BMRB

NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type subtype subsubtype
2328 1bp8 RC cing 1-original 1 unknown distance NOE simple



! CHARMm distance constraints for molecules :
! mra_acc2.pdb
!
NOE
RESET
!
ASSIGN SELE ATOM A       3 1H2*         END -
       SELE ATOM A       4 H5           END -
 KMIN    15.00 RMIN    3.00 KMAX    12.00 RMAX    3.70
ASSIGN SELE ATOM A       4 H3*          END -
       SELE ATOM A       4 H5           END -
 KMIN    15.00 RMIN    3.61 KMAX    12.00 RMAX    4.01
ASSIGN SELE ATOM A       7 H8          END -
       SELE ATOM A       7 2H2*           END -
 KMIN    15.00 RMIN    3.22 KMAX    12.00 RMAX    3.620
ASSIGN SELE ATOM A       6 H8         END -
       SELE ATOM A       5 1H2*           END -
 KMIN    15.00 RMIN    2.20 KMAX    15.00 RMAX    2.60
ASSIGN SELE ATOM B       6 H8         END -
       SELE ATOM B       5 1H2*           END -
 KMIN    15.00 RMIN    2.20 KMAX    15.00 RMAX    2.60
ASSIGN SELE ATOM A       3 2H2*         END -
       SELE ATOM A       4 H6           END -
 KMIN    15.00 RMIN    2.80 KMAX    15.00 RMAX   20.00
ASSIGN SELE ATOM B       4 H3*          END -
       SELE ATOM B       4 H4*          END -
 KMIN    15.00 RMIN    2.50 KMAX    15.00 RMAX   20.00
ASSIGN SELE ATOM B       4 H4*          END -
       SELE ATOM B       4 H6           END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX   20.00
ASSIGN SELE ATOM MIT1    1 H%M4           END -       
       SELE ATOM MIT1    1 H%M9          END -
 KMIN    12.00 RMIN    3.50 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT1    2 H%M4           END -      
       SELE ATOM MIT1    2 H%M9          END -
 KMIN    12.00 RMIN    3.50 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT2    9 H%M4           END -    
       SELE ATOM MIT2    9 H%M9          END -
 KMIN    12.00 RMIN    3.50 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT2   10 H%M4           END -      
       SELE ATOM MIT2   10 H%M9          END -
 KMIN    12.00 RMIN    3.50 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT1    1 H%M8           END -       
       SELE ATOM MIT1    1 H%M9          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT1    2 H%M8           END -      
       SELE ATOM MIT1    2 H%M9          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT2    9 H%M8           END -       
       SELE ATOM MIT2    9 H%M9          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT2   10 H%M8           END -        
       SELE ATOM MIT2   10 H%M9          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT1    1 H%M9           END -         
       SELE ATOM MIT1    1 H132          END -
 KMIN    15.00 RMIN    3.50 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT1    2 H%M9           END -       
       SELE ATOM MIT1    2 H132          END -
 KMIN    15.00 RMIN    3.50 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT2    9 H%M9           END -        
       SELE ATOM MIT2    9 H132          END -
 KMIN    15.00 RMIN    3.50 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT2   10 H%M9           END -         
       SELE ATOM MIT2   10 H132          END -
 KMIN    15.00 RMIN    3.50 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT1    1 H143           END -          
       SELE ATOM MIT1    1 H%M8         END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT1    2 H143           END -           
       SELE ATOM MIT1    2 H%M8          END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT2    9 H143           END -          
       SELE ATOM MIT2    9 H%M8         END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT2   10 H143           END -           
       SELE ATOM MIT2   10 H%M8          END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT2    9 H19           END -           
       SELE ATOM MIT2    9 H23          END -
 KMIN    15.00 RMIN    2.30 KMAX    15.00 RMAX    2.70
ASSIGN SELE ATOM MIT2   10 H19           END -          
       SELE ATOM MIT2   10 H23          END -
KMIN    15.00 RMIN    2.30 KMAX    15.00 RMAX    2.70
ASSIGN SELE ATOM MIT1    1 H19           END -         
       SELE ATOM MIT1    1 H23          END -
 KMIN    15.00 RMIN    2.30 KMAX    15.00 RMAX    2.70
ASSIGN SELE ATOM MIT1    2 H19           END -        
       SELE ATOM MIT1    2 H23          END -
 KMIN    15.00 RMIN    2.30 KMAX    15.00 RMAX    2.70
ASSIGN SELE ATOM A       3 H5           END -          
       SELE ATOM A       3 H3*          END -
 KMIN    15.00 RMIN    2.85 KMAX    15.00 RMAX    3.60
ASSIGN SELE ATOM B       2 H5           END -         
       SELE ATOM B       2 H3*          END -
 KMIN    15.00 RMIN    3.45 KMAX    12.00 RMAX    4.20
ASSIGN SELE ATOM B       2 H5           END -         
       SELE ATOM B       1 H3*          END -
 KMIN    15.00 RMIN    2.55 KMAX    12.00 RMAX    3.30
ASSIGN SELE ATOM MIT1    1 H61           END -        
       SELE ATOM MIT1    1 H58          END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.70
ASSIGN SELE ATOM MIT1    2 H61           END -         
       SELE ATOM MIT1    2 H58          END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.70
ASSIGN SELE ATOM MIT2    9 H61           END -           
       SELE ATOM MIT2    9 H58          END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.70
ASSIGN SELE ATOM MIT2   10 H61           END -          
       SELE ATOM MIT2   10 H58          END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.70
ASSIGN SELE ATOM MIT1    1 H61           END -         
       SELE ATOM MIT1    2 H75          END -
 KMIN    15.00 RMIN    2.92 KMAX    15.00 RMAX    3.37
ASSIGN SELE ATOM MIT2    9 H61           END -          
       SELE ATOM MIT2   10 H75          END -
 KMIN    15.00 RMIN    2.92 KMAX    15.00 RMAX    3.37
ASSIGN SELE ATOM MIT2   10 H61           END -          
       SELE ATOM MIT2    9 H75          END -
 KMIN    15.00 RMIN    2.92 KMAX    15.00 RMAX    3.37
ASSIGN SELE ATOM B       4 H5           END -          
       SELE ATOM B       3 H2*          END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.70
ASSIGN SELE ATOM MIT1    1 7H11           END -         
       SELE ATOM MIT2    9 H25          END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX   20.00
ASSIGN SELE ATOM MIT2   10 7H11           END -         
       SELE ATOM MIT1    2 H25         END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX   20.00
ASSIGN SELE ATOM MIT2   10 0H11           END -          
       SELE ATOM MIT2    9 H25          END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX   20.00
ASSIGN SELE ATOM MIT1    1 0H11           END -          
