NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
654756 | 7b71 | 34580 | cing | 1-original | 1 | unknown | unknown |
# Restraints file 1: vol_all_mix_times.rst &noeexp omega = 600, taurot=3, taumet=0.04, oscale=0.000001948125, id2o=1, emix = 0.090, 0.140, 0.200, 0.260, npeak = 37, 41, 43, 44, -1, ihp(1,1) = 7, jhp(1,1) = 13, aexp(1,1) = 1180, arange(1,1) = 963, ihp(1,2) = 10, jhp(1,2) = 13, aexp(1,2) = 5820, arange(1,2) = 963, ihp(1,3) = 13, jhp(1,3) = 15, aexp(1,3) = 35600, arange(1,3) = 3560, ihp(1,4) = 13, jhp(1,4) = 24, aexp(1,4) = 2220, arange(1,4) = 963, ihp(1,5) = 13, jhp(1,5) = 26, aexp(1,5) = 30400, arange(1,5) = 3040, ihp(1,6) = 10, jhp(1,6) = 26, aexp(1,6) = 5730, arange(1,6) = 963, ihp(1,7) = 15, jhp(1,7) = 26, aexp(1,7) = 1520, arange(1,7) = 963, ihp(1,8) = 13, jhp(1,8) = 27, aexp(1,8) = 4380, arange(1,8) = 963, ihp(1,9) = 37, jhp(1,9) = 40, aexp(1,9) = 7600, arange(1,9) = 963, ihp(1,10) = 24, jhp(1,10) = 43, aexp(1,10) = 1490, arange(1,10) = 963, ihp(1,11) = 26, jhp(1,11) = 43, aexp(1,11) = 5630, arange(1,11) = 963, ihp(1,12) = 27, jhp(1,12) = 43, aexp(1,12) = 6830, arange(1,12) = 963, ihp(1,13) = 40, jhp(1,13) = 43, aexp(1,13) = 3920, arange(1,13) = 963, ihp(1,14) = 40, jhp(1,14) = 52, aexp(1,14) = 951, arange(1,14) = 963, ihp(1,15) = 37, jhp(1,15) = 56, aexp(1,15) = 19000, arange(1,15) = 1900, ihp(1,16) = 40, jhp(1,16) = 56, aexp(1,16) = 3160, arange(1,16) = 963, ihp(1,17) = 43, jhp(1,17) = 56, aexp(1,17) = 2560, arange(1,17) = 963, ihp(1,18) = 40, jhp(1,18) = 58, aexp(1,18) = 13700, arange(1,18) = 1370, ihp(1,19) = 43, jhp(1,19) = 58, aexp(1,19) = 45700, arange(1,19) = 4570, ihp(1,20) = 40, jhp(1,20) = 59, aexp(1,20) = 38800, arange(1,20) = 3880, ihp(1,21) = 43, jhp(1,21) = 59, aexp(1,21) = 12000, arange(1,21) = 1200, ihp(1,22) = 52, jhp(1,22) = 72, aexp(1,22) = 1630, arange(1,22) = 963, ihp(1,23) = 69, jhp(1,23) = 72, aexp(1,23) = 19000, arange(1,23) = 1900, ihp(1,24) = 43, jhp(1,24) = 75, aexp(1,24) = 1100, arange(1,24) = 963, ihp(1,25) = 40, jhp(1,25) = 75, aexp(1,25) = 4800, arange(1,25) = 963, ihp(1,26) = 72, jhp(1,26) = 75, aexp(1,26) = 3610, arange(1,26) = 963, ihp(1,27) = 59, jhp(1,27) = 75, aexp(1,27) = 15100, arange(1,27) = 1510, ihp(1,28) = 58, jhp(1,28) = 75, aexp(1,28) = 5230, arange(1,28) = 963, ihp(1,29) = 43, jhp(1,29) = 77, aexp(1,29) = 2480, arange(1,29) = 963, ihp(1,30) = 75, jhp(1,30) = 77, aexp(1,30) = 41200, arange(1,30) = 4120, ihp(1,31) = 59, jhp(1,31) = 77, aexp(1,31) = 5330, arange(1,31) = 963, ihp(1,32) = 58, jhp(1,32) = 77, aexp(1,32) = 3690, arange(1,32) = 963, ihp(1,33) = 75, jhp(1,33) = 86, aexp(1,33) = 5240, arange(1,33) = 963, ihp(1,34) = 75, jhp(1,34) = 88, aexp(1,34) = 49500, arange(1,34) = 4950, ihp(1,35) = 72, jhp(1,35) = 88, aexp(1,35) = 8850, arange(1,35) = 963, ihp(1,36) = 72, jhp(1,36) = 89, aexp(1,36) = 37000, arange(1,36) = 3700, ihp(1,37) = 75, jhp(1,37) = 89, aexp(1,37) = 9360, arange(1,37) = 963, ihp(2,1) = 7, jhp(2,1) = 13, aexp(2,1) = 2430, arange(2,1) = 727, ihp(2,2) = 10, jhp(2,2) = 13, aexp(2,2) = 7870, arange(2,2) = 787, ihp(2,3) = 13, jhp(2,3) = 15, aexp(2,3) = 50400, arange(2,3) = 5040, ihp(2,4) = 13, jhp(2,4) = 24, aexp(2,4) = 5470, arange(2,4) = 727, ihp(2,5) = 13, jhp(2,5) = 26, aexp(2,5) = 41400, arange(2,5) = 4140, ihp(2,6) = 10, jhp(2,6) = 26, aexp(2,6) = 10600, arange(2,6) = 1060, ihp(2,7) = 15, jhp(2,7) = 26, aexp(2,7) = 3400, arange(2,7) = 727, ihp(2,8) = 13, jhp(2,8) = 27, aexp(2,8) = 7510, arange(2,8) = 751, ihp(2,9) = 37, jhp(2,9) = 40, aexp(2,9) = 12900, arange(2,9) = 1290, ihp(2,10) = 24, jhp(2,10) = 43, aexp(2,10) = 2530, arange(2,10) = 727, ihp(2,11) = 26, jhp(2,11) = 43, aexp(2,11) = 8340, arange(2,11) = 834, ihp(2,12) = 27, jhp(2,12) = 43, aexp(2,12) = 9950, arange(2,12) = 995, ihp(2,13) = 10, jhp(2,13) = 43, aexp(2,13) = 2620, arange(2,13) = 727, ihp(2,14) = 37, jhp(2,14) = 43, aexp(2,14) = 1930, arange(2,14) = 727, ihp(2,15) = 40, jhp(2,15) = 43, aexp(2,15) = 6710, arange(2,15) = 727, ihp(2,16) = 40, jhp(2,16) = 52, aexp(2,16) = 1810, arange(2,16) = 727, ihp(2,17) = 37, jhp(2,17) = 56, aexp(2,17) = 23700, arange(2,17) = 2370, ihp(2,18) = 40, jhp(2,18) = 56, aexp(2,18) = 5400, arange(2,18) = 727, ihp(2,19) = 43, jhp(2,19) = 56, aexp(2,19) = 5900, arange(2,19) = 727, ihp(2,20) = 40, jhp(2,20) = 58, aexp(2,20) = 25100, arange(2,20) = 2510, ihp(2,21) = 43, jhp(2,21) = 58, aexp(2,21) = 56900, arange(2,21) = 5690, ihp(2,22) = 40, jhp(2,22) = 59, aexp(2,22) = 49800, arange(2,22) = 4980, ihp(2,23) = 43, jhp(2,23) = 59, aexp(2,23) = 21000, arange(2,23) = 2100, ihp(2,24) = 52, jhp(2,24) = 72, aexp(2,24) = 2160, arange(2,24) = 727, ihp(2,25) = 69, jhp(2,25) = 72, aexp(2,25) = 28700, arange(2,25) = 2870, ihp(2,26) = 43, jhp(2,26) = 75, aexp(2,26) = 2960, arange(2,26) = 727, ihp(2,27) = 40, jhp(2,27) = 75, aexp(2,27) = 7310, arange(2,27) = 731, ihp(2,28) = 72, jhp(2,28) = 75, aexp(2,28) = 5140, arange(2,28) = 727, ihp(2,29) = 59, jhp(2,29) = 75, aexp(2,29) = 19400, arange(2,29) = 1940, ihp(2,30) = 58, jhp(2,30) = 75, aexp(2,30) = 9690, arange(2,30) = 969, ihp(2,31) = 43, jhp(2,31) = 77, aexp(2,31) = 3590, arange(2,31) = 727, ihp(2,32) = 75, jhp(2,32) = 77, aexp(2,32) = 53900, arange(2,32) = 5390, ihp(2,33) = 59, jhp(2,33) = 77, aexp(2,33) = 7700, arange(2,33) = 770, ihp(2,34) = 58, jhp(2,34) = 77, aexp(2,34) = 6170, arange(2,34) = 727, ihp(2,35) = 40, jhp(2,35) = 77, aexp(2,35) = 3920, arange(2,35) = 727, ihp(2,36) = 75, jhp(2,36) = 86, aexp(2,36) = 6970, arange(2,36) = 727, ihp(2,37) = 75, jhp(2,37) = 88, aexp(2,37) = 62300, arange(2,37) = 6230, ihp(2,38) = 77, jhp(2,38) = 88, aexp(2,38) = 3930, arange(2,38) = 727, ihp(2,39) = 72, jhp(2,39) = 88, aexp(2,39) = 15800, arange(2,39) = 1580, ihp(2,40) = 72, jhp(2,40) = 89, aexp(2,40) = 50000, arange(2,40) = 5000, ihp(2,41) = 75, jhp(2,41) = 89, aexp(2,41) = 16400, arange(2,41) = 1640, ihp(3,1) = 7, jhp(3,1) = 13, aexp(3,1) = 3010, arange(1,1) = 884, ihp(3,2) = 10, jhp(3,2) = 13, aexp(3,2) = 10700, arange(1,2) = 1070, ihp(3,3) = 13, jhp(3,3) = 15, aexp(3,3) = 65700, arange(1,3) = 6570, ihp(3,4) = 13, jhp(3,4) = 24, aexp(3,4) = 9110, arange(1,4) = 911, ihp(3,5) = 13, jhp(3,5) = 26, aexp(3,5) = 51600, arange(1,5) = 5160, ihp(3,6) = 10, jhp(3,6) = 26, aexp(3,6) = 11500, arange(1,6) = 1150, ihp(3,7) = 15, jhp(3,7) = 26, aexp(3,7) = 5000, arange(1,7) = 884, ihp(3,8) = 13, jhp(3,8) = 27, aexp(3,8) = 11600, arange(1,8) = 1160, ihp(3,9) = 37, jhp(3,9) = 40, aexp(3,9) = 13400, arange(1,9) = 1340, ihp(3,10) = 24, jhp(3,10) = 43, aexp(3,10) = 4480, arange(1,10) = 884, ihp(3,11) = 26, jhp(3,11) = 43, aexp(3,11) = 11000, arange(1,11) = 1100, ihp(3,12) = 27, jhp(3,12) = 43, aexp(3,12) = 11800, arange(1,12) = 1180, ihp(3,13) = 10, jhp(3,13) = 43, aexp(3,13) = 3250, arange(1,13) = 884, ihp(3,14) = 37, jhp(3,14) = 43, aexp(3,14) = 1700, arange(1,14) = 884, ihp(3,15) = 40, jhp(3,15) = 43, aexp(3,15) = 9170, arange(1,15) = 917, ihp(3,16) = 40, jhp(3,16) = 52, aexp(3,16) = 2380, arange(1,16) = 884, ihp(3,17) = 37, jhp(3,17) = 56, aexp(3,17) = 32700, arange(1,17) = 3270, ihp(3,18) = 40, jhp(3,18) = 56, aexp(3,18) = 8180, arange(1,18) = 884, ihp(3,19) = 43, jhp(3,19) = 56, aexp(3,19) = 9630, arange(1,19) = 963, ihp(3,20) = 40, jhp(3,20) = 58, aexp(3,20) = 32000, arange(1,20) = 3200, ihp(3,21) = 43, jhp(3,21) = 58, aexp(3,21) = 66100, arange(1,21) = 6610, ihp(3,22) = 40, jhp(3,22) = 59, aexp(3,22) = 58700, arange(1,22) = 5870, ihp(3,23) = 43, jhp(3,23) = 59, aexp(3,23) = 29300, arange(1,23) = 2930, ihp(3,24) = 52, jhp(3,24) = 72, aexp(3,24) = 3120, arange(1,24) = 884, ihp(3,25) = 69, jhp(3,25) = 72, aexp(3,25) = 32900, arange(1,25) = 3290, ihp(3,26) = 43, jhp(3,26) = 75, aexp(3,26) = 3470, arange(1,26) = 884, ihp(3,27) = 40, jhp(3,27) = 75, aexp(3,27) = 10400, arange(1,27) = 1040, ihp(3,28) = 72, jhp(3,28) = 75, aexp(3,28) = 8600, arange(1,28) = 884, ihp(3,29) = 56, jhp(3,29) = 75, aexp(3,29) = 2270, arange(1,29) = 884, ihp(3,30) = 59, jhp(3,30) = 75, aexp(3,30) = 23900, arange(1,30) = 2390, ihp(3,31) = 58, jhp(3,31) = 75, aexp(3,31) = 12200, arange(1,31) = 1220, ihp(3,32) = 43, jhp(3,32) = 77, aexp(3,32) = 5610, arange(1,32) = 884, ihp(3,33) = 75, jhp(3,33) = 77, aexp(3,33) = 66000, arange(1,33) = 6600, ihp(3,34) = 59, jhp(3,34) = 77, aexp(3,34) = 10400, arange(1,34) = 1040, ihp(3,35) = 58, jhp(3,35) = 77, aexp(3,35) = 8900, arange(1,35) = 890, ihp(3,36) = 40, jhp(3,36) = 77, aexp(3,36) = 4570, arange(1,36) = 884, ihp(3,37) = 75, jhp(3,37) = 86, aexp(3,37) = 11900, arange(1,37) = 1190, ihp(3,38) = 75, jhp(3,38) = 88, aexp(3,38) = 70100, arange(1,38) = 7010, ihp(3,39) = 77, jhp(3,39) = 88, aexp(3,39) = 6780, arange(1,39) = 884, ihp(3,40) = 72, jhp(3,40) = 88, aexp(3,40) = 22000, arange(1,40) = 2200, ihp(3,41) = 72, jhp(3,41) = 89, aexp(3,41) = 60100, arange(1,41) = 6010, ihp(3,42) = 75, jhp(3,42) = 89, aexp(3,42) = 23600, arange(1,42) = 2360, ihp(3,43) = 77, jhp(3,43) = 89, aexp(3,43) = 2970, arange(1,43) = 884, ihp(4,1) = 7, jhp(4,1) = 13, aexp(4,1) = 3790, arange(4,1) = 1150, ihp(4,2) = 10, jhp(4,2) = 13, aexp(4,2) = 13100, arange(4,2) = 1310, ihp(4,3) = 13, jhp(4,3) = 15, aexp(4,3) = 77900, arange(4,3) = 7790, ihp(4,4) = 13, jhp(4,4) = 24, aexp(4,4) = 11000, arange(4,4) = 1150, ihp(4,5) = 13, jhp(4,5) = 26, aexp(4,5) = 56200, arange(4,5) = 5620, ihp(4,6) = 10, jhp(4,6) = 26, aexp(4,6) = 15600, arange(4,6) = 1560, ihp(4,7) = 15, jhp(4,7) = 26, aexp(4,7) = 8000, arange(4,7) = 1150, ihp(4,8) = 13, jhp(4,8) = 27, aexp(4,8) = 15700, arange(4,8) = 1570, ihp(4,9) = 37, jhp(4,9) = 40, aexp(4,9) = 17200, arange(4,9) = 1720, ihp(4,10) = 24, jhp(4,10) = 43, aexp(4,10) = 5190, arange(4,10) = 1150, ihp(4,11) = 26, jhp(4,11) = 43, aexp(4,11) = 12600, arange(4,11) = 1260, ihp(4,12) = 27, jhp(4,12) = 43, aexp(4,12) = 14900, arange(4,12) = 1490, ihp(4,13) = 10, jhp(4,13) = 43, aexp(4,13) = 4000, arange(4,13) = 1150, ihp(4,14) = 37, jhp(4,14) = 43, aexp(4,14) = 2080, arange(4,14) = 1150, ihp(4,15) = 40, jhp(4,15) = 43, aexp(4,15) = 13200, arange(4,15) = 1320, ihp(4,16) = 40, jhp(4,16) = 52, aexp(4,16) = 2710, arange(4,16) = 1150, ihp(4,17) = 37, jhp(4,17) = 56, aexp(4,17) = 39500, arange(4,17) = 3950, ihp(4,18) = 40, jhp(4,18) = 56, aexp(4,18) = 11300, arange(4,18) = 1150, ihp(4,19) = 43, jhp(4,19) = 56, aexp(4,19) = 13000, arange(4,19) = 1300, ihp(4,20) = 40, jhp(4,20) = 58, aexp(4,20) = 37900, arange(4,20) = 3790, ihp(4,21) = 43, jhp(4,21) = 58, aexp(4,21) = 73000, arange(4,21) = 7300, ihp(4,22) = 40, jhp(4,22) = 59, aexp(4,22) = 64400, arange(4,22) = 6440, ihp(4,23) = 43, jhp(4,23) = 59, aexp(4,23) = 36100, arange(4,23) = 3610, ihp(4,24) = 52, jhp(4,24) = 72, aexp(4,24) = 3960, arange(4,24) = 1150, ihp(4,25) = 69, jhp(4,25) = 72, aexp(4,25) = 41600, arange(4,25) = 4160, ihp(4,26) = 43, jhp(4,26) = 75, aexp(4,26) = 1980, arange(4,26) = 1150, ihp(4,27) = 40, jhp(4,27) = 75, aexp(4,27) = 11900, arange(4,27) = 1190, ihp(4,28) = 72, jhp(4,28) = 75, aexp(4,28) = 10300, arange(4,28) = 1150, ihp(4,29) = 56, jhp(4,29) = 75, aexp(4,29) = 3620, arange(4,29) = 1150, ihp(4,30) = 59, jhp(4,30) = 75, aexp(4,30) = 25200, arange(4,30) = 2520, ihp(4,31) = 58, jhp(4,31) = 75, aexp(4,31) = 15100, arange(4,31) = 1510, ihp(4,32) = 43, jhp(4,32) = 77, aexp(4,32) = 7430, arange(4,32) = 1150, ihp(4,33) = 75, jhp(4,33) = 77, aexp(4,33) = 75800, arange(4,33) = 7580, ihp(4,34) = 59, jhp(4,34) = 77, aexp(4,34) = 11900, arange(4,34) = 1190, ihp(4,35) = 58, jhp(4,35) = 77, aexp(4,35) = 9610, arange(4,35) = 1150, ihp(4,36) = 40, jhp(4,36) = 77, aexp(4,36) = 5800, arange(4,36) = 1150, ihp(4,37) = 72, jhp(4,37) = 86, aexp(4,37) = 9560, arange(4,37) = 1150, ihp(4,38) = 75, jhp(4,38) = 86, aexp(4,38) = 15100, arange(4,38) = 1510, ihp(4,39) = 75, jhp(4,39) = 88, aexp(4,39) = 73900, arange(4,39) = 7390, ihp(4,40) = 77, jhp(4,40) = 88, aexp(4,40) = 9730, arange(4,40) = 1150, ihp(4,41) = 72, jhp(4,41) = 88, aexp(4,41) = 26600, arange(4,41) = 2660, ihp(4,42) = 72, jhp(4,42) = 89, aexp(4,42) = 68000, arange(4,42) = 6800, ihp(4,43) = 75, jhp(4,43) = 89, aexp(4,43) = 30200, arange(4,43) = 3020, ihp(4,44) = 77, jhp(4,44) = 89, aexp(4,44) = 4050, arange(4,44) = 1150, / SUBM 1 RES 1 2 3 END END &noeexp emix = 0.090, 0.140, 0.200, 0.260, npeak = 29, 36, 38, 38, -1, ihp(1,1) = 99, jhp(1,1) = 102, aexp(1,1) = 8930, arange(1,1) = 963, ihp(1,2) = 88, jhp(1,2) = 105, aexp(1,2) = 5750, arange(1,2) = 963, ihp(1,3) = 89, jhp(1,3) = 105, aexp(1,3) = 6770, arange(1,3) = 963, ihp(1,4) = 72, jhp(1,4) = 105, aexp(1,4) = 2150, arange(1,4) = 963, ihp(1,5) = 86, jhp(1,5) = 105, aexp(1,5) = 1510, arange(1,5) = 963, ihp(1,6) = 102, jhp(1,6) = 105, aexp(1,6) = 2610, arange(1,6) = 963, ihp(1,7) = 105, jhp(1,7) = 119, aexp(1,7) = 2390, arange(1,7) = 963, ihp(1,8) = 105, jhp(1,8) = 121, aexp(1,8) = 34400, arange(1,8) = 3440, ihp(1,9) = 102, jhp(1,9) = 121, aexp(1,9) = 19100, arange(1,9) = 1910, ihp(1,10) = 105, jhp(1,10) = 122, aexp(1,10) = 12100, arange(1,10) = 1210, ihp(1,11) = 102, jhp(1,11) = 138, aexp(1,11) = 5120, arange(1,11) = 963, ihp(1,12) = 121, jhp(1,12) = 138, aexp(1,12) = 8610, arange(1,12) = 963, ihp(1,13) = 122, jhp(1,13) = 138, aexp(1,13) = 16200, arange(1,13) = 1620, ihp(1,14) = 105, jhp(1,14) = 140, aexp(1,14) = 2380, arange(1,14) = 963, ihp(1,15) = 121, jhp(1,15) = 140, aexp(1,15) = 5670, arange(1,15) = 963, ihp(1,16) = 122, jhp(1,16) = 140, aexp(1,16) = 8390, arange(1,16) = 963, ihp(1,17) = 138, jhp(1,17) = 140, aexp(1,17) = 38500, arange(1,17) = 3850, ihp(1,18) = 102, jhp(1,18) = 140, aexp(1,18) = 2930, arange(1,18) = 963, ihp(1,19) = 138, jhp(1,19) = 149, aexp(1,19) = 5660, arange(1,19) = 963, ihp(1,20) = 138, jhp(1,20) = 151, aexp(1,20) = 52900, arange(1,20) = 5290, ihp(1,21) = 135, jhp(1,21) = 151, aexp(1,21) = 14000, arange(1,21) = 1400, ihp(1,22) = 162, jhp(1,22) = 165, aexp(1,22) = 14000, arange(1,22) = 1400, ihp(1,23) = 138, jhp(1,23) = 170, aexp(1,23) = 2700, arange(1,23) = 963, ihp(1,24) = 152, jhp(1,24) = 170, aexp(1,24) = 6380, arange(1,24) = 963, ihp(1,25) = 165, jhp(1,25) = 182, aexp(1,25) = 33100, arange(1,25) = 3310, ihp(1,26) = 168, jhp(1,26) = 182, aexp(1,26) = 13000, arange(1,26) = 1300, ihp(1,27) = 165, jhp(1,27) = 