       SELE ATOM MIT1    2 H25          END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX   20.00
ASSIGN SELE ATOM B       3 H5           END -           
       SELE ATOM B       2 H3*          END -
 KMIN    15.00 RMIN    2.90 KMAX    15.00 RMAX   3.70
ASSIGN SELE ATOM A       5 H8           END -          
       SELE ATOM A       5 H1*          END -           
 KMIN    15.00 RMIN    3.11 KMAX    15.00 RMAX   3.48   
ASSIGN SELE ATOM MIT1    1 H6            END -
       SELE ATOM MIT1    1 H4            END -
 KMIN    15.00 RMIN    2.51 KMAX    15.00 RMAX    2.96
ASSIGN SELE ATOM MIT1    1 H9            END -
       SELE ATOM MIT1    1 H4            END -
 KMIN    15.00 RMIN    2.92 KMAX    15.00 RMAX    3.37
ASSIGN SELE ATOM MIT1    1 H12           END -
       SELE ATOM MIT1    1 H6            END -
 KMIN    15.00 RMIN    2.74 KMAX    15.00 RMAX    3.19
ASSIGN SELE ATOM MIT1    1 H12           END -
       SELE ATOM MIT1    1 H7            END -
 KMIN    15.00 RMIN    2.56 KMAX    15.00 RMAX    3.02
ASSIGN SELE ATOM MIT1    1 H12           END -
       SELE ATOM MIT1    1 H9            END -
 KMIN    15.00 RMIN    2.13 KMAX    15.00 RMAX    2.58
ASSIGN SELE ATOM MIT1    1 H19           END -
       SELE ATOM MIT1    1 H6            END -
 KMIN    15.00 RMIN    2.23 KMAX    15.00 RMAX    2.68
ASSIGN SELE ATOM MIT1    1 H19           END -
       SELE ATOM MIT1    1 H7            END -
 KMIN    15.00 RMIN    2.53 KMAX    15.00 RMAX    2.98
ASSIGN SELE ATOM MIT1    1 H19           END -
       SELE ATOM MIT1    1 H9            END -
 KMIN    15.00 RMIN    2.90 KMAX    15.00 RMAX    3.35
ASSIGN SELE ATOM MIT1    1 H19           END -
       SELE ATOM MIT1    1 H%M1          END -
 KMIN    15.00 RMIN    3.06 KMAX    15.00 RMAX    3.51
ASSIGN SELE ATOM MIT1    1 H25           END -
       SELE ATOM MIT1    1 H19           END -
 KMIN    15.00 RMIN    2.40 KMAX    15.00 RMAX    2.85
ASSIGN SELE ATOM MIT1    1 H25           END -
       SELE ATOM MIT1    1 H23           END -
 KMIN    15.00 RMIN    2.03 KMAX    15.00 RMAX    2.48
ASSIGN SELE ATOM MIT1    1 H28           END -
       SELE ATOM MIT1    1 H19           END -
 KMIN    12.00 RMIN    3.78 KMAX    12.00 RMAX    4.23
ASSIGN SELE ATOM MIT1    1 H28           END -
       SELE ATOM MIT1    1 H23           END -
 KMIN    15.00 RMIN    2.43 KMAX    15.00 RMAX    2.88
ASSIGN SELE ATOM MIT1    1 H28           END -
       SELE ATOM MIT1    1 H25           END -
 KMIN    15.00 RMIN    2.29 KMAX    15.00 RMAX    2.74
ASSIGN SELE ATOM MIT1    1 H28           END -
       SELE ATOM MIT1    1 H26           END -
 KMIN    15.00 RMIN    2.31 KMAX    15.00 RMAX    2.76
ASSIGN SELE ATOM MIT1    1 H31           END -
       SELE ATOM MIT1    1 H28           END -
 KMIN    15.00 RMIN    2.25 KMAX    15.00 RMAX    2.70
ASSIGN SELE ATOM MIT1    1 H%M2          END -
       SELE ATOM MIT1    1 H28           END -
 KMIN    15.00 RMIN    2.00 KMAX    15.00 RMAX    2.45
ASSIGN SELE ATOM MIT1    1 H38           END -
       SELE ATOM MIT1    1 H23           END -
 KMIN    15.00 RMIN    2.16 KMAX    15.00 RMAX    2.61
ASSIGN SELE ATOM MIT1    1 H38           END -
       SELE ATOM MIT1    1 H25           END -
 KMIN    15.00 RMIN    2.32 KMAX    15.00 RMAX    2.77
ASSIGN SELE ATOM MIT1    1 H38           END -
       SELE ATOM MIT1    1 H26           END -
 KMIN    15.00 RMIN    2.48 KMAX    15.00 RMAX    2.93
ASSIGN SELE ATOM MIT1    1 H38           END -
       SELE ATOM MIT1    1 H28           END -
 KMIN    15.00 RMIN    2.42 KMAX    15.00 RMAX    2.87
ASSIGN SELE ATOM MIT1    1 H38           END -
       SELE ATOM MIT1    1 H31           END -
 KMIN    15.00 RMIN    1.70 KMAX    15.00 RMAX    2.15
ASSIGN SELE ATOM MIT1    1 H38           END -
       SELE ATOM MIT1    1 H%M2          END -
 KMIN    15.00 RMIN    3.26 KMAX    15.00 RMAX    3.71
ASSIGN SELE ATOM MIT1    1 H55           END -
       SELE ATOM MIT1    1 H23           END -
 KMIN    15.00 RMIN    3.18 KMAX    15.00 RMAX    3.63
ASSIGN SELE ATOM MIT1    1 H55           END -
       SELE ATOM MIT1    1 H26           END -
 KMIN    15.00 RMIN    3.05 KMAX    15.00 RMAX    3.50
ASSIGN SELE ATOM MIT1    1 H55           END -
       SELE ATOM MIT1    1 H%M2          END -
 KMIN    15.00 RMIN    2.79 KMAX    15.00 RMAX    3.24
ASSIGN SELE ATOM MIT1    1 H55           END -
       SELE ATOM MIT1    1 H38           END -
 KMIN    15.00 RMIN    1.73 KMAX    15.00 RMAX    2.18
ASSIGN SELE ATOM MIT1    1 H58           END -
       SELE ATOM MIT1    1 H31           END -
 KMIN    15.00 RMIN    2.81 KMAX    15.00 RMAX    3.26
ASSIGN SELE ATOM MIT1    1 H58           END -
       SELE ATOM MIT1    1 H%M2          END -
 KMIN    12.00 RMIN    3.92 KMAX    12.00 RMAX    4.37
ASSIGN SELE ATOM MIT1    1 H58           END -
       SELE ATOM MIT1    1 H38           END -
 KMIN    15.00 RMIN    3.04 KMAX    15.00 RMAX    3.50
ASSIGN SELE ATOM MIT1    1 H62           END -
       SELE ATOM MIT1    1 H58           END -
 KMIN    15.00 RMIN    1.88 KMAX    15.00 RMAX    2.33
ASSIGN SELE ATOM MIT1    1 H69           END -
       SELE ATOM MIT1    1 H66           END -
 KMIN    15.00 RMIN    2.32 KMAX    15.00 RMAX    2.77
ASSIGN SELE ATOM MIT1    1 H71           END -
       SELE ATOM MIT1    1 H66           END -
 KMIN    12.00 RMIN    3.59 KMAX    12.00 RMAX    4.04
ASSIGN SELE ATOM MIT1    1 H71           END -
       SELE ATOM MIT1    1 H69           END -
 KMIN    15.00 RMIN    2.57 KMAX    15.00 RMAX    3.02
ASSIGN SELE ATOM MIT1    1 H72           END -
       SELE ATOM MIT1    1 H69           END -
 KMIN    15.00 RMIN    3.05 KMAX    15.00 RMAX    3.50
ASSIGN SELE ATOM MIT1    1 H75           END -
       SELE ATOM MIT1    1 H69           END -
 KMIN    15.00 RMIN    2.90 KMAX    15.00 RMAX    3.35
ASSIGN SELE ATOM MIT1    1 H%M4          END -
       SELE ATOM MIT1    1 H66           END -
 KMIN    15.00 RMIN    2.97 KMAX    15.00 RMAX    3.42
ASSIGN SELE ATOM MIT1    1 H%M4          END -
       SELE ATOM MIT1    1 H69           END -
 KMIN    12.00 RMIN    3.81 KMAX    12.00 RMAX    4.26
ASSIGN SELE ATOM MIT1    1 H91           END -
       SELE ATOM MIT1    1 H88           END -
 KMIN    15.00 RMIN    3.04 KMAX    15.00 RMAX    3.49
ASSIGN SELE ATOM MIT1    1 0H10          END -
       SELE ATOM MIT1    1 H88           END -
 KMIN    12.00 RMIN    3.49 KMAX    12.00 RMAX    3.94
ASSIGN SELE ATOM MIT1    1 7H10          END -
       SELE ATOM MIT1    1 0H10          END -
 KMIN    15.00 RMIN    2.40 KMAX    15.00 RMAX    2.85
ASSIGN SELE ATOM MIT1    1 7H10          END -
       SELE ATOM MIT1    1 4H10          END -