198, aexp(1,27) = 2440, arange(1,27) = 963, ihp(1,28) = 181, jhp(1,28) = 198, aexp(1,28) = 5300, arange(1,28) = 963, ihp(1,29) = 198, jhp(1,29) = 212, aexp(1,29) = 3190, arange(1,29) = 963, ihp(2,1) = 99, jhp(2,1) = 102, aexp(2,1) = 13700, arange(2,1) = 1370, ihp(2,2) = 88, jhp(2,2) = 105, aexp(2,2) = 7920, arange(2,2) = 792, ihp(2,3) = 89, jhp(2,3) = 105, aexp(2,3) = 9710, arange(2,3) = 971, ihp(2,4) = 72, jhp(2,4) = 105, aexp(2,4) = 3600, arange(2,4) = 727, ihp(2,5) = 86, jhp(2,5) = 105, aexp(2,5) = 2330, arange(2,5) = 727, ihp(2,6) = 102, jhp(2,6) = 105, aexp(2,6) = 4670, arange(2,6) = 727, ihp(2,7) = 99, jhp(2,7) = 105, aexp(2,7) = 1130, arange(2,7) = 727, ihp(2,8) = 75, jhp(2,8) = 105, aexp(2,8) = 1570, arange(2,8) = 727, ihp(2,9) = 105, jhp(2,9) = 119, aexp(2,9) = 5120, arange(2,9) = 727, ihp(2,10) = 105, jhp(2,10) = 121, aexp(2,10) = 46900, arange(2,10) = 4690, ihp(2,11) = 102, jhp(2,11) = 121, aexp(2,11) = 25400, arange(2,11) = 2540, ihp(2,12) = 105, jhp(2,12) = 122, aexp(2,12) = 19700, arange(2,12) = 1970, ihp(2,13) = 102, jhp(2,13) = 138, aexp(2,13) = 8350, arange(2,13) = 835, ihp(2,14) = 105, jhp(2,14) = 138, aexp(2,14) = 1220, arange(2,14) = 727, ihp(2,15) = 121, jhp(2,15) = 138, aexp(2,15) = 12900, arange(2,15) = 1290, ihp(2,16) = 122, jhp(2,16) = 138, aexp(2,16) = 22500, arange(2,16) = 2250, ihp(2,17) = 105, jhp(2,17) = 140, aexp(2,17) = 3530, arange(2,17) = 727, ihp(2,18) = 121, jhp(2,18) = 140, aexp(2,18) = 7630, arange(2,18) = 763, ihp(2,19) = 122, jhp(2,19) = 140, aexp(2,19) = 12500, arange(2,19) = 1250, ihp(2,20) = 138, jhp(2,20) = 140, aexp(2,20) = 52800, arange(2,20) = 5280, ihp(2,21) = 102, jhp(2,21) = 140, aexp(2,21) = 3460, arange(2,21) = 727, ihp(2,22) = 138, jhp(2,22) = 149, aexp(2,22) = 7370, arange(2,22) = 737, ihp(2,23) = 138, jhp(2,23) = 151, aexp(2,23) = 64900, arange(2,23) = 6490, ihp(2,24) = 140, jhp(2,24) = 151, aexp(2,24) = 5020, arange(2,24) = 727, ihp(2,25) = 135, jhp(2,25) = 151, aexp(2,25) = 21400, arange(2,25) = 2140, ihp(2,26) = 162, jhp(2,26) = 165, aexp(2,26) = 19900, arange(2,26) = 1990, ihp(2,27) = 138, jhp(2,27) = 170, aexp(2,27) = 4350, arange(2,27) = 727, ihp(2,28) = 152, jhp(2,28) = 170, aexp(2,28) = 8990, arange(2,28) = 899, ihp(2,29) = 135, jhp(2,29) = 170, aexp(2,29) = 3180, arange(2,29) = 727, ihp(2,30) = 168, jhp(2,30) = 179, aexp(2,30) = 9750, arange(2,30) = 975, ihp(2,31) = 165, jhp(2,31) = 182, aexp(2,31) = 47300, arange(2,31) = 4730, ihp(2,32) = 168, jhp(2,32) = 182, aexp(2,32) = 20200, arange(2,32) = 2020, ihp(2,33) = 165, jhp(2,33) = 198, aexp(2,33) = 3340, arange(2,33) = 727, ihp(2,34) = 181, jhp(2,34) = 198, aexp(2,34) = 6660, arange(2,34) = 727, ihp(2,35) = 195, jhp(2,35) = 212, aexp(2,35) = 9350, arange(2,35) = 935, ihp(2,36) = 198, jhp(2,36) = 212, aexp(2,36) = 5130, arange(2,36) = 727, ihp(3,1) = 99, jhp(3,1) = 102, aexp(3,1) = 16700, arange(1,1) = 1670, ihp(3,2) = 88, jhp(3,2) = 105, aexp(3,2) = 9470, arange(1,2) = 947, ihp(3,3) = 89, jhp(3,3) = 105, aexp(3,3) = 12500, arange(1,3) = 1250, ihp(3,4) = 72, jhp(3,4) = 105, aexp(3,4) = 4320, arange(1,4) = 884, ihp(3,5) = 86, jhp(3,5) = 105, aexp(3,5) = 3580, arange(1,5) = 884, ihp(3,6) = 102, jhp(3,6) = 105, aexp(3,6) = 6060, arange(1,6) = 884, ihp(3,7) = 99, jhp(3,7) = 105, aexp(3,7) = 1460, arange(1,7) = 884, ihp(3,8) = 75, jhp(3,8) = 105, aexp(3,8) = 1690, arange(1,8) = 884, ihp(3,9) = 105, jhp(3,9) = 119, aexp(3,9) = 7820, arange(1,9) = 884, ihp(3,10) = 105, jhp(3,10) = 121, aexp(3,10) = 53300, arange(1,10) = 5330, ihp(3,11) = 102, jhp(3,11) = 121, aexp(3,11) = 34100, arange(1,11) = 3410, ihp(3,12) = 105, jhp(3,12) = 122, aexp(3,12) = 26200, arange(1,12) = 2620, ihp(3,13) = 102, jhp(3,13) = 138, aexp(3,13) = 12700, arange(1,13) = 1270, ihp(3,14) = 105, jhp(3,14) = 138, aexp(3,14) = 2250, arange(1,14) = 884, ihp(3,15) = 119, jhp(3,15) = 138, aexp(3,15) = 3240, arange(1,15) = 884, ihp(3,16) = 121, jhp(3,16) = 138, aexp(3,16) = 16500, arange(1,16) = 1650, ihp(3,17) = 122, jhp(3,17) = 138, aexp(3,17) = 25800, arange(1,17) = 2580, ihp(3,18) = 105, jhp(3,18) = 140, aexp(3,18) = 4670, arange(1,18) = 884, ihp(3,19) = 121, jhp(3,19) = 140, aexp(3,19) = 11600, arange(1,19) = 1160, ihp(3,20) = 122, jhp(3,20) = 140, aexp(3,20) = 16500, arange(1,20) = 1650, ihp(3,21) = 138, jhp(3,21) = 140, aexp(3,21) = 62800, arange(1,21) = 6280, ihp(3,22) = 102, jhp(3,22) = 140, aexp(3,22) = 6750, arange(1,22) = 884, ihp(3,23) = 138, jhp(3,23) = 149, aexp(3,23) = 11700, arange(1,23) = 1170, ihp(3,24) = 138, jhp(3,24) = 151, aexp(3,24) = 70900, arange(1,24) = 7090, ihp(3,25) = 140, jhp(3,25) = 151, aexp(3,25) = 7430, arange(1,25) = 884, ihp(3,26) = 135, jhp(3,26) = 151, aexp(3,26) = 29600, arange(1,26) = 2960, ihp(3,27) = 140, jhp(3,27) = 152, aexp(3,27) = 2290, arange(1,27) = 884, ihp(3,28) = 162, jhp(3,28) = 165, aexp(3,28) = 26500, arange(1,28) = 2650, ihp(3,29) = 138, jhp(3,29) = 170, aexp(3,29) = 6420, arange(1,29) = 884, ihp(3,30) = 152, jhp(3,30) = 170, aexp(3,30) = 13600, arange(1,30) = 1360, ihp(3,31) = 135, jhp(3,31) = 170, aexp(3,31) = 6510, arange(1,31) = 884, ihp(3,32) = 168, jhp(3,32) = 179, aexp(3,32) = 13500, arange(1,32) = 1350, ihp(3,33) = 165, jhp(3,33) = 182, aexp(3,33) = 59000, arange(1,33) = 5900, ihp(3,34) = 168, jhp(3,34) = 182, aexp(3,34) = 28900, arange(1,34) = 2890, ihp(3,35) = 165, jhp(3,35) = 198, aexp(3,35) = 4880, arange(1,35) = 884, ihp(3,36) = 181, jhp(3,36) = 198, aexp(3,36) = 9020, arange(1,36) = 902, ihp(3,37) = 195, jhp(3,37) = 212, aexp(3,37) = 12100, arange(1,37) = 1210, ihp(3,38) = 198, jhp(3,38) = 212, aexp(3,38) = 8320, arange(1,38) = 884, ihp(4,1) = 99, jhp(4,1) = 102, aexp(4,1) = 19800, arange(4,1) = 1980, ihp(4,2) = 88, jhp(4,2) = 105, aexp(4,2) = 11300, arange(4,2) = 1150, ihp(4,3) = 89, jhp(4,3) = 105, aexp(4,3) = 15300, arange(4,3) = 1530, ihp(4,4) = 72, jhp(4,4) = 105, aexp(4,4) = 6080, arange(4,4) = 1150, ihp(4,5) = 86, jhp(4,5) = 105, aexp(4,5) = 3940, arange(4,5) = 1150, ihp(4,6) = 102, jhp(4,6) = 105, aexp(4,6) = 9310, arange(4,6) = 1150, ihp(4,7) = 99, jhp(4,7) = 105, aexp(4,7) = 2370, arange(4,7) = 1150, ihp(4,8) = 75, jhp(4,8) = 105, aexp(4,8) = 2060, arange(4,8) = 1150, ihp(4,9) = 105, jhp(4,9) = 119, aexp(4,9) = 10500, arange(4,9) = 1150, ihp(4,10) = 105, jhp(4,10) = 121, aexp(4,10) = 58500, arange(4,10) = 5850, ihp(4,11) = 102, jhp(4,11) = 121, aexp(4,11) = 40800, arange(4,11) = 4080, ihp(4,12) = 105, jhp(4,12) = 122, aexp(4,12) = 29900, arange(4,12) = 2990, ihp(4,13) = 102, jhp(4,13) = 138, aexp(4,13) = 14500, arange(4,13) = 1450, ihp(4,14) = 105, jhp(4,14) = 138, aexp(4,14) = 2530, arange(4,14) = 1150, ihp(4,15) = 119, jhp(4,15) = 138, aexp(4,15) = 3990, arange(4,15) = 1150, ihp(4,16) = 121, jhp(4,16) = 138, aexp(4,16) = 20000, arange(4,16) = 2000, ihp(4,17) = 122, jhp(4,17) = 138, aexp(4,17) = 29200, arange(4,17) = 2920, ihp(4,18) = 105, jhp(4,18) = 140, aexp(4,18) = 6530, arange(4,18) = 1150, ihp(4,19) = 121, jhp(4,19) = 140, aexp(4,19) = 13500, arange(4,19) = 1350, ihp(4,20) = 122, jhp(4,20) = 140, aexp(4,20) = 19300, arange(4,20) = 1930, ihp(4,21) = 138, jhp(4,21) = 140, aexp(4,21) = 72000, arange(4,21) = 7200, ihp(4,22) = 102, jhp(4,22) = 140, aexp(4,22) = 8620, arange(4,22) = 1150, ihp(4,23) = 138, jhp(4,23) = 149, aexp(4,23) = 14500, arange(4,23) = 1450, ihp(4,24) = 138, jhp(4,24) = 151, aexp(4,24) = 76300, arange(4,24) = 7630, ihp(4,25) = 140, jhp(4,25) = 151, aexp(4,25) = 9430, arange(4,25) = 1150, ihp(4,26) = 135, jhp(4,26) = 151, aexp(4,26) = 37800, arange(4,26) = 3780, ihp(4,27) = 140, jhp(4,27) = 152, aexp(4,27) = 4060, arange(4,27) = 1150, ihp(4,28) = 162, jhp(4,28) = 165, aexp(4,28) = 31200, arange(4,28) = 3120, ihp(4,29) = 138, jhp(4,29) = 170, aexp(4,29) = 8320, arange(4,29) = 1150, ihp(4,30) = 152, jhp(4,30) = 170, aexp(4,30) = 16300, arange(4,30) = 1630, ihp(4,31) = 135, jhp(4,31) = 170, aexp(4,31) = 7650, arange(4,31) = 1150, ihp(4,32) = 168, jhp(4,32) = 179, aexp(4,32) = 16000, arange(4,32) = 1600, ihp(4,33) = 165, jhp(4,33) = 182, aexp(4,33) = 65200, arange(4,33) = 6520, ihp(4,34) = 168, jhp(4,34) = 182, aexp(4,34) = 35200, arange(4,34) = 3520, ihp(4,35) = 165, jhp(4,35) = 198, aexp(4,35) = 6340, arange(4,35) = 1150, ihp(4,36) = 181, jhp(4,36) = 198, aexp(4,36) = 10300, arange(4,36) = 1150, ihp(4,37) = 195, jhp(4,37) = 212, aexp(4,37) = 14500, arange(4,37) = 1450, ihp(4,38) = 198, jhp(4,38) = 212, aexp(4,38) = 11100, arange(4,38) = 1150, / SUBM 2 RES 3 4 5 6 7 END END &noeexp npeak = 38, 40, 42, 43, -1, ihp(1,1) = 215, jhp(1,1) = 231, aexp(1,1) = 19800, arange(1,1) = 1980, ihp(1,2) = 214, jhp(1,2) = 231, aexp(1,2) = 10200, arange(1,2) = 1020, ihp(1,3) = 225, jhp(1,3) = 231, aexp(1,3) = 2950, arange(1,3) = 963, ihp(1,4) = 198, jhp(1,4) = 233, aexp(1,4) = 3080, arange(1,4) = 963, ihp(1,5) = 214, jhp(1,5) = 233, aexp(1,5) = 5720, arange(1,5) = 963, ihp(1,6) = 215, jhp(1,6) = 233, aexp(1,6) = 8290, arange(1,6) = 963, ihp(1,7) = 231, jhp(1,7) = 233, aexp(1,7) = 40000, arange(1,7) = 4000, ihp(1,8) = 195, jhp(1,8) = 233, aexp(1,8) = 3940, arange(1,8) = 963, ihp(1,9) = 231, jhp(1,9) = 242, aexp(1,9) = 3720, arange(1,9) = 963, ihp(1,10) = 231, jhp(1,10) = 244, aexp(1,10) = 39000, arange(1,10) = 3900, ihp(1,11) = 228, jhp(1,11) = 244, aexp(1,11) = 13300, arange(1,11) = 1330, ihp(1,12) = 258, jhp(1,12) = 261, aexp(1,12) = 5030, arange(1,12) = 963, ihp(1,13) = 255, jhp(1,13) = 261, aexp(1,13) = 2980, arange(1,13) = 963, ihp(1,14) = 258, jhp(1,14) = 274, aexp(1,14) = 2680, arange(1,14) = 963, ihp(1,15) = 261, jhp(1,15) = 274, aexp(1,15) = 6500, arange(1,15) = 963, ihp(1,16) = 261, jhp(1,16) = 276, aexp(1,16) = 71900, arange(1,16) = 7190, ihp(1,17) = 258, jhp(1,17) = 276, aexp(1,17) = 13300, arange(1,17) = 1330, ihp(1,18) = 261, jhp(1,18) = 277, aexp(1,18) = 12000, arange(1,18) = 1200, ihp(1,19) = 258, jhp(1,19) = 277, aexp(1,19) = 45600, arange(1,19) = 4560, ihp(1,20) = 287, jhp(1,20) = 290, aexp(1,20) = 8340, arange(1,20) = 963, ihp(1,21) = 276, jhp(1,21) = 293, aexp(1,21) = 3330, arange(1,21) = 963, ihp(1,22) = 290, jhp(1,22) = 293, aexp(1,22) = 1750, arange(1,22) = 963, ihp(1,23) = 258, jhp(1,23) = 293, aexp(1,23) = 790, arange(1,23) = 963, ihp(1,24) = 287, jhp(1,24) = 293, aexp(1,24) = 410, arange(1,24) = 963, ihp(1,25) = 293, jhp(1,25) = 307, aexp(1,25) = 3440, arange(1,25) = 963, ihp(1,26) = 290, jhp(1,26) = 307, aexp(1,26) = 1680, arange(1,26) = 963, ihp(1,27) = 293, jhp(1,27) = 309, aexp(1,27) = 27000, arange(1,27) = 2700, ihp(1,28) = 290, jhp(1,28) = 309, aexp(1,28) = 11500, arange(1,28) = 1150, ihp(1,29) = 290, jhp(1,29) = 310, aexp(1,29) = 43800, arange(1,29) = 4380, ihp(1,30) = 319, jhp(1,30) = 325, aexp(1,30) = 1630, arange(1,30) = 963, ihp(1,31) = 322, jhp(1,31) = 325, aexp(1,31) = 6110, arange(1,31) = 963, ihp(1,32) = 325, jhp(1,32) = 327, aexp(1,32) = 34600, arange(1,32) = 3460, ihp(1,33) = 325, jhp(1,33) = 336, aexp(1,33) = 2270, arange(1,33) = 963, ihp(1,34) = 325, jhp(1,34) = 338, aexp(1,34) = 30100, arange(1,34) = 3010, ihp(1,35) = 322, jhp(1,35) = 338, aexp(1,35) = 5280, arange(1,35) = 963, ihp(1,36) = 327, jhp(1,36) = 338, aexp(1,36) = 3000, arange(1,36) = 963, ihp(1,37) = 325, jhp(1,37) = 339, aexp(1,37) = 4070, arange(1,37) = 963, ihp(1,38) = 322, jhp(1,38) = 339, aexp(1,38) = 26600, arange(1,38) = 2660, ihp(2,1) = 215, jhp(2,1) = 231, aexp(2,1) = 25100, arange(2,1) = 2510, ihp(2,2) = 214, jhp(2,2) = 231, aexp(2,2) = 14500, arange(2,2) = 1450, ihp(2,3) = 225, jhp(2,3) = 231, aexp(2,3) = 3090, arange(2,3) = 727, ihp(2,4) = 198, jhp(2,4) = 233, aexp(2,4) = 4870, arange(2,4) = 727, ihp(2,5) = 214, jhp(2,5) = 233, aexp(2,5) = 7920, arange(2,5) = 792, ihp(2,6) = 215, jhp(2,6) = 233, aexp(2,6) = 11500, arange(2,6) = 1150, ihp(2,7) = 231, jhp(2,7) = 233, aexp(2,7) = 52400, arange(2,7) = 5240, ihp(2,8) = 195, jhp(2,8) = 233, aexp(2,8) = 4320, arange(2,8) = 727, ihp(2,9) = 231, jhp(2,9) = 242, aexp(2,9) = 7170, arange(2,9) = 727, ihp(2,10) = 231, jhp(2,10) = 244, aexp(2,10) = 51000, arange(2,10) = 5100, ihp(2,11) = 233, jhp(2,11) = 244, aexp(2,11) = 4370, arange(2,11) = 727, ihp(2,12) = 228, jhp(2,12) = 244, aexp(2,12) = 21000, arange(2,12) = 2100, ihp(2,13) = 258, jhp(2,13) = 261, aexp(2,13) = 7460, arange(2,13) = 746, ihp(2,14) = 255, jhp(2,14) = 261, aexp(2,14) = 3910, arange(2,14) = 727, ihp(2,15) = 258, jhp(2,15) = 274, aexp(2,15) = 4810, arange(2,15) = 727, ihp(2,16) = 261, jhp(2,16) = 274, aexp(2,16) = 9740, arange(2,16) = 974, ihp(2,17) = 261, jhp(2,17) = 276, aexp(2,17) = 87400, arange(2,17) = 8740, ihp(2,18) = 258, jhp(2,18) = 276, aexp(2,18) = 20800, arange(2,18) = 2080, ihp(2,19) = 261, jhp(2,19) = 277, aexp(2,19) = 19700, arange(2,19) = 1970, ihp(2,20) = 258, jhp(2,20) = 277, aexp(2,20) = 60000, arange(2,20) = 6000, ihp(2,21) = 287, jhp(2,21) = 290, aexp(2,21) = 12600, arange(2,21) = 1260, ihp(2,22) = 276, jhp(2,22) = 293, aexp(2,22) = 4580, arange(2,22) = 727, ihp(2,23) = 290, jhp(2,23) = 293, aexp(2,23) = 3760, arange(2,23) = 727, ihp(2,24) = 258, jhp(2,24) = 293, aexp(2,24) = 1560, arange(2,24) = 727, ihp(2,25) = 274, jhp(2,25) = 293, aexp(2,25) = 1480, arange(2,25) = 727, ihp(2,26) = 287, jhp(2,26) = 293, aexp(2,26) = 963, arange(2,26) = 727, ihp(2,27) = 293, jhp(2,27) = 307, aexp(2,27) = 5820, arange(2,27) = 727, ihp(2,28) = 290, jhp(2,28) = 307, aexp(2,28) = 3280, arange(2,28) = 727, ihp(2,29) = 293, jhp(2,29) = 309, aexp(2,29) = 36700, arange(2,29) = 3670, ihp(2,30) = 290, jhp(2,30) = 309, aexp(2,30) = 19500, arange(2,30) = 1950, ihp(2,31) = 290, jhp(2,31) = 310, aexp(2,31) = 59100, arange(2,31) = 5910, ihp(2,32) = 319, jhp(2,32) = 325, aexp(2,32) = 2040, arange(2,32) = 727, ihp(2,33) = 322, jhp(2,33) = 325, aexp(2,33) = 9290, arange(2,33) = 929, ihp(2,34) = 325, jhp(2,34) = 327, aexp(2,34) = 50500, arange(2,34) = 5050, ihp(2,35) = 325, jhp(2,35) = 336, aexp(2,35) = 4540, arange(2,35) = 727, ihp(2,36) = 325, jhp(2,36) = 338, aexp(2,36) = 41100, arange(2,36) = 4110, ihp(2,37) = 322, jhp(2,37) = 338, aexp(2,37) = 10400, arange(2,37) = 1040, ihp(2,38) = 327, jhp(2,38) = 338, aexp(2,38) = 4000, arange(2,38) = 727, ihp(2,39) = 325, jhp(2,39) = 339, aexp(2,39) = 7520, arange(2,39) = 752, ihp(2,40) = 322, jhp(2,40) = 339, aexp(2,40) = 36300, arange(2,40) = 3630, ihp(3,1) = 215, jhp(3,1) = 231, aexp(3,1) = 28100, arange(1,1) = 2810, ihp(3,2) = 214, jhp(3,2) = 231, aexp(3,2) = 20100, arange(1,2) = 2010, ihp(3,3) = 212, jhp(3,3) = 231, aexp(3,3) = 3900, arange(1,3) = 884, ihp(3,4) = 225, jhp(3,4) = 231, aexp(3,4) = 3760, arange(1,4) = 884, ihp(3,5) = 198, jhp(3,5) = 233, aexp(3,5) = 5530, arange(1,5) = 884, ihp(3,6) = 214, jhp(3,6) = 233, aexp(3,6) = 12300, arange(1,6) = 1230, ihp(3,7) = 215, jhp(3,7) = 233, aexp(3,7) = 14800, arange(1,7) = 1480, ihp(3,8) = 231, jhp(3,8) = 233, aexp(3,8) = 64700, arange(1,8) = 6470, ihp(3,9) = 195, jhp(3,9) = 233, aexp(3,9) = 7150, arange(1,9) = 884, ihp(3,10) = 231, jhp(3,10) = 242, aexp(3,10) = 11300, arange(1,10) = 1130, ihp(3,11) = 231, jhp(3,11) = 244, aexp(3,11) = 60500, arange(1,11) = 6050, ihp(3,12) = 233, jhp(3,12) = 244, aexp(3,12) = 7130, arange(1,12) = 884, ihp(3,13) = 228, jhp(3,13) = 244, aexp(3,13) = 28900, arange(1,13) = 2890, ihp(3,14) = 233, jhp(3,14) = 245, aexp(3,14) = 1690, arange(1,14) = 884, ihp(3,15) = 258, jhp(3,15) = 261, aexp(3,15) = 9910, arange(1,15) = 991, ihp(3,16) = 255, jhp(3,16) = 261, aexp(3,16) = 5940, arange(1,16) = 884, ihp(3,17) = 258, jhp(3,17) = 274, aexp(3,17) = 8370, arange(1,17) = 884, ihp(3,18) = 261, jhp(3,18) = 274, aexp(3,18) = 13700, arange(1,18) = 1370, ihp(3,19) = 261, jhp(3,19) = 276, aexp(3,19) = 98500, arange(1,19) = 9850, ihp(3,20) = 258, jhp(3,20) = 276, aexp(3,20) = 30200, arange(1,20) = 3020, ihp(3,21) = 261, jhp(3,21) = 277, aexp(3,21) = 28700, arange(1,21) = 2870, ihp(3,22) = 258, jhp(3,22) = 277, aexp(3,22) = 72100, arange(1,22) = 7210, ihp(3,23) = 287, jhp(3,23) = 290, aexp(3,23) = 16100, arange(1,23) = 1610, ihp(3,24) = 276, jhp(3,24) = 293, aexp(3,24) = 6770, arange(1,24) = 884, ihp(3,25) = 290, jhp(3,25) = 293, aexp(3,25) = 5180, arange(1,25) = 884, ihp(3,26) = 258, jhp(3,26) = 293, aexp(3,26) = 2140, arange(1,26) = 884, ihp(3,27) = 274, jhp(3,27) = 293, aexp(3,27) = 1800, arange(1,27) = 884, ihp(3,28) = 287, jhp(3,28) = 293, aexp(3,28) = 1380, arange(1,28) = 884, ihp(3,29) = 293, jhp(3,29) = 307, aexp(3,29) = 8450, arange(1,29) = 884, ihp(3,30) = 290, jhp(3,30) = 307, aexp(3,30) = 8150, arange(1,30) = 884, ihp(3,31) = 293, jhp(3,31) = 309, aexp(3,31) = 46100, arange(1,31) = 4610, ihp(3,32) = 290, jhp(3,32) = 309, aexp(3,32) = 26800, arange(1,32) = 2680, ihp(3,33) = 290, jhp(3,33) = 310, aexp(3,33) = 73800, arange(1,33) = 7380, ihp(3,34) = 319, jhp(3,34) = 325, aexp(3,34) = 3600, arange(1,34) = 884, ihp(3,35) = 322, jhp(3,35) = 325, aexp(3,35) = 13400, arange(1,35) = 1340, ihp(3,36) = 325, jhp(3,36) = 327, aexp(3,36) = 65000, arange(1,36) = 6500, ihp(3,37) = 325, jhp(3,37) = 336, aexp(3,37) = 8800, arange(1,37) = 884, ihp(3,38) = 325, jhp(3,38) = 338, aexp(3,38) = 49100, arange(1,38) = 4910, ihp(3,39) = 322, jhp(3,39) = 338, aexp(3,39) = 14500, arange(1,39) = 1450, ihp(3,40) = 327, jhp(3,40) = 338, aexp(3,40) = 6600, arange(1,40) = 884, ihp(3,41) = 325, jhp(3,41) = 339, aexp(3,41) = 11500, arange(1,41) = 1150, ihp(3,42) = 322, jhp(3,42) = 339, aexp(3,42) = 45700, arange(1,42) = 4570, ihp(4,1) = 215, jhp(4,1) = 231, aexp(4,1) = 31000, arange(4,1) = 3100, ihp(4,2) = 214, jhp(4,2) = 231, aexp(4,2) = 23500, arange(4,2) = 2350, ihp(4,3) = 212, jhp(4,3) = 231, aexp(4,3) = 4600, arange(4,3) = 1150, ihp(4,4) = 225, jhp(4,4) = 231, aexp(4,4) = 5520, arange(4,4) = 1150, ihp(4,5) = 198, jhp(4,5) = 233, aexp(4,5) = 8100, arange(4,5) = 1150, ihp(4,6) = 214, jhp(4,6) = 233, aexp(4,6) = 14600, arange(4,6) = 1460, ihp(4,7) = 215, jhp(4,7) = 233, aexp(4,7) = 18000, arange(4,7) = 1800, ihp(4,8) = 231, jhp(4,8) = 233, aexp(4,8) = 71800, arange(4,8) = 7180, ihp(4,9) = 195, jhp(4,9) = 233, aexp(4,9) = 10200, arange(4,9) = 1150, ihp(4,10) = 231, jhp(4,10) = 242, aexp(4,10) = 13200, arange(4,10) = 1320, ihp(4,11) = 231, jhp(4,11) = 244, aexp(4,11) = 61800, arange(4,11) = 6180, ihp(4,12) = 233, jhp(4,12) = 244, aexp(4,12) = 8650, arange(4,12) = 1150, ihp(4,13) = 228, jhp(4,13) = 244, aexp(4,13) = 37900, arange(4,13) = 3790, ihp(4,14) = 233, jhp(4,14) = 245, aexp(4,14) = 2620, arange(4,14) = 1150, ihp(4,15) = 258, jhp(4,15) = 261, aexp(4,15) = 13300, arange(4,15) = 1330, ihp(4,16) = 255, jhp(4,16) = 261, aexp(4,16) = 7320, arange(4,16) = 1150, ihp(4,17) = 258, jhp(4,17) = 274, aexp(4,17) = 10800, arange(4,17) = 1150, ihp(4,18) = 261, jhp(4,18) = 274, aexp(4,18) = 17100, arange(4,18) = 1710, ihp(4,19) = 261, jhp(4,19) = 276, aexp(4,19) = 109000, arange(4,19) = 10900, ihp(4,20) = 258, jhp(4,20) = 276, aexp(4,20) = 37900, arange(4,20) = 3790, ihp(4,21) = 261, jhp(4,21) = 277, aexp(4,21) = 36200, arange(4,21) = 3620, ihp(4,22) = 258, jhp(4,22) = 277, aexp(4,22) = 82900, arange(4,22) = 8290, ihp(4,23) = 287, jhp(4,23) = 290, aexp(4,23) = 18600, arange(4,23) = 1860, ihp(4,24) = 261, jhp(4,24) = 293, aexp(4,24) = 2220, arange(4,24) = 1150, ihp(4,25) = 276, jhp(4,25) = 293, aexp(4,25) = 7610, arange(4,25) = 1150, ihp(4,26) = 290, jhp(4,26) = 293, aexp(4,26) = 7220, arange(4,26) = 1150, ihp(4,27) = 258, jhp(4,27) = 293, aexp(4,27) = 3290, arange(4,27) = 1150, ihp(4,28) = 274, jhp(4,28) = 293, aexp(4,28) = 2520, arange(4,28) = 1150, ihp(4,29) = 287, jhp(4,29) = 293, aexp(4,29) = 1880, arange(4,29) = 1150, ihp(4,30) = 293, jhp(4,30) = 307, aexp(4,30) = 10800, arange(4,30) = 1150, ihp(4,31) = 290, jhp(4,31) = 307, aexp(4,31) = 7960, arange(4,31) = 1150, ihp(4,32) = 293, jhp(4,32) = 309, aexp(4,32) = 51400, arange(4,32) = 5140, ihp(4,33) = 290, jhp(4,33) = 309, aexp(4,33) = 34500, arange(4,33) = 3450, ihp(4,34) = 290, jhp(4,34) = 310, aexp(4,34) = 85400, arange(4,34) = 8540, ihp(4,35) = 319, jhp(4,35) = 325, aexp(4,35) = 4160, arange(4,35) = 1150, ihp(4,36) = 322, jhp(4,36) = 325, aexp(4,36) = 15800, arange(4,36) = 1580, ihp(4,37) = 325, jhp(4,37) = 327, aexp(4,37) = 75800, arange(4,37) = 7580, ihp(4,38) = 325, jhp(4,38) = 336, aexp(4,38) = 10700, arange(4,38) = 1150, ihp(4,39) = 325, jhp(4,39) = 338, aexp(4,39) = 55900, arange(4,39) = 5590, ihp(4,40) = 322, jhp(4,40) = 338, aexp(4,40) = 17600, arange(4,40) = 1760, ihp(4,41) = 327, jhp(4,41) = 338, aexp(4,41) = 9000, arange(4,41) = 1150, ihp(4,42) = 325, jhp(4,42) = 339, aexp(4,42) = 14700, arange(4,42) = 1470, ihp(4,43) = 322, jhp(4,43) = 339, aexp(4,43) = 53200, arange(4,43) = 5320, / SUBM 3 RES 7 8 9 10 11 END END &noeexp emix = 0.090, 0.140, 0.200, 0.260, npeak = 57, 63, 67, 70, -1, ihp(1,1) = 349, jhp(1,1) = 352, aexp(1,1) = 6920, arange(1,1) = 963, ihp(1,2) = 336, jhp(1,2) = 355, aexp(1,2) = 1580, arange(1,2) = 963, ihp(1,3) = 338, jhp(1,3) = 355, aexp(1,3) = 4900, arange(1,3) = 963, ihp(1,4) = 339, jhp(1,4) = 355, aexp(1,4) = 6290, arange(1,4) = 963, ihp(1,5) = 352, jhp(1,5) = 355, aexp(1,5) = 3460, arange(1,5) = 963, ihp(1,6) = 352, jhp(1,6) = 364, aexp(1,6) = 1020, arange(1,6) = 963, ihp(1,7) = 349, jhp(1,7) = 368, aexp(1,7) = 18800, arange(1,7) = 1880, ihp(1,8) = 352, jhp(1,8) = 368, aexp(1,8) = 3700, arange(1,8) = 963, ihp(1,9) = 355, jhp(1,9) = 368, aexp(1,9) = 3470, arange(1,9) = 963, ihp(1,10) = 352, jhp(1,10) = 370, aexp(1,10) = 13700, arange(1,10) = 1370, ihp(1,11) = 355, jhp(1,11) = 370, aexp(1,11) = 47400, arange(1,11) = 4740, ihp(1,12) = 352, jhp(1,12) = 371, aexp(1,12) = 37000, arange(1,12) = 3700, ihp(1,13) = 355, jhp(1,13) = 371, aexp(1,13) = 13000, arange(1,13) = 1300, ihp(1,14) = 381, jhp(1,14) = 384, aexp(1,14) = 12300, arange(1,14) = 1230, ihp(1,15) = 364, jhp(1,15) = 384, aexp(1,15) = 541, arange(1,15) = 963, ihp(1,16) = 352, jhp(1,16) = 387, aexp(1,16) = 2900, arange(1,16) = 963, ihp(1,17) = 371, jhp(1,17) = 387, aexp(1,17) = 10300, arange(1,17) = 1030, ihp(1,18) = 370, jhp(1,18) = 387, aexp(1,18) = 3860, arange(1,18) = 963, ihp(1,19) = 384, jhp(1,19) = 387, aexp(1,19) = 1690, arange(1,19) = 963, ihp(1,20) = 368, jhp(1,20) = 387, aexp(1,20) = 744, arange(1,20) = 963, ihp(1,21) = 384, jhp(1,21) = 401, aexp(1,21) = 4730, arange(1,21) = 963, ihp(1,22) = 387, jhp(1,22) = 401, aexp(1,22) = 2380, arange(1,22) = 963, ihp(1,23) = 384, jhp(1,23) = 403, aexp(1,23) = 15600, arange(1,23) = 1560, ihp(1,24) = 387, jhp(1,24) = 403, aexp(1,24) = 27400, arange(1,24) = 2740, ihp(1,25) = 384, jhp(1,25) = 404, aexp(1,25) = 38100, arange(1,25) = 3810, ihp(1,26) = 387, jhp(1,26) = 404, aexp(1,26) = 10000, arange(1,26) = 1000, ihp(1,27) = 381, jhp(1,27) = 404, aexp(1,27) = 2860, arange(1,27) = 963, ihp(1,28) = 384, jhp(1,28) = 420, aexp(1,28) = 6170, arange(1,28) = 963, ihp(1,29) = 387, jhp(1,29) = 420, aexp(1,29) = 271, arange(1,29) = 963, ihp(1,30) = 417, jhp(1,30) = 420, aexp(1,30) = 4430, arange(1,30) = 963, ihp(1,31) = 404, jhp(1,31) = 420, aexp(1,31) = 16100, arange(1,31) = 1610, ihp(1,32) = 403, jhp(1,32) = 420, aexp(1,32) = 5910, arange(1,32) = 963, ihp(1,33) = 384, jhp(1,33) = 422, aexp(1,33) = 3300, arange(1,33) = 963, ihp(1,34) = 387, jhp(1,34) = 422, aexp(1,34) = 2390, arange(1,34) = 963, ihp(1,35) = 403, jhp(1,35) = 422, aexp(1,35) = 4930, arange(1,35) = 963, ihp(1,36) = 404, jhp(1,36) = 422, aexp(1,36) = 9580, arange(1,36) = 963, ihp(1,37) = 420, jhp(1,37) = 422, aexp(1,37) = 38100, arange(1,37) = 3810, ihp(1,38) = 420, jhp(1,38) = 431, aexp(1,38) = 5920, arange(1,38) = 963, ihp(1,39) = 420, jhp(1,39) = 433, aexp(1,39) = 45300, arange(1,39) = 4530, ihp(1,40) = 417, jhp(1,40) = 433, aexp(1,40) = 11100, arange(1,40) = 1110, ihp(1,41) = 422, jhp(1,41) = 433, aexp(1,41) = 2960, arange(1,41) = 963, ihp(1,42) = 417, jhp(1,42) = 434, aexp(1,42) = 35200, arange(1,42) = 3520, ihp(1,43) = 420, jhp(1,43) = 434, aexp(1,43) = 7440, arange(1,43) = 963, ihp(1,44) = 444, jhp(1,44) = 447, aexp(1,44) = 9990, arange(1,44) = 999, ihp(1,45) = 433, jhp(1,45) = 450, aexp(1,45) = 7690, arange(1,45) = 963, ihp(1,46) = 434, jhp(1,46) = 450, aexp(1,46) = 8780, arange(1,46) = 963, ihp(1,47) = 431, jhp(1,47) = 450, aexp(1,47) = 1870, arange(1,47) = 963, ihp(1,48) = 447, jhp(1,48) = 450, aexp(1,48) = 2420, arange(1,48) = 963, ihp(1,49) = 417, jhp(1,49) = 450, aexp(1,49) = 1200, arange(1,49) = 963, ihp(1,50) = 444, jhp(1,50) = 464, aexp(1,50) = 22100, arange(1,50) = 2210, ihp(1,51) = 450, jhp(1,51) = 464, aexp(1,51) = 2840, arange(1,51) = 963, ihp(1,52) = 450, jhp(1,52) = 466, aexp(1,52) = 40200, arange(1,52) = 4020, ihp(1,53) = 447, jhp(1,53) = 466, aexp(1,53) = 15200, arange(1,53) = 1520, ihp(1,54) = 444, jhp(1,54) = 466, aexp(1,54) = 2770, arange(1,54) = 963, ihp(1,55) = 450, jhp(1,55) = 467, aexp(1,55) = 14600, arange(1,55) = 1460, ihp(1,56) = 447, jhp(1,56) = 467, aexp(1,56) = 37700, arange(1,56) = 3770, ihp(1,57) = 444, jhp(1,57) = 467, aexp(1,57) = 2720, arange(1,57) = 963, ihp(2,1) = 349, jhp(2,1) = 352, aexp(2,1) = 10300, arange(2,1) = 1030, ihp(2,2) = 336, jhp(2,2) = 355, aexp(2,2) = 3080, arange(2,2) = 727, ihp(2,3) = 338, jhp(2,3) = 355, aexp(2,3) = 8040, arange(2,3) = 804, ihp(2,4) = 339, jhp(2,4) = 355, aexp(2,4) = 8090, arange(2,4) = 809, ihp(2,5) = 349, jhp(2,5) = 355, aexp(2,5) = 1290, arange(2,5) = 727, ihp(2,6) = 322, jhp(2,6) = 355, aexp(2,6) = 1520, arange(2,6) = 727, ihp(2,7) = 352, jhp(2,7) = 355, aexp(2,7) = 5990, arange(2,7) = 727, ihp(2,8) = 258, jhp(2,8) = 364, aexp(2,8) = 784, arange(2,8) = 727, ihp(2,9) = 290, jhp(2,9) = 364, aexp(2,9) = 675, arange(2,9) = 727, ihp(2,10) = 352, jhp(2,10) = 364, aexp(2,10) = 2380, arange(2,10) = 727, ihp(2,11) = 349, jhp(2,11) = 368, aexp(2,11) = 28700, arange(2,11) = 2870, ihp(2,12) = 352, jhp(2,12) = 368, aexp(2,12) = 5960, arange(2,12) = 727, ihp(2,13) = 355, jhp(2,13) = 368, aexp(2,13) = 5980, arange(2,13) = 727, ihp(2,14) = 352, jhp(2,14) = 370, aexp(2,14) = 23900, arange(2,14) = 2390, ihp(2,15) = 355, jhp(2,15) = 370, aexp(2,15) = 61000, arange(2,15) = 6100, ihp(2,16) = 352, jhp(2,16) = 371, aexp(2,16) = 50200, arange(2,16) = 5020, ihp(2,17) = 355, jhp(2,17) = 371, aexp(2,17) = 20500, arange(2,17) = 2050, ihp(2,18) = 381, jhp(2,18) = 384, aexp(2,18) = 17700, arange(2,18) = 1770, ihp(2,19) = 364, jhp(2,19) = 384, aexp(2,19) = 958, arange(2,19) = 727, ihp(2,20) = 352, jhp(2,20) = 387, aexp(2,20) = 5090, arange(2,20) = 727, ihp(2,21) = 371, jhp(2,21) = 387, aexp(2,21) = 13300, arange(2,21) = 1330, ihp(2,22) = 370, jhp(2,22) = 387, aexp(2,22) = 5620, arange(2,22) = 727, ihp(2,23) = 384, jhp(2,23) = 387, aexp(2,23) = 4110, arange(2,23) = 727, ihp(2,24) = 368, jhp(2,24) = 387, aexp(2,24) = 1230, arange(2,24) = 727, ihp(2,25) = 384, jhp(2,25) = 401, aexp(2,25) = 10300, arange(2,25) = 1030, ihp(2,26) = 387, jhp(2,26) = 401, aexp(2,26) = 4870, arange(2,26) = 727, ihp(2,27) = 384, jhp(2,27) = 403, aexp(2,27) = 22500, arange(2,27) = 2250, ihp(2,28) = 387, jhp(2,28) = 403, aexp(2,28) = 34800, arange(2,28) = 3480, ihp(2,29) = 384, jhp(2,29) = 404, aexp(2,29) = 48600, arange(2,29) = 4860, ihp(2,30) = 387, jhp(2,30) = 404, aexp(2,30) = 16200, arange(2,30) = 1620, ihp(2,31) = 381, jhp(2,31) = 404, aexp(2,31) = 5330, arange(2,31) = 727, ihp(2,32) = 384, jhp(2,32) = 420, aexp(2,32) = 8900, arange(2,32) = 890, ihp(2,33) = 387, jhp(2,33) = 420, aexp(2,33) = 642, arange(2,33) = 727, ihp(2,34) = 417, jhp(2,34) = 420, aexp(2,34) = 5990, arange(2,34) = 727, ihp(2,35) = 404, jhp(2,35) = 420, aexp(2,35) = 20100, arange(2,35) = 2010, ihp(2,36) = 403, jhp(2,36) = 420, aexp(2,36) = 8980, arange(2,36) = 898, ihp(2,37) = 401, jhp(2,37) = 420, aexp(2,37) = 2480, arange(2,37) = 727, ihp(2,38) = 384, jhp(2,38) = 422, aexp(2,38) = 7840, arange(2,38) = 784, ihp(2,39) = 387, jhp(2,39) = 422, aexp(2,39) = 3200, arange(2,39) = 727, ihp(2,40) = 403, jhp(2,40) = 422, aexp(2,40) = 7640, arange(2,40) = 764, ihp(2,41) = 404, jhp(2,41) = 422, aexp(2,41) = 12100, arange(2,41) = 1210, ihp(2,42) = 420, jhp(2,42) = 422, aexp(2,42) = 54200, arange(2,42) = 5420, ihp(2,43) = 420, jhp(2,43) = 431, aexp(2,43) = 7090, arange(2,43) = 727, ihp(2,44) = 420, jhp(2,44) = 433, aexp(2,44) = 58000, arange(2,44) = 5800, ihp(2,45) = 417, jhp(2,45) = 433, aexp(2,45) = 18100, arange(2,45) = 1810, ihp(2,46) = 422, jhp(2,46) = 433, aexp(2,46) = 4490, arange(2,46) = 727, ihp(2,47) = 417, jhp(2,47) = 434, aexp(2,47) = 48000, arange(2,47) = 4800, ihp(2,48) = 420, jhp(2,48) = 434, aexp(2,48) = 13900, arange(2,48) = 