 KMIN    15.00 RMIN    2.69 KMAX    15.00 RMAX    3.14
ASSIGN SELE ATOM MIT1    1 0H11          END -
       SELE ATOM MIT1    1 7H10          END -
 KMIN    15.00 RMIN    2.23 KMAX    15.00 RMAX    2.68
ASSIGN SELE ATOM MIT1    1 7H11          END -
       SELE ATOM MIT1    1 H83           END -
 KMIN    15.00 RMIN    2.23 KMAX    15.00 RMAX    2.68
ASSIGN SELE ATOM MIT1    1 7H11          END -
       SELE ATOM MIT1    1 7H10          END -
 KMIN    15.00 RMIN    3.01 KMAX    15.00 RMAX    3.46
ASSIGN SELE ATOM MIT1    1 7H117          END -
       SELE ATOM MIT1    1 0H11          END -
 KMIN    15.00 RMIN    2.36 KMAX    15.00 RMAX    2.81
ASSIGN SELE ATOM MIT1    1 H%M9          END -
       SELE ATOM MIT1    1 H64           END -
 KMIN    12.00 RMIN    4.05 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT1    1 H%M9          END -
       SELE ATOM MIT1    1 H66           END -
 KMIN    15.00 RMIN    2.73 KMAX    15.00 RMAX    3.18
ASSIGN SELE ATOM MIT1    1 H%M9          END -
       SELE ATOM MIT1    1 3H14          END -
 KMIN    15.00 RMIN    2.33 KMAX    15.00 RMAX    2.78
ASSIGN SELE ATOM MIT1    2 H6            END -
       SELE ATOM MIT1    2 H4            END -
 KMIN    15.00 RMIN    2.55 KMAX    15.00 RMAX    3.00
ASSIGN SELE ATOM MIT1    2 H9            END -
       SELE ATOM MIT1    2 H4            END -
 KMIN    15.00 RMIN    3.21 KMAX    15.00 RMAX    3.66
ASSIGN SELE ATOM MIT1    2 H12           END -
       SELE ATOM MIT1    2 H6            END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.45
ASSIGN SELE ATOM MIT1    2 H12           END -
       SELE ATOM MIT1    2 H7            END -
 KMIN    15.00 RMIN    2.69 KMAX    15.00 RMAX    3.14
ASSIGN SELE ATOM MIT1    2 H12           END -
       SELE ATOM MIT1    2 H9            END -
 KMIN    15.00 RMIN    2.08 KMAX    15.00 RMAX    2.53
ASSIGN SELE ATOM MIT1    2 H19           END -
       SELE ATOM MIT1    2 H4            END -
 KMIN    15.00 RMIN    2.01 KMAX    15.00 RMAX    2.46
ASSIGN SELE ATOM MIT1    2 H19           END -
       SELE ATOM MIT1    2 H6            END -
 KMIN    15.00 RMIN    2.24 KMAX    15.00 RMAX    2.69
ASSIGN SELE ATOM MIT1    2 H19           END -
       SELE ATOM MIT1    2 H7            END -
 KMIN    15.00 RMIN    2.64 KMAX    15.00 RMAX    3.09
ASSIGN SELE ATOM MIT1    2 H19           END -
       SELE ATOM MIT1    2 H9            END -
 KMIN    12.00 RMIN    3.47 KMAX    12.00 RMAX    3.92
ASSIGN SELE ATOM MIT1    2 H19           END -
       SELE ATOM MIT1    2 H%M1          END -
 KMIN    15.00 RMIN    3.05 KMAX    15.00 RMAX    3.50
ASSIGN SELE ATOM MIT1    2 H25           END -
       SELE ATOM MIT1    2 H19           END -
 KMIN    15.00 RMIN    2.42 KMAX    15.00 RMAX    2.87
ASSIGN SELE ATOM MIT1    2 H25           END -
       SELE ATOM MIT1    2 H23           END -
 KMIN    15.00 RMIN    2.23 KMAX    15.00 RMAX    2.68
ASSIGN SELE ATOM MIT1    2 H28           END -
       SELE ATOM MIT1    1 7H10          END -
 KMIN    12.00 RMIN    4.04 KMAX    12.00 RMAX    4.49
ASSIGN SELE ATOM MIT1    2 H28           END -
       SELE ATOM MIT1    1 0H11          END -
 KMIN    15.00 RMIN    2.61 KMAX    15.00 RMAX    3.06
ASSIGN SELE ATOM MIT1    2 H28           END -
       SELE ATOM MIT1    2 H19           END -
 KMIN    12.00 RMIN    3.44 KMAX    12.00 RMAX    3.89
ASSIGN SELE ATOM MIT1    2 H28           END -
       SELE ATOM MIT1    2 H23           END -
 KMIN    15.00 RMIN    2.80 KMAX    15.00 RMAX    3.25
ASSIGN SELE ATOM MIT1    2 H28           END -
       SELE ATOM MIT1    2 H25           END -
 KMIN    15.00 RMIN    2.47 KMAX    15.00 RMAX    2.92
ASSIGN SELE ATOM MIT1    2 H28           END -
       SELE ATOM MIT1    2 H26           END -
 KMIN    15.00 RMIN    2.38 KMAX    15.00 RMAX    2.83
ASSIGN SELE ATOM MIT1    2 H31           END -
       SELE ATOM MIT1    2 H28           END -
 KMIN    15.00 RMIN    2.29 KMAX    15.00 RMAX    2.74
ASSIGN SELE ATOM MIT1    2 H%M2          END -
       SELE ATOM MIT1    2 H28           END -
 KMIN    15.00 RMIN    2.06 KMAX    15.00 RMAX    2.51
ASSIGN SELE ATOM MIT1    2 H38           END -
       SELE ATOM MIT1    2 H23           END -
 KMIN    15.00 RMIN    2.20 KMAX    15.00 RMAX    2.65
ASSIGN SELE ATOM MIT1    2 H38           END -
       SELE ATOM MIT1    2 H25           END -
 KMIN    15.00 RMIN    2.53 KMAX    15.00 RMAX    2.98
ASSIGN SELE ATOM MIT1    2 H38           END -
       SELE ATOM MIT1    2 H26           END -
 KMIN    15.00 RMIN    2.65 KMAX    15.00 RMAX    3.10
ASSIGN SELE ATOM MIT1    2 H38           END -
       SELE ATOM MIT1    2 H28           END -
 KMIN    15.00 RMIN    2.46 KMAX    15.00 RMAX    2.91
ASSIGN SELE ATOM MIT1    2 H38           END -
       SELE ATOM MIT1    2 H31           END -
 KMIN    15.00 RMIN    1.80 KMAX    15.00 RMAX    2.25
ASSIGN SELE ATOM MIT1    2 H38           END -
       SELE ATOM MIT1    2 H%M2          END -
 KMIN    15.00 RMIN    3.14 KMAX    15.00 RMAX    3.59
ASSIGN SELE ATOM MIT1    2 H%M3          END -
       SELE ATOM MIT1    1 4H10          END -
 KMIN    15.00 RMIN    2.85 KMAX    15.00 RMAX    3.31
ASSIGN SELE ATOM MIT1    2 H%M3          END -
       SELE ATOM MIT1    1 7H10          END -
 KMIN    15.00 RMIN    2.77 KMAX    15.00 RMAX    3.22
ASSIGN SELE ATOM MIT1    2 H%M3          END -
       SELE ATOM MIT1    1 0H11          END -
 KMIN    15.00 RMIN    2.84 KMAX    15.00 RMAX    3.24 
ASSIGN SELE ATOM MIT1    2 H%M3          END -
       SELE ATOM MIT1    1 6H12          END -
 KMIN    15.00 RMIN    3.03 KMAX    15.00 RMAX    3.48
ASSIGN SELE ATOM MIT1    2 H55           END -
       SELE ATOM MIT1    1 H%M5          END -
 KMIN    12.00 RMIN    3.39 KMAX    12.00 RMAX    3.84
ASSIGN SELE ATOM MIT1    2 H55           END -
       SELE ATOM MIT1    1 0H10          END -
 KMIN    15.00 RMIN    2.86 KMAX    15.00 RMAX    3.31
ASSIGN SELE ATOM MIT1    2 H55           END -
       SELE ATOM MIT1    1 7H10          END -
 KMIN    15.00 RMIN    3.29 KMAX    15.00 RMAX    3.69 
ASSIGN SELE ATOM MIT1    2 H55           END -
       SELE ATOM MIT1    2 H26           END -
 KMIN    15.00 RMIN    3.09 KMAX    15.00 RMAX    3.54
ASSIGN SELE ATOM MIT1    2 H55           END -
       SELE ATOM MIT1    2 H%M2          END -
 KMIN    15.00 RMIN    2.83 KMAX    15.00 RMAX    3.28
ASSIGN SELE ATOM MIT1    2 H55           END -
       SELE ATOM MIT1    2 H38           END -
 KMIN    15.00 RMIN    1.83 KMAX    15.00 RMAX    2.28
ASSIGN SELE ATOM MIT1    2 H58           END -
       SELE ATOM MIT1    1 H94           END -
 KMIN    15.00 RMIN    3.02 KMAX    15.00 RMAX    3.47
ASSIGN SELE ATOM MIT1    2 H58           END -
       SELE ATOM MIT1    1 H%M5          END -