1390, ihp(2,49) = 444, jhp(2,49) = 447, aexp(2,49) = 14300, arange(2,49) = 1430, ihp(2,50) = 433, jhp(2,50) = 450, aexp(2,50) = 10700, arange(2,50) = 1070, ihp(2,51) = 434, jhp(2,51) = 450, aexp(2,51) = 13100, arange(2,51) = 1310, ihp(2,52) = 431, jhp(2,52) = 450, aexp(2,52) = 2730, arange(2,52) = 727, ihp(2,53) = 447, jhp(2,53) = 450, aexp(2,53) = 3860, arange(2,53) = 727, ihp(2,54) = 417, jhp(2,54) = 450, aexp(2,54) = 2610, arange(2,54) = 727, ihp(2,55) = 420, jhp(2,55) = 450, aexp(2,55) = 1180, arange(2,55) = 727, ihp(2,56) = 444, jhp(2,56) = 464, aexp(2,56) = 27800, arange(2,56) = 2780, ihp(2,57) = 450, jhp(2,57) = 464, aexp(2,57) = 5930, arange(2,57) = 727, ihp(2,58) = 450, jhp(2,58) = 466, aexp(2,58) = 52100, arange(2,58) = 5210, ihp(2,59) = 447, jhp(2,59) = 466, aexp(2,59) = 25300, arange(2,59) = 2530, ihp(2,60) = 444, jhp(2,60) = 466, aexp(2,60) = 3800, arange(2,60) = 727, ihp(2,61) = 450, jhp(2,61) = 467, aexp(2,61) = 23900, arange(2,61) = 2390, ihp(2,62) = 447, jhp(2,62) = 467, aexp(2,62) = 49700, arange(2,62) = 4970, ihp(2,63) = 444, jhp(2,63) = 467, aexp(2,63) = 3830, arange(2,63) = 727, ihp(3,1) = 349, jhp(3,1) = 352, aexp(3,1) = 12500, arange(1,1) = 1250, ihp(3,2) = 336, jhp(3,2) = 355, aexp(3,2) = 4580, arange(1,2) = 884, ihp(3,3) = 338, jhp(3,3) = 355, aexp(3,3) = 9280, arange(1,3) = 928, ihp(3,4) = 339, jhp(3,4) = 355, aexp(3,4) = 11400, arange(1,4) = 1140, ihp(3,5) = 349, jhp(3,5) = 355, aexp(3,5) = 1420, arange(1,5) = 884, ihp(3,6) = 322, jhp(3,6) = 355, aexp(3,6) = 2510, arange(1,6) = 884, ihp(3,7) = 352, jhp(3,7) = 355, aexp(3,7) = 8530, arange(1,7) = 884, ihp(3,8) = 258, jhp(3,8) = 364, aexp(3,8) = 1350, arange(1,8) = 884, ihp(3,9) = 290, jhp(3,9) = 364, aexp(3,9) = 1130, arange(1,9) = 884, ihp(3,10) = 352, jhp(3,10) = 364, aexp(3,10) = 2870, arange(1,10) = 884, ihp(3,11) = 349, jhp(3,11) = 368, aexp(3,11) = 29300, arange(1,11) = 2930, ihp(3,12) = 352, jhp(3,12) = 368, aexp(3,12) = 7910, arange(1,12) = 884, ihp(3,13) = 355, jhp(3,13) = 368, aexp(3,13) = 9850, arange(1,13) = 985, ihp(3,14) = 352, jhp(3,14) = 370, aexp(3,14) = 33500, arange(1,14) = 3350, ihp(3,15) = 355, jhp(3,15) = 370, aexp(3,15) = 69200, arange(1,15) = 6920, ihp(3,16) = 352, jhp(3,16) = 371, aexp(3,16) = 59100, arange(1,16) = 5910, ihp(3,17) = 355, jhp(3,17) = 371, aexp(3,17) = 28800, arange(1,17) = 2880, ihp(3,18) = 381, jhp(3,18) = 384, aexp(3,18) = 20700, arange(1,18) = 2070, ihp(3,19) = 364, jhp(3,19) = 384, aexp(3,19) = 1910, arange(1,19) = 884, ihp(3,20) = 352, jhp(3,20) = 387, aexp(3,20) = 6900, arange(1,20) = 884, ihp(3,21) = 371, jhp(3,21) = 387, aexp(3,21) = 16200, arange(1,21) = 1620, ihp(3,22) = 370, jhp(3,22) = 387, aexp(3,22) = 7120, arange(1,22) = 884, ihp(3,23) = 384, jhp(3,23) = 387, aexp(3,23) = 6160, arange(1,23) = 884, ihp(3,24) = 368, jhp(3,24) = 387, aexp(3,24) = 1980, arange(1,24) = 884, ihp(3,25) = 381, jhp(3,25) = 387, aexp(3,25) = 2020, arange(1,25) = 884, ihp(3,26) = 384, jhp(3,26) = 401, aexp(3,26) = 13200, arange(1,26) = 1320, ihp(3,27) = 387, jhp(3,27) = 401, aexp(3,27) = 7350, arange(1,27) = 884, ihp(3,28) = 384, jhp(3,28) = 403, aexp(3,28) = 31300, arange(1,28) = 3130, ihp(3,29) = 387, jhp(3,29) = 403, aexp(3,29) = 40900, arange(1,29) = 4090, ihp(3,30) = 384, jhp(3,30) = 404, aexp(3,30) = 58900, arange(1,30) = 5890, ihp(3,31) = 387, jhp(3,31) = 404, aexp(3,31) = 21700, arange(1,31) = 2170, ihp(3,32) = 381, jhp(3,32) = 404, aexp(3,32) = 8430, arange(1,32) = 884, ihp(3,33) = 384, jhp(3,33) = 420, aexp(3,33) = 12500, arange(1,33) = 1250, ihp(3,34) = 387, jhp(3,34) = 420, aexp(3,34) = 1610, arange(1,34) = 884, ihp(3,35) = 417, jhp(3,35) = 420, aexp(3,35) = 8900, arange(1,35) = 890, ihp(3,36) = 404, jhp(3,36) = 420, aexp(3,36) = 24100, arange(1,36) = 2410, ihp(3,37) = 403, jhp(3,37) = 420, aexp(3,37) = 13900, arange(1,37) = 1390, ihp(3,38) = 401, jhp(3,38) = 420, aexp(3,38) = 3510, arange(1,38) = 884, ihp(3,39) = 384, jhp(3,39) = 422, aexp(3,39) = 8100, arange(1,39) = 884, ihp(3,40) = 387, jhp(3,40) = 422, aexp(3,40) = 5970, arange(1,40) = 884, ihp(3,41) = 403, jhp(3,41) = 422, aexp(3,41) = 10600, arange(1,41) = 1060, ihp(3,42) = 404, jhp(3,42) = 422, aexp(3,42) = 17100, arange(1,42) = 1710, ihp(3,43) = 420, jhp(3,43) = 422, aexp(3,43) = 65600, arange(1,43) = 6560, ihp(3,44) = 420, jhp(3,44) = 431, aexp(3,44) = 11600, arange(1,44) = 1160, ihp(3,45) = 420, jhp(3,45) = 433, aexp(3,45) = 65200, arange(1,45) = 6520, ihp(3,46) = 417, jhp(3,46) = 433, aexp(3,46) = 21900, arange(1,46) = 2190, ihp(3,47) = 422, jhp(3,47) = 433, aexp(3,47) = 6580, arange(1,47) = 884, ihp(3,48) = 417, jhp(3,48) = 434, aexp(3,48) = 57900, arange(1,48) = 5790, ihp(3,49) = 420, jhp(3,49) = 434, aexp(3,49) = 20300, arange(1,49) = 2030, ihp(3,50) = 422, jhp(3,50) = 434, aexp(3,50) = 1650, arange(1,50) = 884, ihp(3,51) = 444, jhp(3,51) = 447, aexp(3,51) = 16800, arange(1,51) = 1680, ihp(3,52) = 433, jhp(3,52) = 450, aexp(3,52) = 12600, arange(1,52) = 1260, ihp(3,53) = 434, jhp(3,53) = 450, aexp(3,53) = 16200, arange(1,53) = 1620, ihp(3,54) = 431, jhp(3,54) = 450, aexp(3,54) = 4430, arange(1,54) = 884, ihp(3,55) = 447, jhp(3,55) = 450, aexp(3,55) = 6080, arange(1,55) = 884, ihp(3,56) = 417, jhp(3,56) = 450, aexp(3,56) = 3860, arange(1,56) = 884, ihp(3,57) = 444, jhp(3,57) = 450, aexp(3,57) = 2160, arange(1,57) = 884, ihp(3,58) = 420, jhp(3,58) = 450, aexp(3,58) = 1810, arange(1,58) = 884, ihp(3,59) = 444, jhp(3,59) = 464, aexp(3,59) = 36700, arange(1,59) = 3670, ihp(3,60) = 447, jhp(3,60) = 464, aexp(3,60) = 9760, arange(1,60) = 976, ihp(3,61) = 450, jhp(3,61) = 464, aexp(3,61) = 7950, arange(1,61) = 884, ihp(3,62) = 450, jhp(3,62) = 466, aexp(3,62) = 60400, arange(1,62) = 6040, ihp(3,63) = 447, jhp(3,63) = 466, aexp(3,63) = 35500, arange(1,63) = 3550, ihp(3,64) = 444, jhp(3,64) = 466, aexp(3,64) = 5980, arange(1,64) = 884, ihp(3,65) = 450, jhp(3,65) = 467, aexp(3,65) = 32200, arange(1,65) = 3220, ihp(3,66) = 447, jhp(3,66) = 467, aexp(3,66) = 59700, arange(1,66) = 5970, ihp(3,67) = 444, jhp(3,67) = 467, aexp(3,67) = 5440, arange(1,67) = 884, ihp(4,1) = 349, jhp(4,1) = 352, aexp(4,1) = 15400, arange(4,1) = 1540, ihp(4,2) = 325, jhp(4,2) = 355, aexp(4,2) = 1240, arange(4,2) = 1150, ihp(4,3) = 336, jhp(4,3) = 355, aexp(4,3) = 5150, arange(4,3) = 1150, ihp(4,4) = 338, jhp(4,4) = 355, aexp(4,4) = 10700, arange(4,4) = 1150, ihp(4,5) = 339, jhp(4,5) = 355, aexp(4,5) = 14000, arange(4,5) = 1400, ihp(4,6) = 349, jhp(4,6) = 355, aexp(4,6) = 3500, arange(4,6) = 1150, ihp(4,7) = 322, jhp(4,7) = 355, aexp(4,7) = 3580, arange(4,7) = 1150, ihp(4,8) = 352, jhp(4,8) = 355, aexp(4,8) = 12700, arange(4,8) = 1270, ihp(4,9) = 258, jhp(4,9) = 364, aexp(4,9) = 1670, arange(4,9) = 1150, ihp(4,10) = 290, jhp(4,10) = 364, aexp(4,10) = 1520, arange(4,10) = 1150, ihp(4,11) = 352, jhp(4,11) = 364, aexp(4,11) = 3480, arange(4,11) = 1150, ihp(4,12) = 349, jhp(4,12) = 368, aexp(4,12) = 42900, arange(4,12) = 4290, ihp(4,13) = 352, jhp(4,13) = 368, aexp(4,13) = 11500, arange(4,13) = 1150, ihp(4,14) = 355, jhp(4,14) = 368, aexp(4,14) = 14200, arange(4,14) = 1420, ihp(4,15) = 352, jhp(4,15) = 370, aexp(4,15) = 40600, arange(4,15) = 4060, ihp(4,16) = 355, jhp(4,16) = 370, aexp(4,16) = 76000, arange(4,16) = 7600, ihp(4,17) = 352, jhp(4,17) = 371, aexp(4,17) = 66000, arange(4,17) = 6600, ihp(4,18) = 355, jhp(4,18) = 371, aexp(4,18) = 36900, arange(4,18) = 3690, ihp(4,19) = 381, jhp(4,19) = 384, aexp(4,19) = 26200, arange(4,19) = 2620, ihp(4,20) = 364, jhp(4,20) = 384, aexp(4,20) = 2150, arange(4,20) = 1150, ihp(4,21) = 352, jhp(4,21) = 387, aexp(4,21) = 8910, arange(4,21) = 1150, ihp(4,22) = 355, jhp(4,22) = 387, aexp(4,22) = 2430, arange(4,22) = 1150, ihp(4,23) = 371, jhp(4,23) = 387, aexp(4,23) = 18900, arange(4,23) = 1890, ihp(4,24) = 370, jhp(4,24) = 387, aexp(4,24) = 8860, arange(4,24) = 1150, ihp(4,25) = 384, jhp(4,25) = 387, aexp(4,25) = 8340, arange(4,25) = 1150, ihp(4,26) = 368, jhp(4,26) = 387, aexp(4,26) = 2690, arange(4,26) = 1150, ihp(4,27) = 381, jhp(4,27) = 387, aexp(4,27) = 2670, arange(4,27) = 1150, ihp(4,28) = 384, jhp(4,28) = 401, aexp(4,28) = 14300, arange(4,28) = 1430, ihp(4,29) = 387, jhp(4,29) = 401, aexp(4,29) = 9910, arange(4,29) = 1150, ihp(4,30) = 384, jhp(4,30) = 403, aexp(4,30) = 36800, arange(4,30) = 3680, ihp(4,31) = 387, jhp(4,31) = 403, aexp(4,31) = 44100, arange(4,31) = 4410, ihp(4,32) = 384, jhp(4,32) = 404, aexp(4,32) = 65400, arange(4,32) = 6540, ihp(4,33) = 387, jhp(4,33) = 404, aexp(4,33) = 27500, arange(4,33) = 2750, ihp(4,34) = 381, jhp(4,34) = 404, aexp(4,34) = 10300, arange(4,34) = 1150, ihp(4,35) = 384, jhp(4,35) = 420, aexp(4,35) = 15300, arange(4,35) = 1530, ihp(4,36) = 387, jhp(4,36) = 420, aexp(4,36) = 2060, arange(4,36) = 1150, ihp(4,37) = 417, jhp(4,37) = 420, aexp(4,37) = 10900, arange(4,37) = 1150, ihp(4,38) = 404, jhp(4,38) = 420, aexp(4,38) = 26700, arange(4,38) = 2670, ihp(4,39) = 403, jhp(4,39) = 420, aexp(4,39) = 16200, arange(4,39) = 1620, ihp(4,40) = 401, jhp(4,40) = 420, aexp(4,40) = 4770, arange(4,40) = 1150, ihp(4,41) = 384, jhp(4,41) = 422, aexp(4,41) = 9350, arange(4,41) = 1150, ihp(4,42) = 387, jhp(4,42) = 422, aexp(4,42) = 6030, arange(4,42) = 1150, ihp(4,43) = 403, jhp(4,43) = 422, aexp(4,43) = 14600, arange(4,43) = 1460, ihp(4,44) = 404, jhp(4,44) = 422, aexp(4,44) = 20800, arange(4,44) = 2080, ihp(4,45) = 420, jhp(4,45) = 422, aexp(4,45) = 75800, arange(4,45) = 7580, ihp(4,46) = 417, jhp(4,46) = 431, aexp(4,46) = 9760, arange(4,46) = 1150, ihp(4,47) = 420, jhp(4,47) = 431, aexp(4,47) = 14900, arange(4,47) = 1490, ihp(4,48) = 420, jhp(4,48) = 433, aexp(4,48) = 69600, arange(4,48) = 6960, ihp(4,49) = 417, jhp(4,49) = 433, aexp(4,49) = 25800, arange(4,49) = 2580, ihp(4,50) = 422, jhp(4,50) = 433, aexp(4,50) = 8490, arange(4,50) = 1150, ihp(4,51) = 417, jhp(4,51) = 434, aexp(4,51) = 66900, arange(4,51) = 6690, ihp(4,52) = 420, jhp(4,52) = 434, aexp(4,52) = 25300, arange(4,52) = 2530, ihp(4,53) = 422, jhp(4,53) = 434, aexp(4,53) = 1990, arange(4,53) = 1150, ihp(4,54) = 444, jhp(4,54) = 447, aexp(4,54) = 19800, arange(4,54) = 1980, ihp(4,55) = 433, jhp(4,55) = 450, aexp(4,55) = 15800, arange(4,55) = 1580, ihp(4,56) = 434, jhp(4,56) = 450, aexp(4,56) = 17900, arange(4,56) = 1790, ihp(4,57) = 431, jhp(4,57) = 450, aexp(4,57) = 5290, arange(4,57) = 1150, ihp(4,58) = 447, jhp(4,58) = 450, aexp(4,58) = 8620, arange(4,58) = 1150, ihp(4,59) = 417, jhp(4,59) = 450, aexp(4,59) = 4990, arange(4,59) = 1150, ihp(4,60) = 444, jhp(4,60) = 450, aexp(4,60) = 2350, arange(4,60) = 1150, ihp(4,61) = 420, jhp(4,61) = 450, aexp(4,61) = 2500, arange(4,61) = 1150, ihp(4,62) = 444, jhp(4,62) = 464, aexp(4,62) = 47500, arange(4,62) = 4750, ihp(4,63) = 447, jhp(4,63) = 464, aexp(4,63) = 15700, arange(4,63) = 1570, ihp(4,64) = 450, jhp(4,64) = 464, aexp(4,64) = 12800, arange(4,64) = 1280, ihp(4,65) = 450, jhp(4,65) = 466, aexp(4,65) = 65100, arange(4,65) = 6510, ihp(4,66) = 447, jhp(4,66) = 466, aexp(4,66) = 42900, arange(4,66) = 4290, ihp(4,67) = 444, jhp(4,67) = 466, aexp(4,67) = 7120, arange(4,67) = 1150, ihp(4,68) = 450, jhp(4,68) = 467, aexp(4,68) = 39200, arange(4,68) = 3920, ihp(4,69) = 447, jhp(4,69) = 467, aexp(4,69) = 68100, arange(4,69) = 6810, ihp(4,70) = 444, jhp(4,70) = 467, aexp(4,70) = 7190, arange(4,70) = 1150, / SUBM 4 RES 9 11 12 13 14 15 END END &noeexp emix = 0.090, 0.140, 0.200, 0.260, npeak = 41, 45, 51, 52, -1, ihp(1,1) = 477, jhp(1,1) = 480, aexp(1,1) = 9880, arange(1,1) = 988, ihp(1,2) = 447, jhp(1,2) = 483, aexp(1,2) = 5640, arange(1,2) = 963, ihp(1,3) = 466, jhp(1,3) = 483, aexp(1,3) = 5020, arange(1,3) = 963, ihp(1,4) = 480, jhp(1,4) = 483, aexp(1,4) = 2790, arange(1,4) = 963, ihp(1,5) = 480, jhp(1,5) = 499, aexp(1,5) = 14100, arange(1,5) = 1410, ihp(1,6) = 483, jhp(1,6) = 499, aexp(1,6) = 36500, arange(1,6) = 3650, ihp(1,7) = 480, jhp(1,7) = 516, aexp(1,7) = 5650, arange(1,7) = 963, ihp(1,8) = 483, jhp(1,8) = 516, aexp(1,8) = 823, arange(1,8) = 963, ihp(1,9) = 499, jhp(1,9) = 516, aexp(1,9) = 6970, arange(1,9) = 963, ihp(1,10) = 513, jhp(1,10) = 516, aexp(1,10) = 4180, arange(1,10) = 963, ihp(1,11) = 500, jhp(1,11) = 516, aexp(1,11) = 18700, arange(1,11) = 1870, ihp(1,12) = 480, jhp(1,12) = 518, aexp(1,12) = 1800, arange(1,12) = 963, ihp(1,13) = 483, jhp(1,13) = 518, aexp(1,13) = 3420, arange(1,13) = 963, ihp(1,14) = 499, jhp(1,14) = 518, aexp(1,14) = 5020, arange(1,14) = 963, ihp(1,15) = 516, jhp(1,15) = 518, aexp(1,15) = 40800, arange(1,15) = 4080, ihp(1,16) = 500, jhp(1,16) = 518, aexp(1,16) = 7290, arange(1,16) = 963, ihp(1,17) = 516, jhp(1,17) = 527, aexp(1,17) = 4910, arange(1,17) = 963, ihp(1,18) = 513, jhp(1,18) = 529, aexp(1,18) = 8550, arange(1,18) = 963, ihp(1,19) = 516, jhp(1,19) = 529, aexp(1,19) = 48900, arange(1,19) = 4890, ihp(1,20) = 510, jhp(1,20) = 529, aexp(1,20) = 4170, arange(1,20) = 963, ihp(1,21) = 516, jhp(1,21) = 530, aexp(1,21) = 10000, arange(1,21) = 1000, ihp(1,22) = 513, jhp(1,22) = 546, aexp(1,22) = 1600, arange(1,22) = 963, ihp(1,23) = 529, jhp(1,23) = 546, aexp(1,23) = 5900, arange(1,23) = 963, ihp(1,24) = 546, jhp(1,24) = 560, aexp(1,24) = 1150, arange(1,24) = 963, ihp(1,25) = 540, jhp(1,25) = 560, aexp(1,25) = 19500, arange(1,25) = 1950, ihp(1,26) = 543, jhp(1,26) = 560, aexp(1,26) = 4100, arange(1,26) = 963, ihp(1,27) = 575, jhp(1,27) = 579, aexp(1,27) = 12300, arange(1,27) = 1230, ihp(1,28) = 575, jhp(1,28) = 580, aexp(1,28) = 48300, arange(1,28) = 4830, ihp(1,29) = 560, jhp(1,29) = 584, aexp(1,29) = 1070, arange(1,29) = 963, ihp(1,30) = 579, jhp(1,30) = 584, aexp(1,30) = 49500, arange(1,30) = 4950, ihp(1,31) = 580, jhp(1,31) = 584, aexp(1,31) = 9770, arange(1,31) = 977, ihp(1,32) = 577, jhp(1,32) = 584, aexp(1,32) = 6970, arange(1,32) = 963, ihp(1,33) = 572, jhp(1,33) = 584, aexp(1,33) = 898, arange(1,33) = 963, ihp(1,34) = 622, jhp(1,34) = 625, aexp(1,34) = 8340, arange(1,34) = 963, ihp(1,35) = 579, jhp(1,35) = 628, aexp(1,35) = 4820, arange(1,35) = 963, ihp(1,36) = 575, jhp(1,36) = 628, aexp(1,36) = 1300, arange(1,36) = 963, ihp(1,37) = 625, jhp(1,37) = 628, aexp(1,37) = 1970, arange(1,37) = 963, ihp(1,38) = 622, jhp(1,38) = 