 KMIN    12.00 RMIN    3.38 KMAX    12.00 RMAX    3.83
ASSIGN SELE ATOM MIT1    2 H58           END -
       SELE ATOM MIT1    2 H31           END -
 KMIN    15.00 RMIN    2.83 KMAX    15.00 RMAX    3.28
ASSIGN SELE ATOM MIT1    2 H58           END -
       SELE ATOM MIT1    2 H%M2          END -
 KMIN    12.00 RMIN    3.85 KMAX    12.00 RMAX    4.30
ASSIGN SELE ATOM MIT1    2 H58           END -
       SELE ATOM MIT1    2 H38           END -
 KMIN    15.00 RMIN    2.81 KMAX    15.00 RMAX    3.26
ASSIGN SELE ATOM MIT1    2 H61           END -
       SELE ATOM MIT1    1 H75           END -
 KMIN    15.00 RMIN    2.90 KMAX    15.00 RMAX    3.35
ASSIGN SELE ATOM MIT1    2 H62           END -
       SELE ATOM MIT1    2 H58           END -
 KMIN    15.00 RMIN    1.85 KMAX    15.00 RMAX    2.30
ASSIGN SELE ATOM MIT1    2 H69           END -
       SELE ATOM MIT1    2 H66           END -
 KMIN    15.00 RMIN    2.34 KMAX    15.00 RMAX    2.79
ASSIGN SELE ATOM MIT1    2 H71           END -
       SELE ATOM MIT1    2 H66           END -
 KMIN    12.00 RMIN    3.64 KMAX    12.00 RMAX    4.09
ASSIGN SELE ATOM MIT1    2 H71           END -
       SELE ATOM MIT1    2 H69           END -
 KMIN    15.00 RMIN    2.58 KMAX    15.00 RMAX    3.03
ASSIGN SELE ATOM MIT1    2 H72           END -
       SELE ATOM MIT1    2 H69           END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.45
ASSIGN SELE ATOM MIT1    2 H75           END -
       SELE ATOM MIT1    2 H69           END -
 KMIN    15.00 RMIN    2.87 KMAX    15.00 RMAX    3.32
ASSIGN SELE ATOM MIT1    2 H%M4          END -
       SELE ATOM MIT1    2 H66           END -
 KMIN    15.00 RMIN    2.90 KMAX    15.00 RMAX    3.35
ASSIGN SELE ATOM MIT1    2 H%M4          END -
       SELE ATOM MIT1    2 H69           END -
 KMIN    12.00 RMIN    4.20 KMAX    12.00 RMAX    4.65
ASSIGN SELE ATOM MIT1    2 H94           END -
       SELE ATOM MIT1    1 H58           END -
 KMIN    12.00 RMIN    3.40 KMAX    12.00 RMAX    3.85
ASSIGN SELE ATOM MIT1    2 H%M5          END -
       SELE ATOM MIT1    1 H38           END -
 KMIN    12.00 RMIN    4.19 KMAX    12.00 RMAX    4.64
ASSIGN SELE ATOM MIT1    2 H%M5          END -
       SELE ATOM MIT1    1 H55           END -
 KMIN    12.00 RMIN    3.44 KMAX    12.00 RMAX    3.89
ASSIGN SELE ATOM MIT1    2 H%M5          END -
       SELE ATOM MIT1    1 H58           END -
 KMIN    12.00 RMIN    3.36 KMAX    12.00 RMAX    3.81
ASSIGN SELE ATOM MIT1    2 0H10          END -
       SELE ATOM MIT1    2 H88           END -
 KMIN    15.00 RMIN    3.22 KMAX    15.00 RMAX    3.67
ASSIGN SELE ATOM MIT1    2 4H10          END -
       SELE ATOM MIT1    1 H%M3          END -
 KMIN    15.00 RMIN    2.98 KMAX    15.00 RMAX    3.43
ASSIGN SELE ATOM MIT1    2 7H10          END -
       SELE ATOM MIT1    1 H28           END -
 KMIN    12.00 RMIN    4.21 KMAX    12.00 RMAX    4.66
ASSIGN SELE ATOM MIT1    2 7H10          END -
       SELE ATOM MIT1    1 H%M3          END -
 KMIN    15.00 RMIN    3.11 KMAX    15.00 RMAX    3.56
ASSIGN SELE ATOM MIT1    2 7H10          END -
       SELE ATOM MIT1    1 H55           END -
 KMIN    15.00 RMIN    3.29 KMAX    15.00 RMAX    3.69 
ASSIGN SELE ATOM MIT1    2 7H10          END -
       SELE ATOM MIT1    2 H83           END -
 KMIN    15.00 RMIN    2.22 KMAX    15.00 RMAX    2.67
ASSIGN SELE ATOM MIT1    2 0H11          END -
       SELE ATOM MIT1    1 H28           END -
 KMIN    15.00 RMIN    2.57 KMAX    15.00 RMAX    3.02
ASSIGN SELE ATOM MIT1    2 0H11          END -
       SELE ATOM MIT1    1 H%M3          END -
 KMIN    15.00 RMIN    2.84 KMAX    15.00 RMAX    3.24 
ASSIGN SELE ATOM MIT1    2 0H11          END -
       SELE ATOM MIT1    2 7H10          END -
 KMIN    15.00 RMIN    2.05 KMAX    15.00 RMAX    2.50
ASSIGN SELE ATOM MIT1    2 7H11          END -
       SELE ATOM MIT1    2 H83           END -
 KMIN    15.00 RMIN    2.40 KMAX    15.00 RMAX    2.85
ASSIGN SELE ATOM MIT1    2 7H11          END -
       SELE ATOM MIT1    2 7H10          END -
 KMIN    15.00 RMIN    2.98 KMAX    15.00 RMAX    3.43
ASSIGN SELE ATOM MIT1    2 7H11          END -
       SELE ATOM MIT1    2 0H11          END -
 KMIN    15.00 RMIN    2.29 KMAX    15.00 RMAX    2.74
ASSIGN SELE ATOM MIT1    2 6H12          END -
       SELE ATOM MIT1    2 7H10          END -
 KMIN    15.00 RMIN    2.35 KMAX    15.00 RMAX    2.80
ASSIGN SELE ATOM MIT1    2 H%M9          END -
       SELE ATOM MIT1    2 H64           END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT1    2 H%M9          END -
       SELE ATOM MIT1    2 H66           END -
 KMIN    15.00 RMIN    2.73 KMAX    15.00 RMAX    3.18
ASSIGN SELE ATOM MIT1    2 H%M9          END -
       SELE ATOM MIT1    2 3H14          END -
 KMIN    15.00 RMIN    2.29 KMAX    15.00 RMAX    2.74
ASSIGN SELE ATOM A       1 H4*           END -
       SELE ATOM A       1 2H5*          END -
 KMIN    15.00 RMIN    2.71 KMAX    15.00 RMAX    3.16
ASSIGN SELE ATOM A       1 H1*           END -
       SELE ATOM MIT1    2 H%M6          END -
 KMIN    12.00 RMIN    4.38 KMAX    12.00 RMAX    4.83
ASSIGN SELE ATOM A       1 H1*           END -
       SELE ATOM MIT1    2 H%M7          END -
 KMIN    12.00 RMIN    4.84 KMAX    12.00 RMAX    5.29
ASSIGN SELE ATOM A       1 H2            END -
       SELE ATOM MIT1    1 H%M3          END -
 KMIN    15.00 RMIN    2.57 KMAX    15.00 RMAX    3.02
ASSIGN SELE ATOM A       1 H2            END -
       SELE ATOM MIT1    2 7H10          END -
 KMIN    15.00 RMIN    2.90 KMAX    15.00 RMAX    3.35
ASSIGN SELE ATOM A       1 H2            END -
       SELE ATOM MIT1    2 0H11          END -
 KMIN    15.00 RMIN    2.19 KMAX    15.00 RMAX    2.64
ASSIGN SELE ATOM A       1 H2            END -
       SELE ATOM MIT1    2 H%M6          END -
 KMIN    12.00 RMIN    4.12 KMAX    12.00 RMAX    4.57
ASSIGN SELE ATOM A       1 H2            END -
       SELE ATOM MIT1    2 H%M7          END -
 KMIN    12.00 RMIN    3.91 KMAX    12.00 RMAX    4.36
ASSIGN SELE ATOM A       1 H2            END -
       SELE ATOM A       1 H1*           END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    4.95
ASSIGN SELE ATOM A       1 H8            END -
       SELE ATOM A       1 H1*           END -
 KMIN    12.00 RMIN    4.01 KMAX    12.00 RMAX    4.46
ASSIGN SELE ATOM A       1 2H2*          END -
       SELE ATOM A       1 H8            END -
 KMIN    12.00 RMIN    4.73 KMAX    12.00 RMAX    5.18
ASSIGN SELE ATOM A       1 1H2*           END -
       SELE ATOM A       1 H8            END -
 KMIN    15.00 RMIN    2.61 KMAX    15.00 RMAX    3.06
ASSIGN SELE ATOM A       1 H3*           END -
       SELE ATOM A       1 H1*           END -
 KMIN    12.00 RMIN    3.36 KMAX    12.00 RMAX    3.81
ASSIGN SELE ATOM A       1 H3*           END -
       SELE ATOM A       1 H8            END -
 KMIN    15.00 RMIN    2.89 KMAX    15.00 RMAX    3.34
ASSIGN SELE ATOM A       2 H1*           END -
       SELE ATOM MIT1    2 0H11          END -
 KMIN    12.00 RMIN    3.40 KMAX    12.00 RMAX    3.85
ASSIGN SELE ATOM A       2 H1*           END -
       SELE ATOM A       1 H2            END -
 KMIN    15.00 RMIN    2.70 KMAX    15.00 RMAX    3.15
ASSIGN SELE ATOM A       2 H1*           END -
       SELE ATOM A       2 H4*           END -
 KMIN    15.00 RMIN    2.63 KMAX    15.00 RMAX    3.08
ASSIGN SELE ATOM A       2 H6            END -
       SELE ATOM A       1 H1*           END -
 KMIN    12.00 RMIN    3.95 KMAX    12.00 RMAX    4.40
ASSIGN SELE ATOM A       2 H6            END -
       SELE ATOM A       1 2H2*          END -
 KMIN    15.00 RMIN    3.06 KMAX    15.00 RMAX    3.51
ASSIGN SELE ATOM A       2 H6            END -
       SELE ATOM A       1 1H2*           END -
 KMIN    15.00 RMIN    2.59 KMAX    15.00 RMAX    3.04
ASSIGN SELE ATOM A       2 H6            END -
       SELE ATOM A       1 H3*           END -
 KMIN    15.00 RMIN    2.30 KMAX    15.00 RMAX    2.75
ASSIGN SELE ATOM A       2 H6            END -       
       SELE ATOM A       2 H1*           END -         
 KMIN    15.00 RMIN    3.19 KMAX    15.00 RMAX    3.64 
ASSIGN SELE ATOM A       2 H5            END -
       SELE ATOM A       1 H8            END -
 KMIN    15.00 RMIN    3.08 KMAX    15.00 RMAX    3.54
ASSIGN SELE ATOM A       2 H5            END -
       SELE ATOM A       1 H3*           END -
 KMIN    15.00 RMIN    2.60 KMAX    15.00 RMAX    3.05
ASSIGN SELE ATOM A       2 H3*           END -
       SELE ATOM A       2 H1*           END -
 KMIN    15.00 RMIN    2.75 KMAX    15.00 RMAX    3.20
ASSIGN SELE ATOM A       2 H3*           END -
       SELE ATOM A       2 H6            END -
 KMIN    15.00 RMIN    2.39 KMAX    15.00 RMAX    2.84
ASSIGN SELE ATOM A       2 H3*           END -
       SELE ATOM A       2 H5            END -
 KMIN    12.00 RMIN    3.34 KMAX    12.00 RMAX    3.79
ASSIGN SELE ATOM A       3 H4*           END -
       SELE ATOM MIT1    1 H38           END -
 KMIN    15.00 RMIN    2.80 KMAX    15.00 RMAX    3.20 
ASSIGN SELE ATOM A       3 H4*           END -
       SELE ATOM MIT1    1 H55           END -
 KMIN    12.00 RMIN    4.12 KMAX    12.00 RMAX    4.57
ASSIGN SELE ATOM A       3 H4*           END -
       SELE ATOM A       3 2H5*          END -
 KMIN    15.00 RMIN    2.36 KMAX    15.00 RMAX    2.76
ASSIGN SELE ATOM A       3 H6            END -
       SELE ATOM A       2 H1*           END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.45
ASSIGN SELE ATOM A       3 H6            END -
       SELE ATOM A       2 H3*           END -
 KMIN    12.00 RMIN    3.81 KMAX    12.00 RMAX    4.26
ASSIGN SELE ATOM A       3 H5            END -
       SELE ATOM A       2 H6            END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.40 
ASSIGN SELE ATOM A       3 H5            END -
       SELE ATOM A       2 1H2*           END -
 KMIN    15.00 RMIN    2.65 KMAX    15.00 RMAX    3.10
ASSIGN SELE ATOM A       3 H5            END -
       SELE ATOM A       2 H3*           END -
 KMIN    15.00 RMIN    3.06 KMAX    15.00 RMAX    3.51
ASSIGN SELE ATOM A       3 2H2*          END -
       SELE ATOM A       3 H1*           END -
 KMIN    15.00 RMIN    1.84 KMAX    15.00 RMAX    2.29
ASSIGN SELE ATOM A       3 2H2*          END -
       SELE ATOM A       3 H6            END -
 KMIN    15.00 RMIN    3.07 KMAX    15.00 RMAX    3.52
ASSIGN SELE ATOM A       3 1H2*           END -
       SELE ATOM A       3 H1*           END -
 KMIN    15.00 RMIN    2.30 KMAX    15.00 RMAX    2.75
ASSIGN SELE ATOM A       3 1H2*           END -
       SELE ATOM A       3 H6            END -
 KMIN    15.00 RMIN    2.64 KMAX    15.00 RMAX    3.09
ASSIGN SELE ATOM A       3 H3*           END -
       SELE ATOM A       3 H1*           END -
 KMIN    15.00 RMIN    2.60 KMAX    15.00 RMAX    3.05
ASSIGN SELE ATOM A       3 H3*           END -
       SELE ATOM A       3 H6            END -
 KMIN    15.00 RMIN    2.02 KMAX    15.00 RMAX    2.47
ASSIGN SELE ATOM A       3 H3*           END -
       SELE ATOM A       3 1H2*           END -
 KMIN    15.00 RMIN    2.53 KMAX    15.00 RMAX    2.98
ASSIGN SELE ATOM A       4 H1*           END -
       SELE ATOM MIT1    2 H%M3          END -
 KMIN    12.00 RMIN    5.00 KMAX    12.00 RMAX    5.45
ASSIGN SELE ATOM A       4 H6            END -
       SELE ATOM A       3 H1*           END -
 KMIN    15.00 RMIN    2.79 KMAX    15.00 RMAX    3.24
ASSIGN SELE ATOM A       4 H6            END -
       SELE ATOM A       3 H3*           END -
 KMIN    15.00 RMIN    2.27 KMAX    15.00 RMAX    2.72
ASSIGN SELE ATOM A       4 H6            END -       
       SELE ATOM A       4 H1*           END -       
 KMIN    15.00 RMIN    3.04 KMAX    15.00 RMAX    3.49
ASSIGN SELE ATOM A       4 H5            END -
       SELE ATOM A       3 H6            END -
 KMIN    15.00 RMIN    2.31 KMAX    15.00 RMAX    2.76
ASSIGN SELE ATOM A       4 H5            END -
       SELE ATOM A       3 2H2*          END -
 KMIN    15.00 RMIN    3.50 KMAX    15.00 RMAX    4.50
ASSIGN SELE ATOM A       4 H5            END -
       SELE ATOM A       3 H3*           END -
 KMIN    15.00 RMIN    2.77 KMAX    15.00 RMAX    3.22
ASSIGN SELE ATOM A       4 2H2*          END -
       SELE ATOM A       4 H1*           END -
 KMIN    15.00 RMIN    2.16 KMAX    15.00 RMAX    2.61
ASSIGN SELE ATOM A       4 2H2*          END -
       SELE ATOM A       4 H6            END -
 KMIN    15.00 RMIN    2.99 KMAX    15.00 RMAX    3.39 
ASSIGN SELE ATOM A       4 1H2*           END -
       SELE ATOM A       4 H1*           END -
 KMIN    15.00 RMIN    2.69 KMAX    15.00 RMAX    3.14
ASSIGN SELE ATOM A       4 H3*           END -
       SELE ATOM A       4 H1*           END -
 KMIN    15.00 RMIN    2.78 KMAX    15.00 RMAX    3.23
ASSIGN SELE ATOM A       4 H3*           END -
       SELE ATOM A       4 H6            END -
 KMIN    15.00 RMIN    2.36 KMAX    15.00 RMAX    2.81
ASSIGN SELE ATOM A       4 H3*           END -
       SELE ATOM A       4 2H2*          END -
 KMIN    15.00 RMIN    2.69 KMAX    15.00 RMAX    3.14
ASSIGN SELE ATOM A       4 H3*           END -
       SELE ATOM A       4 1H2*           END -
 KMIN    15.00 RMIN    2.36 KMAX    15.00 RMAX    2.81
ASSIGN SELE ATOM A       5 H4*           END -
       SELE ATOM MIT1    1 H%M7          END -
 KMIN    12.00 RMIN    4.40 KMAX    12.00 RMAX    4.85