628, aexp(1,38) = 650, arange(1,38) = 963, ihp(1,39) = 628, jhp(1,39) = 642, aexp(1,39) = 3490, arange(1,39) = 963, ihp(1,40) = 625, jhp(1,40) = 642, aexp(1,40) = 1680, arange(1,40) = 963, ihp(1,41) = 628, jhp(1,41) = 644, aexp(1,41) = 26600, arange(1,41) = 2660, ihp(2,62) = 447, jhp(2,62) = 467, aexp(2,62) = 49700, arange(2,62) = 4970, ihp(2,63) = 444, jhp(2,63) = 467, aexp(2,63) = 3830, arange(2,63) = 727, ihp(2,1) = 477, jhp(2,1) = 480, aexp(2,1) = 15700, arange(2,1) = 1570, ihp(2,2) = 447, jhp(2,2) = 483, aexp(2,2) = 8530, arange(2,2) = 853, ihp(2,3) = 466, jhp(2,3) = 483, aexp(2,3) = 8120, arange(2,3) = 812, ihp(2,4) = 480, jhp(2,4) = 483, aexp(2,4) = 4270, arange(2,4) = 727, ihp(2,5) = 480, jhp(2,5) = 499, aexp(2,5) = 23600, arange(2,5) = 2360, ihp(2,6) = 483, jhp(2,6) = 499, aexp(2,6) = 46300, arange(2,6) = 4630, ihp(2,7) = 480, jhp(2,7) = 516, aexp(2,7) = 8270, arange(2,7) = 827, ihp(2,8) = 483, jhp(2,8) = 516, aexp(2,8) = 1120, arange(2,8) = 727, ihp(2,9) = 499, jhp(2,9) = 516, aexp(2,9) = 11700, arange(2,9) = 1170, ihp(2,10) = 513, jhp(2,10) = 516, aexp(2,10) = 5220, arange(2,10) = 727, ihp(2,11) = 500, jhp(2,11) = 516, aexp(2,11) = 25000, arange(2,11) = 2500, ihp(2,12) = 497, jhp(2,12) = 516, aexp(2,12) = 2620, arange(2,12) = 727, ihp(2,13) = 480, jhp(2,13) = 518, aexp(2,13) = 2580, arange(2,13) = 727, ihp(2,14) = 483, jhp(2,14) = 518, aexp(2,14) = 4320, arange(2,14) = 727, ihp(2,15) = 499, jhp(2,15) = 518, aexp(2,15) = 8390, arange(2,15) = 839, ihp(2,16) = 516, jhp(2,16) = 518, aexp(2,16) = 53900, arange(2,16) = 5390, ihp(2,17) = 500, jhp(2,17) = 518, aexp(2,17) = 10800, arange(2,17) = 1080, ihp(2,18) = 516, jhp(2,18) = 527, aexp(2,18) = 7500, arange(2,18) = 750, ihp(2,19) = 513, jhp(2,19) = 529, aexp(2,19) = 17200, arange(2,19) = 1720, ihp(2,20) = 516, jhp(2,20) = 529, aexp(2,20) = 62400, arange(2,20) = 6240, ihp(2,21) = 518, jhp(2,21) = 529, aexp(2,21) = 4460, arange(2,21) = 727, ihp(2,22) = 510, jhp(2,22) = 529, aexp(2,22) = 7850, arange(2,22) = 785, ihp(2,23) = 516, jhp(2,23) = 530, aexp(2,23) = 17000, arange(2,23) = 1700, ihp(2,24) = 513, jhp(2,24) = 546, aexp(2,24) = 2490, arange(2,24) = 727, ihp(2,25) = 529, jhp(2,25) = 546, aexp(2,25) = 8170, arange(2,25) = 817, ihp(2,26) = 546, jhp(2,26) = 560, aexp(2,26) = 4340, arange(2,26) = 727, ihp(2,27) = 540, jhp(2,27) = 560, aexp(2,27) = 30900, arange(2,27) = 3090, ihp(2,28) = 560, jhp(2,28) = 579, aexp(2,28) = 7360, arange(2,28) = 736, ihp(2,29) = 579, jhp(2,29) = 575, aexp(2,29) = 1330, arange(2,29) = 727, ihp(2,30) = 575, jhp(2,30) = 579, aexp(2,30) = 21100, arange(2,30) = 2110, ihp(2,31) = 575, jhp(2,31) = 580, aexp(2,31) = 64900, arange(2,31) = 6490, ihp(2,32) = 560, jhp(2,32) = 584, aexp(2,32) = 2390, arange(2,32) = 727, ihp(2,33) = 579, jhp(2,33) = 584, aexp(2,33) = 62700, arange(2,33) = 6270, ihp(2,34) = 580, jhp(2,34) = 584, aexp(2,34) = 17300, arange(2,34) = 1730, ihp(2,35) = 577, jhp(2,35) = 584, aexp(2,35) = 9340, arange(2,35) = 934, ihp(2,36) = 572, jhp(2,36) = 584, aexp(2,36) = 2280, arange(2,36) = 727, ihp(2,37) = 622, jhp(2,37) = 625, aexp(2,37) = 12600, arange(2,37) = 1260, ihp(2,38) = 577, jhp(2,38) = 628, aexp(2,38) = 1620, arange(2,38) = 727, ihp(2,39) = 579, jhp(2,39) = 628, aexp(2,39) = 6090, arange(2,39) = 727, ihp(2,40) = 575, jhp(2,40) = 628, aexp(2,40) = 2080, arange(2,40) = 727, ihp(2,41) = 625, jhp(2,41) = 628, aexp(2,41) = 3960, arange(2,41) = 727, ihp(2,42) = 622, jhp(2,42) = 628, aexp(2,42) = 1030, arange(2,42) = 727, ihp(2,43) = 628, jhp(2,43) = 642, aexp(2,43) = 5330, arange(2,43) = 727, ihp(2,44) = 625, jhp(2,44) = 642, aexp(2,44) = 3280, arange(2,44) = 727, ihp(2,45) = 628, jhp(2,45) = 644, aexp(2,45) = 34200, arange(2,45) = 3420, ihp(3,66) = 447, jhp(3,66) = 467, aexp(3,66) = 59700, arange(1,66) = 5970, ihp(3,67) = 444, jhp(3,67) = 467, aexp(3,67) = 5440, arange(1,67) = 884, ihp(3,1) = 477, jhp(3,1) = 480, aexp(3,1) = 18700, arange(1,1) = 1870, ihp(3,2) = 447, jhp(3,2) = 483, aexp(3,2) = 11300, arange(1,2) = 1130, ihp(3,3) = 466, jhp(3,3) = 483, aexp(3,3) = 10900, arange(1,3) = 1090, ihp(3,4) = 480, jhp(3,4) = 483, aexp(3,4) = 6270, arange(1,4) = 884, ihp(3,5) = 477, jhp(3,5) = 483, aexp(3,5) = 1370, arange(1,5) = 884, ihp(3,6) = 480, jhp(3,6) = 499, aexp(3,6) = 29700, arange(1,6) = 2970, ihp(3,7) = 483, jhp(3,7) = 499, aexp(3,7) = 54600, arange(1,7) = 5460, ihp(3,8) = 480, jhp(3,8) = 516, aexp(3,8) = 10600, arange(1,8) = 1060, ihp(3,9) = 483, jhp(3,9) = 516, aexp(3,9) = 1740, arange(1,9) = 884, ihp(3,10) = 499, jhp(3,10) = 516, aexp(3,10) = 16100, arange(1,10) = 1610, ihp(3,11) = 513, jhp(3,11) = 516, aexp(3,11) = 8990, arange(1,11) = 899, ihp(3,12) = 500, jhp(3,12) = 516, aexp(3,12) = 28900, arange(1,12) = 2890, ihp(3,13) = 497, jhp(3,13) = 516, aexp(3,13) = 3690, arange(1,13) = 884, ihp(3,14) = 480, jhp(3,14) = 518, aexp(3,14) = 4620, arange(1,14) = 884, ihp(3,15) = 483, jhp(3,15) = 518, aexp(3,15) = 5980, arange(1,15) = 884, ihp(3,16) = 499, jhp(3,16) = 518, aexp(3,16) = 10700, arange(1,16) = 1070, ihp(3,17) = 516, jhp(3,17) = 518, aexp(3,17) = 63200, arange(1,17) = 6320, ihp(3,18) = 500, jhp(3,18) = 518, aexp(3,18) = 15300, arange(1,18) = 1530, ihp(3,19) = 516, jhp(3,19) = 527, aexp(3,19) = 12200, arange(1,19) = 1220, ihp(3,20) = 513, jhp(3,20) = 529, aexp(3,20) = 23300, arange(1,20) = 2330, ihp(3,21) = 516, jhp(3,21) = 529, aexp(3,21) = 67600, arange(1,21) = 6760, ihp(3,22) = 518, jhp(3,22) = 529, aexp(3,22) = 7220, arange(1,22) = 884, ihp(3,23) = 510, jhp(3,23) = 529, aexp(3,23) = 11600, arange(1,23) = 1160, ihp(3,24) = 516, jhp(3,24) = 530, aexp(3,24) = 25500, arange(1,24) = 2550, ihp(3,25) = 518, jhp(3,25) = 530, aexp(3,25) = 2220, arange(1,25) = 884, ihp(3,26) = 513, jhp(3,26) = 546, aexp(3,26) = 4530, arange(1,26) = 884, ihp(3,27) = 516, jhp(3,27) = 546, aexp(3,27) = 2130, arange(1,27) = 884, ihp(3,28) = 529, jhp(3,28) = 546, aexp(3,28) = 11200, arange(1,28) = 1120, ihp(3,29) = 546, jhp(3,29) = 560, aexp(3,29) = 6420, arange(1,29) = 884, ihp(3,30) = 540, jhp(3,30) = 560, aexp(3,30) = 32400, arange(1,30) = 3240, ihp(3,31) = 543, jhp(3,31) = 560, aexp(3,31) = 8550, arange(1,31) = 884, ihp(3,32) = 52, jhp(3,32) = 575, aexp(3,32) = 1470, arange(1,32) = 884, ihp(3,33) = 575, jhp(3,33) = 577, aexp(3,33) = 10900, arange(1,33) = 1090, ihp(3,34) = 575, jhp(3,34) = 579, aexp(3,34) = 29000, arange(1,34) = 2900, ihp(3,35) = 575, jhp(3,35) = 580, aexp(3,35) = 78200, arange(1,35) = 7820, ihp(3,36) = 546, jhp(3,36) = 584, aexp(3,36) = 2760, arange(1,36) = 884, ihp(3,37) = 560, jhp(3,37) = 584, aexp(3,37) = 2550, arange(1,37) = 884, ihp(3,38) = 579, jhp(3,38) = 584, aexp(3,38) = 70100, arange(1,38) = 7010, ihp(3,39) = 580, jhp(3,39) = 584, aexp(3,39) = 25700, arange(1,39) = 2570, ihp(3,40) = 577, jhp(3,40) = 584, aexp(3,40) = 14700, arange(1,40) = 1470, ihp(3,41) = 572, jhp(3,41) = 584, aexp(3,41) = 3750, arange(1,41) = 884, ihp(3,42) = 622, jhp(3,42) = 625, aexp(3,42) = 16100, arange(1,42) = 1610, ihp(3,43) = 577, jhp(3,43) = 628, aexp(3,43) = 2660, arange(1,43) = 884, ihp(3,44) = 579, jhp(3,44) = 628, aexp(3,44) = 7710, arange(1,44) = 884, ihp(3,45) = 584, jhp(3,45) = 628, aexp(3,45) = 1700, arange(1,45) = 884, ihp(3,46) = 575, jhp(3,46) = 628, aexp(3,46) = 3220, arange(1,46) = 884, ihp(3,47) = 625, jhp(3,47) = 628, aexp(3,47) = 5340, arange(1,47) = 884, ihp(3,48) = 622, jhp(3,48) = 628, aexp(3,48) = 2020, arange(1,48) = 884, ihp(3,49) = 628, jhp(3,49) = 642, aexp(3,49) = 8590, arange(1,49) = 884, ihp(3,50) = 625, jhp(3,50) = 642, aexp(3,50) = 8150, arange(1,50) = 884, ihp(3,51) = 628, jhp(3,51) = 644, aexp(3,51) = 42900, arange(1,51) = 4290, ihp(4,69) = 447, jhp(4,69) = 467, aexp(4,69) = 68100, arange(4,69) = 6810, ihp(4,70) = 444, jhp(4,70) = 467, aexp(4,70) = 7190, arange(4,70) = 1150, ihp(4,1) = 477, jhp(4,1) = 480, aexp(4,1) = 21200, arange(4,1) = 2120, ihp(4,2) = 447, jhp(4,2) = 483, aexp(4,2) = 13700, arange(4,2) = 1370, ihp(4,3) = 466, jhp(4,3) = 483, aexp(4,3) = 13700, arange(4,3) = 1370, ihp(4,4) = 480, jhp(4,4) = 483, aexp(4,4) = 8350, arange(4,4) = 1150, ihp(4,5) = 477, jhp(4,5) = 483, aexp(4,5) = 1800, arange(4,5) = 1150, ihp(4,6) = 480, jhp(4,6) = 499, aexp(4,6) = 37900, arange(4,6) = 3790, ihp(4,7) = 483, jhp(4,7) = 499, aexp(4,7) = 58900, arange(4,7) = 5890, ihp(4,8) = 480, jhp(4,8) = 516, aexp(4,8) = 13500, arange(4,8) = 1350, ihp(4,9) = 483, jhp(4,9) = 516, aexp(4,9) = 3300, arange(4,9) = 1150, ihp(4,10) = 499, jhp(4,10) = 516, aexp(4,10) = 18900, arange(4,10) = 1890, ihp(4,11) = 513, jhp(4,11) = 516, aexp(4,11) = 10600, arange(4,11) = 1150, ihp(4,12) = 500, jhp(4,12) = 516, aexp(4,12) = 31500, arange(4,12) = 3150, ihp(4,13) = 497, jhp(4,13) = 516, aexp(4,13) = 4820, arange(4,13) = 1150, ihp(4,14) = 480, jhp(4,14) = 518, aexp(4,14) = 6170, arange(4,14) = 1150, ihp(4,15) = 483, jhp(4,15) = 518, aexp(4,15) = 6910, arange(4,15) = 1150, ihp(4,16) = 499, jhp(4,16) = 518, aexp(4,16) = 13300, arange(4,16) = 1330, ihp(4,17) = 516, jhp(4,17) = 518, aexp(4,17) = 72200, arange(4,17) = 7220, ihp(4,18) = 500, jhp(4,18) = 518, aexp(4,18) = 18200, arange(4,18) = 1820, ihp(4,19) = 513, jhp(4,19) = 527, aexp(4,19) = 12000, arange(4,19) = 1200, ihp(4,20) = 516, jhp(4,20) = 527, aexp(4,20) = 14400, arange(4,20) = 1440, ihp(4,21) = 513, jhp(4,21) = 529, aexp(4,21) = 28800, arange(4,21) = 2880, ihp(4,22) = 516, jhp(4,22) = 529, aexp(4,22) = 72500, arange(4,22) = 7250, ihp(4,23) = 518, jhp(4,23) = 529, aexp(4,23) = 9930, arange(4,23) = 1150, ihp(4,24) = 510, jhp(4,24) = 529, aexp(4,24) = 15000, arange(4,24) = 1500, ihp(4,25) = 516, jhp(4,25) = 530, aexp(4,25) = 30500, arange(4,25) = 3050, ihp(4,26) = 518, jhp(4,26) = 530, aexp(4,26) = 3250, arange(4,26) = 1150, ihp(4,27) = 513, jhp(4,27) = 546, aexp(4,27) = 6210, arange(4,27) = 1150, ihp(4,28) = 516, jhp(4,28) = 546, aexp(4,28) = 3080, arange(4,28) = 1150, ihp(4,29) = 529, jhp(4,29) = 546, aexp(4,29) = 11900, arange(4,29) = 1190, ihp(4,30) = 546, jhp(4,30) = 560, aexp(4,30) = 10200, arange(4,30) = 1150, ihp(4,31) = 540, jhp(4,31) = 560, aexp(4,31) = 40100, arange(4,31) = 4010, ihp(4,32) = 543, jhp(4,32) = 560, aexp(4,32) = 13000, arange(4,32) = 1300, ihp(4,33) = 52, jhp(4,33) = 575, aexp(4,33) = 1620, arange(4,33) = 1150, ihp(4,34) = 575, jhp(4,34) = 577, aexp(4,34) = 17400, arange(4,34) = 1740, ihp(4,35) = 575, jhp(4,35) = 579, aexp(4,35) = 36300, arange(4,35) = 3630, ihp(4,36) = 575, jhp(4,36) = 580, aexp(4,36) = 88900, arange(4,36) = 8890, ihp(4,37) = 546, jhp(4,37) = 584, aexp(4,37) = 3200, arange(4,37) = 1150, ihp(4,38) = 560, jhp(4,38) = 584, aexp(4,38) = 4250, arange(4,38) = 1150, ihp(4,39) = 579, jhp(4,39) = 584, aexp(4,39) = 74500, arange(4,39) = 7450, ihp(4,40) = 580, jhp(4,40) = 584, aexp(4,40) = 30900, arange(4,40) = 3090, ihp(4,41) = 577, jhp(4,41) = 584, aexp(4,41) = 17400, arange(4,41) = 1740, ihp(4,42) = 572, jhp(4,42) = 584, aexp(4,42) = 4450, arange(4,42) = 1150, ihp(4,43) = 622, jhp(4,43) = 625, aexp(4,43) = 18600, arange(4,43) = 1860, ihp(4,44) = 577, jhp(4,44) = 628, aexp(4,44) = 3660, arange(4,44) = 1150, ihp(4,45) = 579, jhp(4,45) = 628, aexp(4,45) = 9720, arange(4,45) = 1150, ihp(4,46) = 584, jhp(4,46) = 628, aexp(4,46) = 2870, arange(4,46) = 1150, ihp(4,47) = 575, jhp(4,47) = 628, aexp(4,47) = 3990, arange(4,47) = 1150, ihp(4,48) = 625, jhp(4,48) = 628, aexp(4,48) = 7680, arange(4,48) = 1150, ihp(4,49) = 622, jhp(4,49) = 628, aexp(4,49) = 3080, arange(4,49) = 1150, ihp(4,50) = 628, jhp(4,50) = 642, aexp(4,50) = 10400, arange(4,50) = 1150, ihp(4,51) = 625, jhp(4,51) = 642, aexp(4,51) = 7960, arange(4,51) = 1150, ihp(4,52) = 628, jhp(4,52) = 644, aexp(4,52) = 48200, arange(4,52) = 4820, ihp(4,53) = 625, jhp(4,53) = 644, aexp(4,53) = 34500, arange(4,53) = 3450, ihp(4,54) = 625, jhp(4,54) = 645, aexp(4,54) = 85400, arange(4,54) = 8540, / SUBM 5 RES 2 3 15 16 17 18 19 20 END END &noeexp emix = 0.090, 0.140, 0.200, 0.260, npeak = 8, 9, 9, 9, -1, ihp(1,1) = 546, jhp(1,1) = 589, aexp(1,1) = 8090.00000, arange(1,1) = 963.00000 ihp(1,2) = 589, jhp(1,2) = 584, aexp(1,2) = 30900.00000, arange(1,2) = 3090.00000 ihp(1,3) = 231, jhp(1,3) = 266, aexp(1,3) = 10700.00000, arange(1,3) = 1070.00000 ihp(1,4) = 266, jhp(1,4) = 261, aexp(1,4) = 30800.00000, arange(1,4) = 3080.00000 ihp(1,5) = 266, jhp(1,5) = 233, aexp(1,5) = 6500.00000, arange(1,5) = 963.00000 ihp(1,6) = 589, jhp(1,6) = 543, aexp(1,6) = 2540.00000, arange(1,6) = 963.00000 ihp(1,7) = 266, jhp(1,7) = 228, aexp(1,7) = 2140.00000, arange(1,7) = 963.00000 ihp(1,8) = 266, jhp(1,8) = 242, aexp(1,8) = 5530.00000, arange(1,8) = 963.00000 ihp(2,1) = 546, jhp(2,1) = 589, aexp(2,1) = 13500.00000, arange(2,1) = 1350.00000 ihp(2,2) = 589, jhp(2,2) = 584, aexp(2,2) = 42700.00000, arange(2,2) = 4270.00000 ihp(2,3) = 231, jhp(2,3) = 266, aexp(2,3) = 15300.00000, arange(2,3) = 1530.00000 ihp(2,4) = 266, jhp(2,4) = 261, aexp(2,4) = 43200.00000, arange(2,4) = 4320.00000 ihp(2,5) = 589, jhp(2,5) = 560, aexp(2,5) = 3360.00000, arange(2,5) = 727.00000 ihp(2,6) = 266, jhp(2,6) = 233, aexp(2,6) = 9270.00000, arange(2,6) = 927.00000 ihp(2,7) = 589, jhp(2,7) = 543, aexp(2,7) = 5370.00000, arange(2,7) = 727.00000 ihp(2,8) = 266, jhp(2,8) = 228, aexp(2,8) = 3080.00000, arange(2,8) = 727.00000 ihp(2,9) = 266, jhp(2,9) = 242, aexp(2,9) = 7630.00000, arange(2,9) = 763.00000 ihp(3,1) = 546, jhp(3,1) = 589, aexp(3,1) = 17400.00000, arange(3,1) = 1740.00000 ihp(3,2) = 589, jhp(3,2) = 584, aexp(3,2) = 54300.00000, arange(3,2) = 5430.00000 ihp(3,3) = 231, jhp(3,3) = 266, aexp(3,3) = 19900.00000, arange(3,3) = 1990.00000 ihp(3,4) = 266, jhp(3,4) = 261, aexp(3,4) = 53200.00000, arange(3,4) = 5320.00000 ihp(3,5) = 589, jhp(3,5) = 560, aexp(3,5) = 4610.00000, arange(3,5) = 884.00000 ihp(3,6) = 266, jhp(3,6) = 233, aexp(3,6) = 13500.00000, arange(3,6) = 1350.00000 ihp(3,7) = 589, jhp(3,7) = 543, aexp(3,7) = 8600.00000, arange(3,7) = 884.00000 ihp(3,8) = 266, jhp(3,8) = 228, aexp(3,8) = 3960.00000, arange(3,8) = 884.00000 ihp(3,9) = 266, jhp(3,9) = 242, aexp(3,9) = 10100.00000, arange(3,9) = 1010.00000 ihp(4,1) = 546, jhp(4,1) = 589, aexp(4,1) = 20700.00000, arange(4,1) = 2070.00000 ihp(4,2) = 589, jhp(4,2) = 584, aexp(4,2) = 