ASSIGN SELE ATOM A       5 H4*           END -
       SELE ATOM A       5 2H5*          END -
 KMIN    15.00 RMIN    2.66 KMAX    15.00 RMAX    3.11
ASSIGN SELE ATOM A       5 H1*           END -
       SELE ATOM MIT1    1 H%M7          END -
 KMIN    12.00 RMIN    3.71 KMAX    12.00 RMAX    4.16
ASSIGN SELE ATOM A       5 H8            END -
       SELE ATOM A       4 H1*           END -
 KMIN    15.00 RMIN    2.75 KMAX    15.00 RMAX    3.20
ASSIGN SELE ATOM A       5 H8            END -
       SELE ATOM A       4 2H2*          END -
 KMIN    15.00 RMIN    3.04 KMAX    15.00 RMAX    3.49
ASSIGN SELE ATOM A       5 H8            END -
       SELE ATOM A       4 1H2*           END -
 KMIN    15.00 RMIN    2.53 KMAX    15.00 RMAX    2.98
ASSIGN SELE ATOM A       5 H8            END -
       SELE ATOM A       4 H3*           END -
 KMIN    15.00 RMIN    3.02 KMAX    15.00 RMAX    3.47
ASSIGN SELE ATOM A       5 H8            END -
       SELE ATOM A       5 H4*           END -
 KMIN    15.00 RMIN    3.25 KMAX    15.00 RMAX    3.70
ASSIGN SELE ATOM A       5 2H2*          END -
       SELE ATOM A       5 H8            END -
 KMIN    15.00 RMIN    2.47 KMAX    15.00 RMAX    2.92
ASSIGN SELE ATOM A       5 1H2*           END -
       SELE ATOM A       5 H8            END -
 KMIN    15.00 RMIN    2.43 KMAX    15.00 RMAX    2.88
ASSIGN SELE ATOM A       5 H3*           END -
       SELE ATOM A       5 H4*           END -
 KMIN    15.00 RMIN    2.28 KMAX    15.00 RMAX    2.73
ASSIGN SELE ATOM A       5 H3*           END -
       SELE ATOM A       5 H1*           END -
 KMIN    15.00 RMIN    2.97 KMAX    15.00 RMAX    3.42
ASSIGN SELE ATOM A       5 H3*           END -
       SELE ATOM A       5 H8            END -
 KMIN    15.00 RMIN    2.45 KMAX    15.00 RMAX    2.90
ASSIGN SELE ATOM A       6 H1*           END -
       SELE ATOM MIT1    1 H%M7          END -
 KMIN    15.00 RMIN    2.93 KMAX    15.00 RMAX    3.70
ASSIGN SELE ATOM A       6 H1*           END -
       SELE ATOM A       6 H4*           END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.45
ASSIGN SELE ATOM A       6 H8            END -
       SELE ATOM A       5 H1*           END -
 KMIN    15.00 RMIN    2.96 KMAX    15.00 RMAX    3.42
ASSIGN SELE ATOM A       6 H8            END -
       SELE ATOM A       5 H8            END -
 KMIN    12.00 RMIN    3.77 KMAX    12.00 RMAX    4.22
ASSIGN SELE ATOM A       6 H8            END -         
       SELE ATOM A       6 H1*           END -         
 KMIN    15.00 RMIN    2.93 KMAX    15.00 RMAX    3.38 
ASSIGN SELE ATOM A       6 2H2*          END -
       SELE ATOM A       6 H1*           END -
 KMIN    15.00 RMIN    1.93 KMAX    15.00 RMAX    2.33 
ASSIGN SELE ATOM A       6 H3*           END -
       SELE ATOM A       6 H1*           END -
 KMIN    15.00 RMIN    2.56 KMAX    15.00 RMAX    3.01
ASSIGN SELE ATOM A       7 H4*           END -
       SELE ATOM A       7 2H5*          END -
 KMIN    15.00 RMIN    2.47 KMAX    15.00 RMAX    2.92
ASSIGN SELE ATOM A       7 H8            END -
       SELE ATOM A       6 H1*           END -
 KMIN    15.00 RMIN    2.63 KMAX    15.00 RMAX    3.03 
ASSIGN SELE ATOM A       7 H8            END -
       SELE ATOM A       6 H8            END -
 KMIN    15.00 RMIN    3.01 KMAX    15.00 RMAX    3.46
ASSIGN SELE ATOM A       7 H8            END -
       SELE ATOM A       6 2H2*          END -
 KMIN    15.00 RMIN    2.75 KMAX    15.00 RMAX    3.20
ASSIGN SELE ATOM A       7 H8            END -
       SELE ATOM A       6 1H2*           END -
 KMIN    15.00 RMIN    2.36 KMAX    15.00 RMAX    2.81
ASSIGN SELE ATOM A       7 H8            END -
       SELE ATOM A       6 H3*           END -
 KMIN    15.00 RMIN    2.36 KMAX    15.00 RMAX    2.81
ASSIGN SELE ATOM A       7 H8            END -
       SELE ATOM A       7 H4*           END -
 KMIN    12.00 RMIN    3.93 KMAX    12.00 RMAX    4.38
ASSIGN SELE ATOM A       7 H8            END -         
       SELE ATOM A       7 H1*           END -         
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.45 
ASSIGN SELE ATOM A       7 2H2*          END -
       SELE ATOM A       7 H1*           END -
 KMIN    15.00 RMIN    2.01 KMAX    15.00 RMAX    2.46
ASSIGN SELE ATOM A       7 1H2*           END -
       SELE ATOM A       7 H1*           END -
 KMIN    15.00 RMIN    2.72 KMAX    15.00 RMAX    3.17
ASSIGN SELE ATOM A       7 1H2*           END -
       SELE ATOM A       7 H8            END -
 KMIN    15.00 RMIN    2.94 KMAX    15.00 RMAX    3.39
ASSIGN SELE ATOM A       7 H3*           END -
       SELE ATOM A       7 H8            END -
 KMIN    15.00 RMIN    2.48 KMAX    15.00 RMAX    2.93
ASSIGN SELE ATOM A       7 H3*           END -
       SELE ATOM A       7 1H2*           END -
 KMIN    15.00 RMIN    2.29 KMAX    15.00 RMAX    2.74
ASSIGN SELE ATOM A      8 H1*           END -
       SELE ATOM A      8 H4*           END -
 KMIN    15.00 RMIN    2.37 KMAX    15.00 RMAX    2.82
ASSIGN SELE ATOM A       8 H6            END -
       SELE ATOM A       7 H1*           END -
 KMIN    15.00 RMIN    2.21 KMAX    15.00 RMAX    2.66
ASSIGN SELE ATOM A       8 H6            END -
       SELE ATOM A       7 H3*           END -
 KMIN    15.00 RMIN    2.59 KMAX    15.00 RMAX    3.04
ASSIGN SELE ATOM A       8 H6            END -
       SELE ATOM A       8 H5**          END -
 KMIN    12.00 RMIN    3.79 KMAX    12.00 RMAX    4.24
ASSIGN SELE ATOM A       8 H6            END -
       SELE ATOM A       8 H4*           END -
 KMIN    15.00 RMIN    3.30 KMAX    15.00 RMAX    3.70
ASSIGN SELE ATOM A       8 H6            END -         
       SELE ATOM A       8 H1*           END -         
 KMIN    15.00 RMIN    2.60 KMAX    15.00 RMAX    3.05 
ASSIGN SELE ATOM A       8 H5+           END -
       SELE ATOM A       7 H1*           END -
 KMIN    12.00 RMIN    3.53 KMAX    12.00 RMAX    3.98
ASSIGN SELE ATOM A       8 H5+            END -
       SELE ATOM A       7 H8            END -
 KMIN    15.00 RMIN    3.14 KMAX    15.00 RMAX    3.59
ASSIGN SELE ATOM A       8 1H2*           END -
       SELE ATOM A       8 H4*           END -
 KMIN    15.00 RMIN    3.04 KMAX    15.00 RMAX    3.44 
ASSIGN SELE ATOM A       8 1H2*           END -
       SELE ATOM A       8 H6            END -
 KMIN    15.00 RMIN    2.52 KMAX    15.00 RMAX    2.97
ASSIGN SELE ATOM A       8 H3*           END -
       SELE ATOM A       8 H1*           END -
 KMIN    15.00 RMIN    2.52 KMAX    15.00 RMAX    2.97
ASSIGN SELE ATOM A       8 H3*           END -
       SELE ATOM A       8 1H2*           END -
 KMIN    15.00 RMIN    2.36 KMAX    15.00 RMAX    2.81
ASSIGN SELE ATOM B       1 H4*           END -
       SELE ATOM B       1 H5**          END -
 KMIN    15.00 RMIN    2.59 KMAX    15.00 RMAX    3.04
ASSIGN SELE ATOM B       1 H2            END -
       SELE ATOM B       1 H1*           END -
 KMIN    12.00 RMIN    4.14 KMAX    12.00 RMAX    4.59
ASSIGN SELE ATOM B       1 H8            END -
       SELE ATOM B       1 H1*           END -
 KMIN    12.00 RMIN    4.11 KMAX    12.00 RMAX    4.56
ASSIGN SELE ATOM B       1 2H2*          END -
       SELE ATOM B       1 H8            END -
 KMIN    12.00 RMIN    4.12 KMAX    12.00 RMAX    4.57
ASSIGN SELE ATOM B       1 1H2*           END -
       SELE ATOM B       1 H8            END -
 KMIN    15.00 RMIN    2.64 KMAX    15.00 RMAX    3.09
ASSIGN SELE ATOM B       1 H3*           END -
       SELE ATOM B       1 H1*           END -
 KMIN    15.00 RMIN    3.29 KMAX    15.00 RMAX    3.74
ASSIGN SELE ATOM B       1 H3*           END -
       SELE ATOM B       1 H8            END -
 KMIN    15.00 RMIN    2.90 KMAX    15.00 RMAX    3.35
ASSIGN SELE ATOM B       2 H1*           END -
       SELE ATOM B       1 H2            END -
 KMIN    15.00 RMIN    2.71 KMAX    15.00 RMAX    3.16
ASSIGN SELE ATOM B       2 H1*           END -
       SELE ATOM B       2 H4*           END -
 KMIN    15.00 RMIN    2.56 KMAX    15.00 RMAX    3.01
ASSIGN SELE ATOM B       2 H6            END -
       SELE ATOM B       1 H1*           END -
 KMIN    12.00 RMIN    4.15 KMAX    12.00 RMAX    4.60
ASSIGN SELE ATOM B       2 H6            END -
       SELE ATOM B       1 2H2*          END -
 KMIN    15.00 RMIN    3.02 KMAX    15.00 RMAX    3.47
ASSIGN SELE ATOM B       2 H6            END -
       SELE ATOM B       1 1H2*           END -
 KMIN    15.00 RMIN    2.56 KMAX    15.00 RMAX    3.01
ASSIGN SELE ATOM B       2 H6            END -
       SELE ATOM B       1 H3*           END -
 KMIN    15.00 RMIN    2.33 KMAX    15.00 RMAX    2.78
ASSIGN SELE ATOM B       2 H6            END -         
       SELE ATOM B       2 H1*           END -          
 KMIN    15.00 RMIN    3.19 KMAX    15.00 RMAX    3.64 
ASSIGN SELE ATOM B       2 H5            END -
       SELE ATOM B       1 H8            END -
 KMIN    15.00 RMIN    3.06 KMAX    15.00 RMAX    3.51
ASSIGN SELE ATOM B       2 H3*           END -
       SELE ATOM B       2 H1*           END -
 KMIN    15.00 RMIN    2.74 KMAX    15.00 RMAX    3.19
ASSIGN SELE ATOM B       2 H3*           END -
       SELE ATOM B       2 H6            END -
 KMIN    15.00 RMIN    2.40 KMAX    15.00 RMAX    2.85
ASSIGN SELE ATOM B       3 H4*           END -
       SELE ATOM B       3 2H5*          END -
 KMIN    15.00 RMIN    2.34 KMAX    15.00 RMAX    2.79
ASSIGN SELE ATOM B       3 H6            END -
       SELE ATOM B       2 H1*           END -
 KMIN    15.00 RMIN    3.18 KMAX    15.00 RMAX    3.63
ASSIGN SELE ATOM B       3 H6            END -
       SELE ATOM B       2 H3*           END -
 KMIN    15.00 RMIN    2.68 KMAX    15.00 RMAX    3.13
ASSIGN SELE ATOM B       3 H5            END -
       SELE ATOM B       2 H6            END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.4
ASSIGN SELE ATOM B       3 H5            END -
       SELE ATOM B       2 1H2*           END -
 KMIN    15.00 RMIN    2.51 KMAX    15.00 RMAX    2.96
ASSIGN SELE ATOM B       3 2H2*          END -
       SELE ATOM B       3 H1*           END -
 KMIN    15.00 RMIN    1.87 KMAX    15.00 RMAX    2.32
ASSIGN SELE ATOM B       3 2H2*          END -
       SELE ATOM B       3 H6            END -
 KMIN    15.00 RMIN    3.13 KMAX    15.00 RMAX    3.58
ASSIGN SELE ATOM B       3 1H2*           END -
       SELE ATOM B       3 H1*           END -
 KMIN    15.00 RMIN    2.45 KMAX    15.00 RMAX    2.90
ASSIGN SELE ATOM B       3 1H2*           END -
       SELE ATOM B       3 H6            END -
 KMIN    15.00 RMIN    2.72 KMAX    15.00 RMAX    3.17
ASSIGN SELE ATOM B       3 H3*           END -
       SELE ATOM B       3 H1*           END -
 KMIN    15.00 RMIN    2.63 KMAX    15.00 RMAX    3.08
ASSIGN SELE ATOM B       3 H3*           END -
       SELE ATOM B       3 H6            END -
 KMIN    15.00 RMIN    2.05 KMAX    15.00 RMAX    2.50
ASSIGN SELE ATOM B       3 H3*           END -
       SELE ATOM B       3 1H2*           END -
 KMIN    15.00 RMIN    2.47 KMAX    15.00 RMAX    2.92
ASSIGN SELE ATOM B       4 H6            END -
       SELE ATOM B       3 H1*           END -
 KMIN    15.00 RMIN    2.75 KMAX    15.00 RMAX    3.20
ASSIGN SELE ATOM B       4 H6            END -
       SELE ATOM B       3 2H2*          END -
 KMIN    12.00 RMIN    2.80 KMAX    12.00 RMAX    3.30
ASSIGN SELE ATOM B       4 H6            END -
       SELE ATOM B       3 H3*           END -
 KMIN    15.00 RMIN    2.33 KMAX    15.00 RMAX    2.78
ASSIGN SELE ATOM B       4 H6            END -         
       SELE ATOM B       4 H1*           END -         
 KMIN    15.00 RMIN    3.12 KMAX    15.00 RMAX    3.57
ASSIGN SELE ATOM B       4 H5            END -
       SELE ATOM B       3 H6            END -
 KMIN    15.00 RMIN    2.34 KMAX    15.00 RMAX    2.79
ASSIGN SELE ATOM B       4 H5            END -
       SELE ATOM B       3 2H2*          END -
 KMIN    15.00 RMIN    3.50 KMAX    15.00 RMAX    4.50
ASSIGN SELE ATOM B       4 H5            END -
       SELE ATOM B       3 H3*           END -
 KMIN    15.00 RMIN    3.61 KMAX    15.00 RMAX    4.011
ASSIGN SELE ATOM B       4 2H2*          END -
       SELE ATOM B       4 H1*           END -
 KMIN    15.00 RMIN    2.18 KMAX    15.00 RMAX    2.63
ASSIGN SELE ATOM B       4 2H2*          END -
       SELE ATOM B       4 H6            END -
 KMIN    15.00 RMIN    2.99 KMAX    15.00 RMAX    3.39 
ASSIGN SELE ATOM B       4 1H2*           END -
       SELE ATOM B       4 H1*           END -
 KMIN    15.00 RMIN    2.69 KMAX    15.00 RMAX    3.14
ASSIGN SELE ATOM B       4 H3*           END -
       SELE ATOM B       4 H1*           END -
 KMIN    15.00 RMIN    2.78 KMAX    15.00 RMAX    3.23
ASSIGN SELE ATOM B       4 H3*           END -
       SELE ATOM B       4 H6            END -
 KMIN    15.00 RMIN    2.44 KMAX    15.00 RMAX    2.89
ASSIGN SELE ATOM B       4 H3*           END -
       SELE ATOM B       4 H5            END -
 KMIN    15.00 RMIN    3.11 KMAX    15.00 RMAX    3.56
ASSIGN SELE ATOM B       4 H3*           END -
       SELE ATOM B       4 2H2*          END -
 KMIN    15.00 RMIN    2.70 KMAX    15.00 RMAX    3.15
ASSIGN SELE ATOM B       4 H3*           END -
       SELE ATOM B       4 1H2*           END -
 KMIN    15.00 RMIN    2.35 KMAX    15.00 RMAX    2.81
ASSIGN SELE ATOM B       5 H4*           END -
       SELE ATOM B       5 2H5*          END -