62700.00000, arange(4,2) = 6270.00000 ihp(4,3) = 231, jhp(4,3) = 266, aexp(4,3) = 23100.00000, arange(4,3) = 2310.00000 ihp(4,4) = 266, jhp(4,4) = 261, aexp(4,4) = 61800.00000, arange(4,4) = 6180.00000 ihp(4,5) = 589, jhp(4,5) = 560, aexp(4,5) = 7050.00000, arange(4,5) = 1150.00000 ihp(4,6) = 266, jhp(4,6) = 233, aexp(4,6) = 15700.00000, arange(4,6) = 1570.00000 ihp(4,7) = 589, jhp(4,7) = 543, aexp(4,7) = 10600.00000, arange(4,7) = 1150.00000 ihp(4,8) = 266, jhp(4,8) = 228, aexp(4,8) = 7040.00000, arange(4,8) = 1150.00000 ihp(4,9) = 266, jhp(4,9) = 242, aexp(4,9) = 13400.00000, arange(4,9) = 1340.00000 / SUBM 6 RES 8 9 18 19 END END &noeexp emix = 0.090, 0.140, 0.200, 0.260, npeak = 6, 6, 6, 6, -1, ihp(1,1) = 560, jhp(1,1) = 608, aexp(1,1) =-2790.00000, arange(1,1) = 963.00000 ihp(1,2) = 560, jhp(1,2) = 611, aexp(1,2) = 2790.00000, arange(1,2) = 963.00000 ihp(1,3) = 577, jhp(1,3) = 608, aexp(1,3) =-814.00000, arange(1,3) = 963.00000 ihp(1,4) = 577, jhp(1,4) = 611, aexp(1,4) = 814.00000, arange(1,4) = 963.00000 ihp(1,5) = 608, jhp(1,5) = 540, aexp(1,5) =-713.00000, arange(1,5) = 963.00000 ihp(1,6) = 611, jhp(1,6) = 540, aexp(1,6) = 713.00000, arange(1,6) = 963.00000 ihp(2,1) = 560, jhp(2,1) = 608, aexp(2,1) =-4370.00000, arange(2,1) = 727.00000 ihp(2,2) = 560, jhp(2,2) = 611, aexp(2,2) = 4370.00000, arange(2,2) = 727.00000 ihp(2,3) = 577, jhp(2,3) = 608, aexp(2,3) =-2450.00000, arange(2,3) = 727.00000 ihp(2,4) = 577, jhp(2,4) = 611, aexp(2,4) = 2450.00000, arange(2,4) = 727.00000 ihp(2,5) = 608, jhp(2,5) = 540, aexp(2,5) =-2360.00000, arange(2,5) = 727.00000 ihp(2,6) = 611, jhp(2,6) = 540, aexp(2,6) = 2360.00000, arange(2,6) = 727.00000 ihp(3,1) = 560, jhp(3,1) = 608, aexp(3,1) =-5350.00000, arange(3,1) = 884.00000 ihp(3,2) = 560, jhp(3,2) = 611, aexp(3,2) = 5350.00000, arange(3,2) = 884.00000 ihp(3,3) = 577, jhp(3,3) = 608, aexp(3,3) =-2550.00000, arange(3,3) = 884.00000 ihp(3,4) = 577, jhp(3,4) = 611, aexp(3,4) = 2550.00000, arange(3,4) = 884.00000 ihp(3,5) = 608, jhp(3,5) = 540, aexp(3,5) =-3070.00000, arange(3,5) = 884.00000 ihp(3,6) = 611, jhp(3,6) = 540, aexp(3,6) = 3070.00000, arange(3,6) = 884.00000 ihp(4,1) = 560, jhp(4,1) = 608, aexp(4,1) =-6110.00000, arange(4,1) = 1150.00000 ihp(4,2) = 560, jhp(4,2) = 611, aexp(4,2) = 6110.00000, arange(4,2) = 1150.00000 ihp(4,3) = 577, jhp(4,3) = 608, aexp(4,3) =-3950.00000, arange(4,3) = 1150.00000 ihp(4,4) = 577, jhp(4,4) = 611, aexp(4,4) = 3950.00000, arange(4,4) = 1150.00000 ihp(4,5) = 608, jhp(4,5) = 540, aexp(4,5) =-3700.00000, arange(4,5) = 1150.00000 ihp(4,6) = 611, jhp(4,6) = 540, aexp(4,6) = 3700.00000, arange(4,6) = 1150.00000 / SUBM 7 RES 18 19 END END &noeexp npeak=-1, / # Restraints file 2: ds.prmtop %VERSION VERSION_STAMP = V0001.000 DATE = 03/26/18 15:48:42 %FLAG TITLE %FORMAT(20a4) default_name %FLAG POINTERS %FORMAT(10I8) 647 15 236 460 552 706 1104 1278 0 0 3592 20 460 706 1278 45 95 49 26 0 0 0 0 0 0 0 0 0 49 0 0 %FLAG ATOM_NAME %FORMAT(20a4) HO5'O5' C5' H5' H5''C4' H4' O4' C1' H1' N1 C6 H6 C5 H5 C4 N4 H41 H42 N3 C2 O2 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9 C8 H8 N7 C5 C6 N6 H61 H62 N1 C2 H2 N3 C4 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N1 C6 H6 C5 H5 C4 N4 H41 H42 N3 C2 O2 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9 C8 H8 N7 C5 C6 O6 N1 H1 C2 N2 H21 H22 N3 C4 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N1 C6 H6 C5 H5 C4 N4 H41 H42 N3 C2 O2 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5'' C4' H4' O4' C1' H1' N1 C6 H6 C5 H5 C4 N4 H41 H42 N3 C2 O2 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9 C8 H8 N7 C5 C6 O6 N1 H1 C2 N2 H21 H22 N3 C4 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N1 C6 H6 C5 H5 C4 N4 H41 H42 N3 C2 O2 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N1 C6 H6 C5 C7 H71 H72 H73 C4 O4 N3 H3 C2 O2 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9 C8 H8 N7 C5 C6 O6 N1 H1 C2 N2 H21 H22 N3 C4 C3' H3' C2' H2' H2''O3' HO3'HO5'O5' C5' H5' H5''C4' H4' O4' C1' H1' N1 C6 H6 C5 H5 C4 N4 H41 H42 N3 C2 O2 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9 C8 H8 N7 C5 C6 N6 H61 H62 N1 C2 H2 N3 C4 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9 C8 H8 N7 C5 C6 O6 N1 H1 C2 N2 H21 H22 N3 C4 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N1 C6 H6 C5 H5 C4 N4 H41 H42 N3 C2 O2 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9 C8 H8 N7 C5 C6 O6 N1 H1 C2 N2 H21 H22 N3 C4 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9 C8 H8 N7 C5 C6 O6 N1 H1 C2 N2 H21 H22 N3 C4 C3' H3' C2' H2' H2'' O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N1 C6 H6 C5 H5 C4 N4 H41 H42 N3 C2 O2 C3' H3' C2' H2' H2''O3' P OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9 C8 H8 N7 C5 C6 O6 N1 H1 C2 N2 H21 H22 N3 C4 C3' H3' C2' H2' H2''O3' P OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' C3' H3' C2' H2''H2' O3' N1 C6 H6 C5 C7 H71 H72 H73 C4 O4 N3 H3 C2 O2 NP CN NC1 NC2 C31 C32 C33 C34 H11 H12 H21 H22 H23 H31 H32 H33 H41 H42 P OP1 OP2 O5' C5' H5' H5'' C4' H4' O4' C1' H1' N9 C8 H8 N7 C5 C6 O6 N1 H1 C2 N2 H21 H22 N3 C4 C3' H3' C2' H2' H2''O3' HO3' %FLAG CHARGE %FORMAT(5E16.8) 8.05790106E+00 -1.15128491E+01 -1.25733870E-01 1.37396142E+00 1.37396142E+00 2.96841267E+00 2.14294248E+00 -6.72585093E+00 -2.11378680E-01 3.57703749E+00 -6.17735970E-01 -3.33468090E-01 4.17837339E+00 -9.51568506E+00 3.39481449E+00 1.53777990E+01 -1.78086538E+01 7.86110022E+00 7.86110022E+00 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13 13 5 14 12 12 5 3 4 4 3 4 5 3 6 7 8 15 7 8 8 12 7 11 8 7 11 11 7 8 3 4 3 13 13 5 14 12 12 5 3 4 4 3 4 5 3 6 7 8 9 8 10 8 7 11 11 7 8 12 3 4 3 13 13 5 14 12 12 5 3 4 4 3 4 5 3 6 7 8 15 7 8 8 12 7 11 8 7 11 11 7 8 3 4 3 13 13 5 14 12 5 3 4 4 3 4 5 3 6 3 4 3 13 13 5 7 8 9 8 3 13 13 13 8 12 7 11 8 12 7 8 7 7 3 3 3 3 13 13 13 13 13 13 13 13 13 13 14 12 12 5 3 4 4 3 4 5 3 6 7 8 15 7 8 8 12 7 11 8 7 11 11 7 8 3 4 3 13 13 2 1 %FLAG NUMBER_EXCLUDED_ATOMS %FORMAT(10I8) 5 7 10 5 4 12 6 11 14 7 12 9 4 7 3 6 4 2 1 2 2 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 7 3 6 8 8 5 2 1 4 3 2 1 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 9 4 7 3 6 4 2 1 2 2 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 7 3 6 7 7 4 7 3 5 4 2 1 1 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 9 4 7 3 6 4 2 1 2 2 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 9 4 7 3 6 4 2 1 2 2 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 7 3 6 7 7 4 7 3 5 4 2 1 1 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 9 4 7 3 6 4 2 1 2 2 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 13 12 4 9 6 3 2 1 5 3 3 2 2 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 7 3 6 7 7 4 7 3 5 4 2 1 1 1 6 5 4 2 1 1 1 5 7 10 5 4 12 6 11 14 7 12 9 4 7 3 6 4 2 1 2 2 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 7 3 6 8 8 5 2 1 4 3 2 1 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 7 3 6 7 7 4 7 3 5 4 2 1 1 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 9 4 7 3 6 4 2 1 2 2 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 7 3 6 7 7 4 7 3 5 4 2 1 1 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 7 3 6 7 7 4 7 3 5 4 2 1 1 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 9 4 7 3 6 4 2 1 2 2 1 9 5 4 2 1 5 7 3 2 7 10 5 4 12 6 11 14 7 12 7 3 6 7 7 4 7 3 5 4 2 1 1 1 9 5 4 2 1 6 10 4 9 11 5 4 12 6 11 14 7 10 5 7 3 2 5 9 11 4 9 6 3 2 1 5 3 3 2 1 1 7 16 12 11 10 6 6 7 3 2 2 1 1 2 1 1 1 1 7 3 2 7 10 5 4 12 6 11 14 7 12 7 3 6 7 7 4 7 3 5 4 2 1 1 1 6 5 4 2 1 1 1 %FLAG NONBONDED_PARM_INDEX %FORMAT(10I8) 1 2 4 7 11 16 22 29 37 46 56 67 79 92 106 2 3 5 8 12 17 23 30 38 47 57 68 80 93 107 4 5 6 9 13 18 24 31 39 48 58 69 81 94 108 7 8 9 10 14 19 25 32 40 49 59 70 82 95 109 11 12 13 14 15 20 26 33 41 50 60 71 83 96 110 16 17 18 19 20 21 27 34 42 51 61 72 84 97 111 22 23 24 25 26 27 28 35 43 52 62 73 85 98 112 29 30 31 32 33 34 35 36 44 53 63 74 86 99 113 37 38 39 40 41 42 43 44 45 54 64 75 87 100 114 46 47 48 49 50 51 52 53 54 55 65 76 88 101 115 56 57 58 59 60 61 62 63 64 65 66 77 89 102 116 67 68 69 70 71 72 73 74 75 76 77 78 90 103 117 79 80 81 82 83 84 85 86 87 88 89 90 91 104 118 92 93 94 95 96 97 98 99 100 101 102 103 104 105 119 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 %FLAG RESIDUE_LABEL %FORMAT(20a4) DC5 DA DC DG DC DC DG DC DT DG3 DC5 DA DG DC DG DG DC DG SGT DG3 %FLAG RESIDUE_POINTER %FORMAT(10I8) 1 29 61 91 124 154 184 217 247 279 313 341 373 406 436 469 502 532 565 614 %FLAG BOND_FORCE_CONSTANT %FORMAT(5E16.8) 2.30000000E+02 3.40000000E+02 3.40000000E+02 3.10000000E+02 3.20000000E+02 5.70000000E+02 4.57000000E+02 4.34000000E+02 4.81000000E+02 4.83000000E+02 3.67000000E+02 4.27000000E+02 3.67000000E+02 5.49000000E+02 4.48000000E+02 4.24000000E+02 3.40000000E+02 3.37000000E+02 3.40000000E+02 3.10000000E+02 3.20000000E+02 5.53000000E+02 4.61000000E+02 3.67000000E+02 5.02000000E+02 4.69000000E+02 5.20000000E+02 4.14000000E+02 3.67000000E+02 5.29000000E+02 4.40000000E+02 4.36000000E+02 3.20000000E+02 5.25000000E+02 4.34000000E+02 4.27000000E+02 4.18000000E+02 4.47000000E+02 3.17000000E+02 4.10000000E+02 3.20000000E+02 3.37000000E+02 4.11100000E+02 4.87700000E+02 4.45800000E+02 %FLAG BOND_EQUIL_VALUE %FORMAT(5E16.8) 1.61000000E+00 1.09000000E+00 1.09000000E+00 1.52600000E+00 1.41000000E+00 1.22900000E+00 1.35800000E+00 1.01000000E+00 1.34000000E+00 1.33900000E+00 1.08000000E+00 1.43300000E+00 1.08000000E+00 1.35000000E+00 1.36500000E+00 1.38300000E+00 1.09000000E+00 1.47500000E+00 1.09000000E+00 1.52600000E+00 1.41000000E+00 9.60000000E-01 1.35400000E+00 1.08000000E+00 1.32400000E+00 1.40400000E+00 1.37000000E+00 1.39100000E+00 1.08000000E+00 1.30400000E+00 1.37100000E+00 1.37400000E+00 1.41000000E+00 1.48000000E+00 1.01000000E+00 1.38100000E+00 1.38800000E+00 1.41900000E+00 1.51000000E+00 1.44400000E+00 1.41000000E+00 1.46300000E+00 1.39100000E+00 1.48100000E+00 1.59900000E+00 %FLAG ANGLE_FORCE_CONSTANT %FORMAT(5E16.8) 1.00000000E+02 4.50000000E+01 3.50000000E+01 5.00000000E+01 5.00000000E+01 5.00000000E+01 5.00000000E+01 1.00000000E+02 8.00000000E+01 3.50000000E+01 7.00000000E+01 5.00000000E+01 7.00000000E+01 5.00000000E+01 7.00000000E+01 7.00000000E+01 5.00000000E+01 7.00000000E+01 5.00000000E+01 6.30000000E+01 5.00000000E+01 5.00000000E+01 7.00000000E+01 7.00000000E+01 8.00000000E+01 5.00000000E+01 5.00000000E+01 7.00000000E+01 7.00000000E+01 4.00000000E+01 5.00000000E+01 5.00000000E+01 6.00000000E+01 5.00000000E+01 3.50000000E+01 5.00000000E+01 5.00000000E+01 4.00000000E+01 5.00000000E+01 5.00000000E+01 5.50000000E+01 5.00000000E+01 7.00000000E+01 7.00000000E+01 6.30000000E+01 7.00000000E+01 7.00000000E+01 7.00000000E+01 7.00000000E+01 7.00000000E+01 7.00000000E+01 5.00000000E+01 7.00000000E+01 7.00000000E+01 5.00000000E+01 7.00000000E+01 7.00000000E+01 7.00000000E+01 7.00000000E+01 7.00000000E+01 5.00000000E+01 5.00000000E+01 1.40000000E+02 1.00000000E+02 7.00000000E+01 5.00000000E+01 7.00000000E+01 7.00000000E+01 8.00000000E+01 6.30000000E+01 5.00000000E+01 7.00000000E+01 8.00000000E+01 7.00000000E+01 7.00000000E+01 7.00000000E+01 7.00000000E+01 5.00000000E+01 8.00000000E+01 7.00000000E+01 7.00000000E+01 6.30000000E+01 7.00000000E+01 5.00000000E+01 5.00000000E+01 5.50000000E+01 4.40100000E+01 6.52300000E+01 6.37600000E+01 8.00000000E+01 4.99000000E+01 7.79600000E+01 6.61300000E+01 6.52300000E+01 6.26400000E+01 %FLAG ANGLE_EQUIL_VALUE %FORMAT(5E16.8) 1.88897066E+00 1.79070858E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 2.10312265E+00 2.13802925E+00 2.09439600E+00 2.08217869E+00 2.09439600E+00 2.10312265E+00 2.15199189E+00 2.09614133E+00 2.12057595E+00 2.08916001E+00 2.12232128E+00 2.08916001E+00 2.04203610E+00 1.91113635E+00 2.07868803E+00 2.11533996E+00 2.06996138E+00 2.11010397E+00 1.91113635E+00 1.91113635E+00 2.11533996E+00 2.05250808E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.91113635E+00 1.89368305E+00 2.01498349E+00 1.93731630E+00 2.25322103E+00 2.04727209E+00 2.06996138E+00 2.15548255E+00 2.04727209E+00 2.22878641E+00 2.31081692E+00 1.92684432E+00 2.14762857E+00 1.83957782E+00 1.81165254E+00 2.14762857E+00 1.98793087E+00 1.85354046E+00 2.20260646E+00 2.24798504E+00 2.19562514E+00 1.91113635E+00 1.91113635E+00 2.09265067E+00 2.10312265E+00 1.95826026E+00 2.05948940E+00 2.02458280E+00 2.15199189E+00 2.10486798E+00 2.08043336E+00 2.03854544E+00 2.18515316E+00 2.24798504E+00 1.94255229E+00 2.26892900E+00 2.20609712E+00 2.08916001E+00 1.91113635E+00 2.18689849E+00 1.99142153E+00 2.08916001E+00 2.10661331E+00 2.01411082E+00 1.91113635E+00 1.91113635E+00 1.89368305E+00 2.02615360E+00 2.09928292E+00 1.93208031E+00 1.94080696E+00 1.91026369E+00 1.98653461E+00 2.01236549E+00 2.09928292E+00 2.07292844E+00 %FLAG DIHEDRAL_FORCE_CONSTANT %FORMAT(5E16.8) 1.85181000E-01 1.25653100E+00 3.54858000E-01 2.50000000E-01 0.00000000E+00 3.83333333E-01 1.55555556E-01 2.50000000E-01 1.20000000E+00 0.00000000E+00 2.40000000E+00 4.80000000E+00 4.00000000E+00 2.55000000E+00 1.85000000E+00 6.65000000E+00 1.45000000E+00 1.00000000E-01 3.83000000E-01 1.17500000E+00 1.44000000E-01 2.50000000E+00 6.50000000E-01 2.00000000E-01 2.50000000E-01 1.80000000E-01 1.60000000E-01 1.17804000E+00 9.21020000E-02 9.62830000E-01 1.66666667E-01 6.80000000E+00 3.50000000E+00 5.45000000E+00 4.15000000E+00 1.70000000E+00 1.00000000E+01 1.65000000E+00 1.50000000E+00 3.00000000E+00 1.35000000E+00 2.17500000E+00 1.15000000E+00 3.80000000E-01 3.00000000E-01 1.50000000E-01 1.05000000E+01 1.00000000E+00 1.10000000E+00 %FLAG DIHEDRAL_PERIODICITY %FORMAT(5E16.8) 1.00000000E+00 2.00000000E+00 3.00000000E+00 1.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 3.00000000E+00 2.00000000E+00 3.00000000E+00 1.00000000E+00 2.00000000E+00 1.00000000E+00 2.00000000E+00 3.00000000E+00 3.00000000E+00 1.00000000E+00 2.00000000E+00 3.00000000E+00 3.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 1.00000000E+00 3.00000000E+00 3.00000000E+00 3.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 %FLAG DIHEDRAL_PHASE %FORMAT(5E16.8) 5.54929070E-01 6.14285649E+00 6.23514744E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 3.14159400E+00 3.14159400E+00 0.00000000E+00 0.00000000E+00 3.33317067E+00 5.15976777E+00 6.07541257E+00 0.00000000E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 0.00000000E+00 3.14159400E+00 0.00000000E+00 0.00000000E+00 3.14159400E+00 3.14159400E+00 3.14159400E+00 %FLAG SCEE_SCALE_FACTOR %FORMAT(5E16.8) 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 1.20000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 %FLAG SCNB_SCALE_FACTOR %FORMAT(5E16.8) 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 2.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 %FLAG SOLTY %FORMAT(5E16.8) 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 %FLAG LENNARD_JONES_ACOEF %FORMAT(5E16.8) 0.00000000E+00 0.00000000E+00 5.81803229E+05 0.00000000E+00 7.91544157E+05 1.04308023E+06 0.00000000E+00 4.66922514E+04 6.78771368E+04 3.25969625E+03 0.00000000E+00 4.58874091E+05 6.28541240E+05 3.63097246E+04 3.61397723E+05 0.00000000E+00 3.15360051E+04 4.68930885E+04 2.09814978E+03 2.44050579E+04 1.32801250E+03 0.00000000E+00 7.44975864E+05 9.95480466E+05 6.20665997E+04 5.89818288E+05 4.24594555E+04 9.44293233E+05 0.00000000E+00 7.01803794E+05 9.24822270E+05 6.01816484E+04 5.57281136E+05 4.15766412E+04 8.82619071E+05 8.19971662E+05 0.00000000E+00 4.96707306E+04 7.18621074E+04 3.50301067E+03 3.86654993E+04 2.26273716E+03 6.58473870E+04 6.37148278E+04 3.76169105E+03 0.00000000E+00 6.00750218E+04 8.59947003E+04 4.33325458E+03 4.68711055E+04 2.82099197E+03 7.91627154E+04 7.62451550E+04 4.64559155E+03 5.71629601E+03 0.00000000E+00 1.40467023E+03 2.56678134E+03 5.94667300E+01 1.03954408E+03 3.20009193E+01 2.12601181E+03 2.27577561E+03 6.63368273E+01 8.90987508E+01 1.39982777E-01 0.00000000E+00 4.71003287E+05 6.47841731E+05 3.69471530E+04 3.70622491E+05 2.47595516E+04 6.06829342E+05 5.74393458E+05 3.93690817E+04 4.77908183E+04 1.02595236E+03 3.79876399E+05 0.00000000E+00 6.82786631E+04 9.71708117E+04 4.98586848E+03 5.33379252E+04 3.25969625E+03 8.96776989E+04 8.61541883E+04 5.34045360E+03 6.55825601E+03 1.07193646E+02 5.44261042E+04 7.51607703E+03 0.00000000E+00 1.98683736E+06 2.54188684E+06 1.81087383E+05 1.58759528E+06 1.27716552E+05 2.45746558E+06 2.25370349E+06 1.90880272E+05 2.26202022E+05 8.41065839E+03 1.64263766E+06 2.54238516E+05 6.02589390E+06 0.00000000E+00 4.09427581E+04 5.98885646E+04 2.82099197E+03 3.17965283E+04 1.80748014E+03 5.46147253E+04 5.30987710E+04 3.03448006E+03 3.76169105E+03 4.90239937E+01 3.23283631E+04 4.33325458E+03 1.60682053E+05 2.43828624E+03 %FLAG LENNARD_JONES_BCOEF %FORMAT(5E16.8) 0.00000000E+00 0.00000000E+00 6.99746810E+02 0.00000000E+00 6.93079947E+02 6.75612247E+02 0.00000000E+00 1.03606917E+02 1.06076943E+02 1.43076527E+01 0.00000000E+00 5.89183300E+02 5.85549272E+02 8.66220817E+01 4.95732238E+02 0.00000000E+00 8.51470647E+01 8.81685417E+01 1.14788417E+01 7.10161395E+01 9.13231543E+00 0.00000000E+00 7.50714425E+02 7.36907417E+02 1.13252061E+02 6.33305958E+02 9.36708259E+01 8.01323529E+02 0.00000000E+00 6.14502845E+02 5.99015525E+02 9.40505980E+01 5.19163331E+02 7.81725398E+01 6.53361429E+02 5.31102864E+02 0.00000000E+00 1.05648788E+02 1.07908863E+02 1.46638650E+01 8.83744760E+01 1.17854122E+01 1.15327881E+02 9.56748258E+01 1.50233639E+01 0.00000000E+00 1.16187983E+02 1.18043746E+02 1.63092814E+01 9.73010751E+01 1.31591746E+01 1.26451907E+02 1.04660679E+02 1.66953734E+01 1.85196588E+01 0.00000000E+00 1.79702257E+01 2.06278363E+01 1.93248820E+00 1.46567808E+01 1.41762397E+00 2.09604198E+01 1.82891803E+01 2.01792524E+00 2.33864085E+00 9.37598976E-02 0.00000000E+00 6.29300710E+02 6.26720080E+02 9.21192136E+01 5.29252520E+02 7.54103785E+01 6.77220874E+02 5.55666448E+02 9.40124296E+01 1.03580945E+02 1.53505284E+01 5.64885984E+02 0.00000000E+00 1.25287818E+02 1.26919150E+02 1.76949863E+01 1.04986921E+02 1.43076527E+01 1.36131731E+02 1.12529845E+02 1.81057616E+01 2.00642027E+01 2.59456373E+00 1.11805549E+02 2.17257828E+01 0.00000000E+00 1.27682121E+03 1.22636552E+03 2.01468199E+02 1.08210555E+03 1.69194406E+02 1.34630496E+03 1.08732781E+03 2.04498832E+02 2.22617115E+02 4.34187588E+01 1.16041466E+03 2.38716853E+02 2.19561270E+03 0.00000000E+00 9.59185913E+01 9.85097219E+01 1.31591746E+01 8.01410250E+01 1.05333009E+01 1.05031585E+02 8.73413012E+01 1.34932874E+01 1.50233639E+01 1.73473071E+00 8.51921330E+01 1.63092814E+01 1.87626421E+02 1.20953369E+01 %FLAG BONDS_INC_HYDROGEN %FORMAT(10I8) 72 75 2 72 78 2 66 69 3 48 51 8 48 54 8 39 42 11 33 36 13 24 27 17 15 18 3 6 9 19 6 12 19 0 3 22 168 171 2 168 174 2 162 165 3 150 153 24 138 141 8 138 144 8 123 126 29 114 117 17 105 108 3 96 99 19 96 102 19 258 261 2 258 264 2 252 255 3 234 237 8 234 240 8 225 228 11 219 222 13 210 213 17 201 204 3 192 195 19 192 198 19 357 360 2 357 363 2 351 354 3 336 339 8 336 342 8 327 330 35 309 312 29 300 303 17 291 294 3 282 285 19 282 288 19 447 450 2 447 453 2 441 444 3 423 426 8 423 429 8 414 417 11 408 411 13 399 402 17 390 393 3 381 384 19 381 387 19 537 540 2 537 543 2 531 534 3 513 516 8 513 519 8 504 507 11 498 501 13 489 492 17 480 483 3 471 474 19 471 477 19 636 639 2 636 642 2 630 633 3 615 618 8 615 621 8 606 609 35 588 591 29 579 582 17 570 573 3 561 564 19 561 567 19 726 729 2 726 732 2 720 723 3 702 705 8 702 708 8 693 696 11 687 690 13 678 681 17 669 672 3 660 663 19 660 666 19 822 825 2 822 828 2 816 819 3 804 807 35 786 789 2 786 792 2 786 795 2 777 780 13 768 771 17 759 762 3 750 753 19 750 756 19 930 933 22 921 924 2 921 927 2 915 918 3 900 903 8 900 906 8 891 894 35 873 876 29 864 867 17 855 858 3 846 849 19 846 852 19 1008 1011 2 1008 1014 2 1002 1005 3 984 987 8 984 990 8 975 978 11 969 972 13 960 963 17 951 954 3 942 945 19 942 948 19 936 939 22 1104 1107 2 1104 1110 2 1098 1101 3 1086 1089 24 1074 1077 8 1074 1080 8 1059 1062 29 1050 1053 17 1041 1044 3 1032 1035 19 1032 1038 19 1203 1206 2 1203 1209 2 1197 1200 3 1182 1185 8 1182 1188 8 1173 1176 35 1155 1158 29 1146 1149 17 1137 1140 3 1128 1131 19 1128 1134 19 1293 1296 2 1293 1299 2 1287 1290 3 1269 1272 8 1269 1275 8 1260 1263 11 1254 1257 13 1245 1248 17 1236 1239 3 1227 1230 19 1227 1233 19 1392 1395 2 1392 1398 2 1386 1389 3 1371 1374 8 1371 1377 8 1362 1365 35 1344 1347 29 1335 1338 17 1326 1329 3 1317 1320 19 1317 1323 19 1491 1494 2 1491 1497 2 1485 1488 3 1470 1473 8 1470 1476 8 1461 1464 35 1443 1446 29 1434 1437 17 1425 1428 3 1416 1419 19 1416 1422 19 1581 1584 2 1581 1587 2 1575 1578 3 1557 1560 8 1557 1563 8 1548 1551 11 1542 1545 13 1533 1536 17 1524 1527 3 1515 1518 19 1515 1521 19 1680 1683 2 1680 1686 2 1674 1677 3 1659 1662 8 1659 1665 8 1650 1653 35 1632 1635 29 1623 1626 17 1614 1617 3 1605 1608 19 1605 1611 19 1806 1836 2 1806 1833 2 1803 1824 2 1803 1827 2 1803 1830 2 1800 1821 2 1800 1815 2 1800 1818 2 1797 1812 2 1797 1809 2 1773 1776 35 1755 1761 2 1755 1758 2 1755 1764 2 1746 1749 13 1731 1737 2 1731 1734 2 1725 1728 3 1719 1722 17 1710 1713 3 1701 1704 19 1701 1707 19 1935 1938 22 1926 1929 2 1926 1932 2 1920 1923 3 1905 1908 8 1905 1911 8 1896 1899 35 1878 1881 29 1869 1872 17 1860 1863 3 1851 1854 19 1851 1857 19 %FLAG BONDS_WITHOUT_HYDROGEN %FORMAT(10I8) 81 84 1 66 72 4 66 81 5 60 63 6 57 60 7 45 48 9 45 57 10 39 45 12 33 39 14 30 33 15 30 60 16 24 30 18 24 72 4 21 24 5 15 21 5 15 66 4 6 15 20 3 6 21 177 180 1 162 168 4 162 177 5 156 159 23 150 156 25 147 150 25 135 138 9 135 147 10 132 135 26 132 159 27 129 132 28 123 129 30 120 123 31 120 159 32 114 120 18 114 168 4 111 114 5 105 111 5 105 162 4 96 105 20 93 96 33 84 87 34 84 90 34 84 93 1 267 270 1 252 258 4 252 267 5 246 249 6 243 246 7 231 234 9 231 243 10 225 231 12 219 225 14 216 219 15 216 246 16 210 216 18 210 258 4 207 210 5 201 207 5 201 252 4 192 201 20 189 192 33 180 183 34 180 186 34 180 189 1 366 369 1 351 357 4 351 366 5 345 348 23 333 336 9 333 345 10 327 333 36 321 324 6 321 327 37 318 321 38 318 348 27 315 318 28 309 315 30 306 309 31 306 348 32 300 306 18 300 357 4 297 300 5 291 297 5 291 351 4 282 291 20 279 282 33 270 273 34 270 276 34 270 279 1 456 459 1 441 447 4 441 456 5 435 438 6 432 435 7 420 423 9 420 432 10 414 420 12 408 414 14 405 408 15 405 435 16 399 405 18 399 447 4 396 399 5 390 396 5 390 441 4 381 390 20 378 381 33 369 372 34 369 375 34 369 378 1 546 549 1 531 537 4 531 546 5 525 528 6 522 525 7 510 513 9 510 522 10 504 510 12 498 504 14 495 498 15 495 525 16 489 495 18 489 537 4 486 489 5 480 486 5 480 531 4 471 480 20 468 471 33 459 462 34 459 465 34 459 468 1 645 648 1 630 636 4 630 645 5 624 627 23 612 615 9 612 624 10 606 612 36 600 603 6 600 606 37 597 600 38 597 627 27 594 597 28 588 594 30 585 588 31 585 627 32 579 585 18 579 636 4 576 579 5 570 576 5 570 630 4 561 570 20 558 561 33 549 552 34 549 555 34 549 558 1 735 738 1 720 726 4 720 735 5 714 717 6 711 714 7 699 702 9 699 711 10 693 699 12 687 693 14 684 687 15 684 714 16 678 684 18 678 726 4 675 678 5 669 675 5 669 720 4 660 669 20 657 660 33 648 651 34 648 654 34 648 657 1 831 834 1 816 822 4 816 831 5 810 813 6 804 810 37 798 801 6 798 804 37 783 786 39 783 798 40 777 783 14 774 777 15 774 810 16 768 774 18 768 822 4 765 768 5 759 765 5 759 816 4 750 759 20 747 750 33 738 741 34 738 744 34 738 747 1 915 921 4 915 930 41 909 912 23 897 900 9 897 909 10 891 897 36 885 888 6 885 891 37 882 885 38 882 912 27 879 882 28 873 879 30 870 873 31 870 912 32 864 870 18 864 921 4 861 864 5 855 861 5 855 915 4 846 855 20 843 846 33 834 837 34 834 840 34 834 843 1 1017 1020 1 1002 1008 4 1002 1017 5 996 999 6 993 996 7 981 984 9 981 993 10 975 981 12 969 975 14 966 969 15 966 996 16 960 966 18 960 1008 4 957 960 5 951 957 5 951 1002 4 942 951 20 939 942 21 1113 1116 1 1098 1104 4 1098 1113 5 1092 1095 23 1086 1092 25 1083 1086 25 1071 1074 9 1071 1083 10 1068 1071 26 1068 1095 27 1065 1068 28 1059 1065 30 1056 1059 31 1056 1095 32 1050 1056 18 1050 1104 4 1047 1050 5 1041 1047 5 1041 1098 4 1032 1041 20 1029 1032 33 1020 1023 34 1020 1026 34 1020 1029 1 1212 1215 1 1197 1203 4 1197 1212 5 1191 1194 23 1179 1182 9 1179 1191 10 1173 1179 36 1167 1170 6 1167 1173 37 1164 1167 38 1164 1194 27 1161 1164 28 1155 1161 30 1152 1155 31 1152 1194 32 1146 1152 18 1146 1203 4 1143 1146 5 1137 1143 5 1137 1197 4 1128 1137 20 1125 1128 33 1116 1119 34 1116 1122 34 1116 1125 1 1302 1305 1 1287 1293 4 1287 1302 5 1281 1284 6 1278 1281 7 1266 1269 9 1266 1278 10 1260 1266 12 1254 1260 14 1251 1254 15 1251 1281 16 1245 1251 18 1245 1293 4 1242 1245 5 1236 1242 5 1236 1287 4 1227 1236 20 1224 1227 33 1215 1218 34 1215 1221 34 1215 1224 1 1401 1404 1 1386 1392 4 1386 1401 5 1380 1383 23 1368 1371 9 1368 1380 10 1362 1368 36 1356 1359 6 1356 1362 37 1353 1356 38 1353 1383 27 1350 1353 28 1344 1350 30 1341 1344 31 1341 1383 32 1335 1341 18 1335 1392 4 1332 1335 5 1326 1332 5 1326 1386 4 1317 1326 20 1314 1317 33 1305 1308 34 1305 1311 34 1305 1314 1 1500 1503 1 1485 1491 4 1485 1500 5 1479 1482 23 1467 1470 9 1467 1479 10 1461 1467 36 1455 1458 6 1455 1461 37 1452 1455 38 1452 1482 27 1449 1452 28 1443 1449 30 1440 1443 31 1440 1482 32 1434 1440 18 1434 1491 4 1431 1434 5 1425 1431 5 1425 1485 4 1416 1425 20 1413 1416 33 1404 1407 34 1404 1410 34 1404 1413 1 1590 1593 1 1575 1581 4 1575 1590 5 1569 1572 6 1566 1569 7 1554 1557 9 1554 1566 10 1548 1554 12 1542 1548 14 1539 1542 15 1539 1569 16 1533 1539 18 1533 1581 4 1530 1533 5 1524 1530 5 1524 1575 4 1515 1524 20 1512 1515 33 1503 1506 34 1503 1509 34 1503 1512 1 1689 1692 1 1674 1680 4 1674 1689 5 1668 1671 23 1656 1659 9 1656 1668 10 1650 1656 36 1644 1647 6 1644 1650 37 1641 1644 38 1641 1671 27 1638 1641 28 1632 1638 30 1629 1632 31 1629 1671 32 1623 1629 18 1623 1680 4 1620 1623 5 1614 1620 5 1614 1674 4 1605 1614 20 1602 1605 33 1593 1596 34 1593 1599 34 1593 1602 1 1797 1806 4 1794 1797 42 1794 1800 42 1791 1806 42 1791 1803 42 1788 1791 43 1788 1794 43 1785 1788 43 1779 1782 6 1773 1779 37 1767 1773 37 1767 1770 6 1752 1767 40 1752 1755 39 1746 1752 14 1743 1779 16 1743 1746 15 1740 1839 1 1725 1731 4 1725 1740 5 1719 1743 18 1719 1731 4 1716 1719 5 1710 1716 5 1710 1725 4 1701 1710 20 1698 1701 33 1692 1698 1 1692 1695 44 1692 1785 45 1920 1926 4 1920 1935 41 1914 1917 23 1902 1905 9 1902 1914 10 1896 1902 36 1890 1893 6 1890 1896 37 1887 1890 38 1887 1917 27 1884 1887 28 1878 1884 30 1875 1878 31 1875 1917 32 1869 1875 18 1869 1926 4 1866 1869 5 1860 1866 5 1860 1920 4 1851 1860 20 1848 1851 33 1839 1842 34 1839 1845 34 1839 1848 1 %FLAG ANGLES_INC_HYDROGEN %FORMAT(10I8) 75 72 78 3 69 66 72 5 69 66 81 6 66 72 75 7 66 72 78 7 51 48 54 10 45 48 51 12 45 48 54 12 42 39 45 14 36 33 39 17 33 39 42 19 30 33 36 22 27 24 30 26 27 24 72 27 24 72 75 7 24 72 78 7 21 24 27 31 18 15 21 6 18 15 66 5 15 66 69 5 12 6 15 34 9 6 12 35 9 6 15 34 6 15 18 36 3 6 9 39 3 6 12 39 0 3 6 41 171 168 174 3 165 162 168 5 165 162 177 6 162 168 171 7 162 168 174 7 153 150 156 42 147 150 153 42 141 138 144 10 135 138 141 12 135 138 144 12 126 123 129 52 120 123 126 55 117 114 120 26 117 114 168 27 114 168 171 7 114 168 174 7 111 114 117 31 108 105 111 6 108 105 162 5 105 162 165 5 102 96 105 34 99 96 102 35 99 96 105 34 96 105 108 36 93 96 99 61 93 96 102 61 261 258 264 3 255 252 258 5 255 252 267 6 252 258 261 7 252 258 264 7 237 234 240 10 231 234 237 12 231 234 240 12 228 225 231 14 222 219 225 17 219 225 228 19 216 219 222 22 213 210 216 26 213 210 258 27 210 258 261 7 210 258 264 7 207 210 213 31 204 201 207 6 204 201 252 5 201 252 255 5 198 192 201 34 195 192 198 35 195 192 201 34 192 201 204 36 189 192 195 61 189 192 198 61 360 357 363 3 354 351 357 5 354 351 366 6 351 357 360 7 351 357 363 7 339 336 342 10 333 336 339 12 333 336 342 12 330 327 333 66 321 327 330 71 312 309 315 52 306 309 312 55 303 300 306 26 303 300 357 27 300 357 360 7 300 357 363 7 297 300 303 31 294 291 297 6 294 291 351 5 291 351 354 5 288 282 291 34 285 282 288 35 285 282 291 34 282 291 294 36 279 282 285 61 279 282 288 61 450 447 453 3 444 441 447 5 444 441 456 6 441 447 450 7 441 447 453 7 426 423 429 10 420 423 426 12 420 423 429 12 417 414 420 14 411 408 414 17 408 414 417 19 405 408 411 22 402 399 405 26 402 399 447 27 399 447 450 7 399 447 453 7 396 399 402 31 393 390 396 6 393 390 441 5 390 441 444 5 387 381 390 34 384 381 387 35 384 381 390 34 381 390 393 36 378 381 384 61 378 381 387 61 540 537 543 3 534 531 537 5 534 531 546 6 531 537 540 7 531 537 543 7 516 513 519 10 510 513 516 12 510 513 519 12 507 504 510 14 501 498 504 17 498 504 507 19 495 498 501 22 492 489 495 26 492 489 537 27 489 537 540 7 489 537 543 7 486 489 492 31 483 480 486 6 483 480 531 5 480 531 534 5 477 471 480 34 474 471 477 35 474 471 480 34 471 480 483 36 468 471 474 61 468 471 477 61 639 636 642 3 633 630 636 5 633 630 645 6 630 636 639 7 630 636 642 7 618 615 621 10 612 615 618 12 612 615 621 12 609 606 612 66 600 606 609 71 591 588 594 52 585 588 591 55 582 579 585 26 582 579 636 27 579 636 639 7 579 636 642 7 576 579 582 31 573 570 576 6 573 570 630 5 570 630 633 5 567 561 570 34 564 561 567 35 564 561 570 34 561 570 573 36 558 561 564 61 558 561 567 61 729 726 732 3 723 720 726 5 723 720 735 6 720 726 729 7 720 726 732 7 705 702 708 10 699 702 705 12 699 702 708 12 696 693 699 14 690 687 693 17 687 693 696 19 684 687 690 22 681 678 684 26 681 678 726 27 678 726 729 7 678 726 732 7 675 678 681 31 672 669 675 6 672 669 720 5 669 720 723 5 666 660 669 34 663 660 666 35 663 660 669 34 660 669 672 36 657 660 663 61 657 660 666 61 825 822 828 3 819 816 822 5 819 816 831 6 816 822 825 7 816 822 828 7 807 804 810 71 798 804 807 71 792 786 795 3 789 786 792 3 789 786 795 3 783 786 789 78 783 786 792 78 783 786 795 78 780 777 783 17 774 777 780 22 771 768 774 26 771 768 822 27 768 822 825 7 768 822 828 7 765 768 771 31 762 759 765 6 762 759 816 5 759 816 819 5 756 750 759 34 753 750 756 35 753 750 759 34 750 759 762 36 747 750 753 61 747 750 756 61 924 921 927 3 918 915 921 5 918 915 930 85 915 921 924 7 915 921 927 7 915 930 933 86 903 900 906 10 897 900 903 12 897 900 906 12 894 891 897 66 885 891 894 71 876 873 879 52 870 873 876 55 867 864 870 26 867 864 921 27 864 921 924 7 864 921 927 7 861 864 867 31 858 855 861 6 858 855 915 5 855 915 918 5 852 846 855 34 849 846 852 35 849 846 855 34 846 855 858 36 843 846 849 61 843 846 852 61 1011 1008 1014 3 1005 1002 1008 5 1005 1002 1017 6 1002 1008 1011 7 1002 1008 1014 7 987 984 990 10 981 984 987 12 981 984 990 12 978 975 981 14 972 969 975 17 969 975 978 19 966 969 972 22 963 960 966 26 963 960 1008 27 960 1008 1011 7 960 1008 1014 7 957 960 963 31 954 951 957 6 954 951 1002 5 951 1002 1005 5 948 942 951 34 945 942 948 35 945 942 951 34 942 951 954 36 939 942 945 39 939 942 948 39 936 939 942 41 1107 1104 1110 3 1101 1098 1104 5 1101 1098 1113 6 1098 1104 1107 7 1098 1104 1110 7 1089 1086 1092 42 1083 1086 1089 42 1077 1074 1080 10 1071 1074 1077 12 1071 1074 1080 12 1062 1059 1065 52 1056 1059 1062 55 1053 1050 1056 26 1053 1050 1104 27 1050 1104 1107 7 1050 1104 1110 7 1047 1050 1053 31 1044 1041 1047 6 1044 1041 1098 5 1041 1098 1101 5 1038 1032 1041 34 1035 1032 1038 35 1035 1032 1041 34 1032 1041 1044 36 1029 1032 1035 61 1029 1032 1038 61 1206 1203 1209 3 1200 1197 1203 5 1200 1197 1212 6 1197 1203 1206 7 1197 1203 1209 7 1185 1182 1188 10 1179 1182 1185 12 1179 1182 1188 12 1176 1173 1179 66 1167 1173 1176 71 1158 1155 1161 52 1152 1155 1158 55 1149 1146 1152 26 1149 1146 1203 27 1146 1203 1206 7 1146 1203 1209 7 1143 1146 1149 31 1140 1137 1143 6 1140 1137 1197 5 1137 1197 1200 5 1134 1128 1137 34 1131 1128 1134 35 1131 1128 1137 34 1128 1137 1140 36 1125 1128 1131 61 1125 1128 1134 61 1296 1293 1299 3 1290 1287 1293 5 1290 1287 1302 6 1287 1293 1296 7 1287 1293 1299 7 1272 1269 1275 10 1266 1269 1272 12 1266 1269 1275 12 1263 1260 1266 14 1257 1254 1260 17 1254 1260 1263 19 1251 1254 1257 22 1248 1245 1251 26 1248 1245 1293 27 1245 1293 1296 7 1245 1293 1299 7 1242 1245 1248 31 1239 1236 1242 6 1239 1236 1287 5 1236 1287 1290 5 1233 1227 1236 34 1230 1227 1233 35 1230 1227 1236 34 1227 1236 1239 36 1224 1227 1230 61 1224 1227 1233 61 1395 1392 1398 3 1389 1386 1392 5 1389 1386 1401 6 1386 1392 1395 7 1386 1392 1398 7 1374 1371 1377 10 1368 1371 1374 12 1368 1371 1377 12 1365 1362 1368 66 1356 1362 1365 71 1347 1344 1350 52 1341 1344 1347 55 1338 1335 1341 26 1338 1335 1392 27 1335 1392 1395 7 1335 1392 1398 7 1332 1335 1338 31 1329 1326 1332 6 1329 1326 1386 5 1326 1386 1389 5 1323 1317 1326 34 1320 1317 1323 35 1320 1317 1326 34 1317 1326 1329 36 1314 1317 1320 61 1314 1317 1323 61 1494 1491 1497 3 1488 1485 1491 5 1488 1485 1500 6 1485 1491 1494 7 1485 1491 1497 7 1473 1470 1476 10 1467 1470 1473 12 1467 1470 1476 12 1464 1461 1467 66 1455 1461 1464 71 1446 1443 1449 52 1440 1443 1446 55 1437 1434 1440 26 1437 1434 1491 27 1434 1491 1494 7 1434 1491 1497 7 1431 1434 1437 31 1428 1425 1431 6 1428 1425 1485 5 1425 1485 1488 5 1422 1416 1425 34 1419 1416 1422 35 1419 1416 1425 34 1416 1425 1428 36 1413 1416 1419 61 1413 1416 1422 61 1584 1581 1587 3 1578 1575 1581 5 1578 1575 1590 6 1575 1581 1584 7 1575 1581 1587 7 1560 1557 1563 10 1554 1557 1560 12 1554 1557 1563 12 1551 1548 1554 14 1545 1542 1548 17 1542 1548 1551 19 1539 1542 1545 22 1536 1533 1539 26 1536 1533 1581 27 1533 1581 1584 7 1533 1581 1587 7 1530 1533 1536 31 1527 1524 1530 6 1527 1524 1575 5 1524 1575 1578 5 1521 1515 1524 34 1518 1515 1521 35 1518 1515 1524 34 1515 1524 1527 36 1512 1515 1518 61 1512 1515 1521 61 1683 1680 1686 3 1677 1674 1680 5 1677 1674 1689 6 1674 1680 1683 7 1674 1680 1686 7 1662 1659 1665 10 1656 1659 1662 12 1656 1659 1665 12 1653 1650 1656 66 1644 1650 1653 71 1635 1632 1638 52 1629 1632 1635 55 1626 1623 1629 26 1626 1623 1680 27 1623 1680 1683 7 1623 1680 1686 7 1620 1623 1626 31 1617 1614 1620 6 1617 1614 1674 5 1614 1674 1677 5 1611 1605 1614 34 1608 1605 1611 35 1608 1605 1614 34 1605 1614 1617 36 1602 1605 1608 61 1602 1605 1611 61 1833 1806 1836 3 1827 1803 1830 3 1824 1803 1827 3 1824 1803 1830 3 1818 1800 1821 3 1815 1800 1821 3 1815 1800 1818 3 1809 1797 1812 3 1806 1797 1812 7 1806 1797 1809 7 1797 1806 1836 7 1797 1806 1833 7 1794 1797 1812 91 1794 1797 1809 91 1794 1800 1821 91 1794 1800 1815 91 1794 1800 1818 91 1791 1806 1836 91 1791 1806 1833 91 1791 1803 1824 91 1791 1803 1827 91 1791 1803 1830 91 1776 1773 1779 71 1767 1773 1776 71 1761 1755 1764 3 1758 1755 1761 3 1758 1755 1764 3 1752 1755 1761 78 1752 1755 1758 78 1752 1755 1764 78 1749 1746 1752 17 1743 1746 1749 22 1734 1731 1737 3 1728 1725 1731 5 1728 1725 1740 6 1725 1731 1737 7 1725 1731 1734 7 1722 1719 1743 26 1722 1719 1731 27 1719 1731 1737 7 1719 1731 1734 7 1716 1719 1722 31 1713 1710 1716 6 1713 1710 1725 5 1710 1725 1728 5 1707 1701 1710 34 1704 1701 1710 34 1704 1701 1707 35 1701 1710 1713 36 1698 1701 1704 61 1698 1701 1707 61 1929 1926 1932 3 1923 1920 1926 5 1923 1920 1935 85 1920 1926 1929 7 1920 1926 1932 7 1920 1935 1938 86 1908 1905 1911 10 1902 1905 1908 12 1902 1905 1911 12 1899 1896 1902 66 1890 1896 1899 71 1881 1878 1884 52 1875 1878 1881 55 1872 1869 1875 26 1872 1869 1926 27 1869 1926 1929 7 1869 1926 1932 7 1866 1869 1872 31 1863 1860 1866 6 1863 1860 1920 5 1860 1920 1923 5 1857 1851 1860 34 1854 1851 1857 35 1854 1851 1860 34 1851 1860 1863 36 1848 1851 1854 61 1848 1851 1857 61 %FLAG ANGLES_WITHOUT_HYDROGEN %FORMAT(10I8) 81 84 87 1 81 84 90 1 81 84 93 2 72 66 81 4 66 81 84 8 57 60 63 9 48 45 57 11 45 57 60 13 39 45 48 15 39 45 57 16 33 30 60 18 33 39 45 20 30 24 72 21 30 33 39 23 30 60 57 24 30 60 63 25 24 30 33 28 24 30 60 29 24 72 66 30 21 15 66 4 21 24 30 32 21 24 72 4 15 21 24 33 15 66 72 30 15 66 81 4 6 15 21 37 6 15 66 38 3 6 15 40 177 180 183 1 177 180 186 1 177 180 189 2 168 162 177 4 162 177 180 8 150 156 159 43 147 150 156 44 138 135 147 11 135 132 159 45 135 147 150 46 132 135 138 47 132 135 147 48 132 159 156 49 129 132 135 50 129 132 159 51 123 120 159 53 123 129 132 54 120 114 168 21 120 123 129 56 120 159 132 57 120 159 156 58 114 120 123 59 114 120 159 60 114 168 162 30 111 105 162 4 111 114 120 32 111 114 168 4 105 111 114 33 105 162 168 30 105 162 177 4 96 105 111 37 96 105 162 38 93 96 105 62 90 84 93 1 87 84 90 63 87 84 93 1 84 93 96 64 267 270 273 1 267 270 276 1 267 270 279 2 258 252 267 4 252 267 270 8 243 246 249 9 234 231 243 11 231 243 246 13 225 231 234 15 225 231 243 16 219 216 246 18 219 225 231 20 216 210 258 21 216 219 225 23 216 246 243 24 216 246 249 25 210 216 219 28 210 216 246 29 210 258 252 30 207 201 252 4 207 210 216 32 207 210 258 4 201 207 210 33 201 252 258 30 201 252 267 4 192 201 207 37 192 201 252 38 189 192 201 62 186 180 189 1 183 180 186 63 183 180 189 1 180 189 192 64 366 369 372 1 366 369 375 1 366 369 378 2 357 351 366 4 351 366 369 8 336 333 345 11 333 345 348 65 327 333 336 67 327 333 345 68 324 321 327 69 321 318 348 70 321 327 333 72 318 321 324 73 318 321 327 74 318 348 345 49 315 318 321 75 315 318 348 51 309 306 348 53 309 315 318 54 306 300 357 21 306 309 315 56 306 348 318 57 306 348 345 58 300 306 309 59 300 306 348 60 300 357 351 30 297 291 351 4 297 300 306 32 297 300 357 4 291 297 300 33 291 351 357 30 291 351 366 4 282 291 297 37 282 291 351 38 279 282 291 62 276 270 279 1 273 270 276 63 273 270 279 1 270 279 282 64 456 459 462 1 456 459 465 1 456 459 468 2 447 441 456 4 441 456 459 8 432 435 438 9 423 420 432 11 420 432 435 13 414 420 423 15 414 420 432 16 408 405 435 18 408 414 420 20 405 399 447 21 405 408 414 23 405 435 432 24 405 435 438 25 399 405 408 28 399 405 435 29 399 447 441 30 396 390 441 4 396 399 405 32 396 399 447 4 390 396 399 33 390 441 447 30 390 441 456 4 381 390 396 37 381 390 441 38 378 381 390 62 375 369 378 1 372 369 375 63 372 369 378 1 369 378 381 64 546 549 552 1 546 549 555 1 546 549 558 2 537 531 546 4 531 546 549 8 522 525 528 9 513 510 522 11 510 522 525 13 504 510 513 15 504 510 522 16 498 495 525 18 498 504 510 20 495 489 537 21 495 498 504 23 495 525 522 24 495 525 528 25 489 495 498 28 489 495 525 29 489 537 531 30 486 480 531 4 486 489 495 32 486 489 537 4 480 486 489 33 480 531 537 30 480 531 546 4 471 480 486 37 471 480 531 38 468 471 480 62 465 459 468 1 462 459 465 63 462 459 468 1 459 468 471 64 645 648 651 1 645 648 654 1 645 648 657 2 636 630 645 4 630 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831 834 840 1 831 834 843 2 822 816 831 4 816 831 834 8 804 810 813 69 801 798 804 69 798 804 810 76 786 783 798 77 783 798 801 79 783 798 804 80 777 774 810 18 777 783 786 81 777 783 798 82 774 768 822 21 774 777 783 23 774 810 804 83 774 810 813 25 768 774 777 28 768 774 810 29 768 822 816 30 765 759 816 4 765 768 774 32 765 768 822 4 759 765 768 33 759 816 822 30 759 816 831 4 750 759 765 37 750 759 816 38 747 750 759 62 744 738 747 1 741 738 744 63 741 738 747 1 738 747 750 64 921 915 930 84 900 897 909 11 897 909 912 65 891 897 900 67 891 897 909 68 888 885 891 69 885 882 912 70 885 891 897 72 882 885 888 73 882 885 891 74 882 912 909 49 879 882 885 75 879 882 912 51 873 870 912 53 873 879 882 54 870 864 921 21 870 873 879 56 870 912 882 57 870 912 909 58 864 870 873 59 864 870 912 60 864 921 915 30 861 855 915 4 861 864 870 32 861 864 921 4 855 861 864 33 855 915 921 30 855 915 930 84 846 855 861 37 846 855 915 38 843 846 855 62 840 834 843 1 837 834 840 63 837 834 843 1 834 843 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CT H1 CT HC HC OS P O2 O2 OS CI H1 H1 CT H1 OS CT H2 N* CK H5 NB CB C O NA H CA N2 H H NC CB CT H1 CT HC HC OS P O2 O2 OS CI H1 H1 CT H1 OS CT H2 N* CM H4 CM HA CA N2 H H NC C O CT H1 CT HC HC OS P O2 O2 OS CI H1 H1 CT H1 OS CT H2 N* CK H5 NB CB C O NA H CA N2 H H NC CB CT H1 CT HC HC OS P O OS CI H1 H1 CT H1 OS CT H2 CT H1 CT HC HC OS N* CM H4 CM CT HC HC HC C O NA H C O N2 CM N2 N2 CT CT CT CT HC HC HC HC HC HC HC HC HC HC P O2 O2 OS CI H1 H1 CT H1 OS CT H2 N* CK H5 NB CB C O NA H CA N2 H H NC CB CT H1 CT HC HC OH HO %FLAG TREE_CHAIN_CLASSIFICATION %FORMAT(20a4) M M M E E M E S 3 E B S E S E B B E E S B E M E B E E M M E E M M E E M E S 3 E B S E E B B B E E S S E E B M E B E E M M E E M M E E M E S 3 E B S E S E B B E E S B E M E B E E M M E E M M E E M E S 3 E B S E E B B E B E S B E E E B M E B E E M M E E M M E E M E S 3 E B S E S E B B E E S B E M E B E E M M E E M M E E M E S 3 E B S E S E B B E E S B E M E B E E M M E E M M E E M E S 3 E B S E E B B E B E S B E E E B M E B E E 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1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 8.00000000E-01 8.00000000E-01 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.70000000E+00 1.55000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.30000000E+00 1.85000000E+00 1.50000000E+00 1.50000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.50000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.50000000E+00 1.55000000E+00 1.30000000E+00 1.70000000E+00 1.55000000E+00 1.30000000E+00 1.30000000E+00 1.55000000E+00 1.70000000E+00 1.70000000E+00 1.30000000E+00 1.70000000E+00 1.30000000E+00 1.30000000E+00 1.50000000E+00 8.00000000E-01 %FLAG SCREEN %FORMAT(5E16.8) 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 7.90000000E-01 8.50000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.60000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 7.20000000E-01 7.90000000E-01 8.50000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.60000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 7.90000000E-01 8.50000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.60000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 8.50000000E-01 7.20000000E-01 7.90000000E-01 8.50000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.60000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 7.90000000E-01 8.50000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.60000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 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8.50000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.60000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 8.60000000E-01 8.50000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 8.50000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 7.20000000E-01 7.20000000E-01 8.50000000E-01 7.90000000E-01 8.50000000E-01 7.20000000E-01 7.90000000E-01 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