 KMIN    15.00 RMIN    2.66 KMAX    15.00 RMAX    3.11
ASSIGN SELE ATOM B       5 H8            END -
       SELE ATOM B       4 H1*           END -
 KMIN    15.00 RMIN    2.75 KMAX    15.00 RMAX    3.21
ASSIGN SELE ATOM B       5 H8            END -
       SELE ATOM B       4 2H2*          END -
 KMIN    15.00 RMIN    3.06 KMAX    15.00 RMAX    3.51
ASSIGN SELE ATOM B       5 H8            END -
       SELE ATOM B       4 1H2*           END -
 KMIN    15.00 RMIN    2.52 KMAX    15.00 RMAX    2.97
ASSIGN SELE ATOM B       5 H8            END -
       SELE ATOM B       4 H3*           END -
 KMIN    15.00 RMIN    3.02 KMAX    15.00 RMAX    3.47
ASSIGN SELE ATOM B       5 H8            END -
       SELE ATOM B       5 H4*           END -
 KMIN    15.00 RMIN    3.26 KMAX    15.00 RMAX    3.71
ASSIGN SELE ATOM B       5 H8            END -       
       SELE ATOM B       5 H1*           END -         
 KMIN    15.00 RMIN    3.09 KMAX    15.00 RMAX    3.54 
ASSIGN SELE ATOM B       5 2H2*          END -
       SELE ATOM B       5 H8            END -
 KMIN    15.00 RMIN    2.50 KMAX    15.00 RMAX    2.95
ASSIGN SELE ATOM B       5 1H2*           END -
       SELE ATOM B       5 H8            END -
 KMIN    15.00 RMIN    2.42 KMAX    15.00 RMAX    2.87
ASSIGN SELE ATOM B       5 H3*           END -
       SELE ATOM B       5 H4*           END -
 KMIN    15.00 RMIN    2.29 KMAX    15.00 RMAX    2.74
ASSIGN SELE ATOM B       5 H3*           END -
       SELE ATOM B       5 H1*           END -
 KMIN    15.00 RMIN    2.98 KMAX    15.00 RMAX    3.43
ASSIGN SELE ATOM B       5 H3*           END -
       SELE ATOM B       5 H8            END -
 KMIN    15.00 RMIN    2.46 KMAX    15.00 RMAX    2.91
ASSIGN SELE ATOM B       6 H1*           END -
       SELE ATOM B       6 H4*           END -
 KMIN    15.00 RMIN    2.93 KMAX    15.00 RMAX    3.45
ASSIGN SELE ATOM B       6 H8            END -
       SELE ATOM B       5 H1*           END -
 KMIN    15.00 RMIN    2.59 KMAX    15.00 RMAX    3.04
ASSIGN SELE ATOM B       6 H8            END -
       SELE ATOM B       5 H8            END -
 KMIN    12.00 RMIN    3.74 KMAX    12.00 RMAX    4.19
ASSIGN SELE ATOM B       6 H8            END -        
       SELE ATOM B       6 H1*           END -         
 KMIN    15.00 RMIN    2.93 KMAX    15.00 RMAX    3.38 
ASSIGN SELE ATOM B       6 2H2*          END -
       SELE ATOM B       6 H1*           END -
 KMIN    15.00 RMIN    1.93 KMAX    15.00 RMAX    2.33 
ASSIGN SELE ATOM B       6 1H2*           END -        
       SELE ATOM B       6 H1*           END -
 KMIN    15.00 RMIN    2.87 KMAX    15.00 RMAX    3.27
ASSIGN SELE ATOM B       6 H3*           END -
       SELE ATOM B       6 H1*           END -
 KMIN    15.00 RMIN    2.56 KMAX    15.00 RMAX    3.01
ASSIGN SELE ATOM B       7 H4*           END -
       SELE ATOM B       7 H5**          END -
 KMIN    15.00 RMIN    2.49 KMAX    15.00 RMAX    2.94
ASSIGN SELE ATOM B       7 H8            END -
       SELE ATOM B       6 H1*           END -
 KMIN    15.00 RMIN    2.63 KMAX    15.00 RMAX    3.03 
ASSIGN SELE ATOM B       7 H8            END -
       SELE ATOM B       6 H8            END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.45
ASSIGN SELE ATOM B       7 H8            END -
       SELE ATOM B       6 2H2*          END -
 KMIN    15.00 RMIN    2.75 KMAX    15.00 RMAX    3.20
ASSIGN SELE ATOM B       7 H8            END -
       SELE ATOM B       6 1H2*           END -
 KMIN    15.00 RMIN    2.36 KMAX    15.00 RMAX    2.81
ASSIGN SELE ATOM B       7 H8            END -
       SELE ATOM B       6 H3*           END -
 KMIN    15.00 RMIN    2.36 KMAX    15.00 RMAX    2.81
ASSIGN SELE ATOM B       7 H8            END -
       SELE ATOM B       7 H4*           END -
 KMIN    12.00 RMIN    3.93 KMAX    12.00 RMAX    4.38
ASSIGN SELE ATOM B       7 H8            END -         
       SELE ATOM B       7 H1*           END -         
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.45 
ASSIGN SELE ATOM B       7 2H2*          END -
       SELE ATOM B       7 H1*           END -
 KMIN    15.00 RMIN    2.03 KMAX    15.00 RMAX    2.48
ASSIGN SELE ATOM B       7 1H2*           END -
       SELE ATOM B       7 H1*           END -
 KMIN    15.00 RMIN    2.60 KMAX    15.00 RMAX    3.05
ASSIGN SELE ATOM B       7 1H2*           END -
       SELE ATOM B       7 H8            END -
 KMIN    15.00 RMIN    2.94 KMAX    15.00 RMAX    3.39
ASSIGN SELE ATOM B       7 H3*           END -
       SELE ATOM B       7 H8            END -
 KMIN    15.00 RMIN    2.47 KMAX    15.00 RMAX    2.92
ASSIGN SELE ATOM B       7 H3*           END -
       SELE ATOM B       7 1H2*           END -
 KMIN    15.00 RMIN    2.25 KMAX    15.00 RMAX    2.70
ASSIGN SELE ATOM B       8 H1*           END -
       SELE ATOM MIT1    2 H71           END -
 KMIN    15.00 RMIN    2.78 KMAX    15.00 RMAX    3.23
ASSIGN SELE ATOM B       8 H1*           END -
       SELE ATOM B       8 H4*           END -
 KMIN    15.00 RMIN    2.45 KMAX    15.00 RMAX    2.90
ASSIGN SELE ATOM B       8 1H2*           END -
       SELE ATOM B       8 H4*           END -
 KMIN    15.00 RMIN    3.04 KMAX    15.00 RMAX    3.44
ASSIGN SELE ATOM B       8 H6            END -
       SELE ATOM B       7 H1*           END -
 KMIN    15.00 RMIN    2.22 KMAX    15.00 RMAX    2.67
ASSIGN SELE ATOM B       8 H6            END -
       SELE ATOM B       7 H3*           END -
 KMIN    15.00 RMIN    2.80 KMAX    15.00 RMAX    3.20
ASSIGN SELE ATOM B       8 H6            END -
       SELE ATOM B       8 H5**          END -
 KMIN    12.00 RMIN    4.18 KMAX    12.00 RMAX    4.63
ASSIGN SELE ATOM B       8 H6            END -
       SELE ATOM B       8 H4*           END -
 KMIN    15.00 RMIN    3.30 KMAX    15.00 RMAX    3.70
ASSIGN SELE ATOM B       8 H6            END -         
       SELE ATOM B       8 H1*           END -         
 KMIN    15.00 RMIN    2.65 KMAX    15.00 RMAX    3.10 
ASSIGN SELE ATOM B       8 H5+            END -
       SELE ATOM B       7 H1*           END -
 KMIN    12.00 RMIN    3.47 KMAX    12.00 RMAX    3.92
ASSIGN SELE ATOM B       8 H5+            END -
       SELE ATOM B       7 H8            END -
 KMIN    15.00 RMIN    3.14 KMAX    15.00 RMAX    3.59
ASSIGN SELE ATOM B       8 1H2*           END -
       SELE ATOM B       8 H6            END -
 KMIN    15.00 RMIN    2.63 KMAX    15.00 RMAX    3.08
ASSIGN SELE ATOM B       8 H3*           END -
       SELE ATOM B       8 H1*           END -
 KMIN    15.00 RMIN    2.53 KMAX    15.00 RMAX    2.98
ASSIGN SELE ATOM B       8 H3*           END -
       SELE ATOM B       8 1H2*           END -
 KMIN    15.00 RMIN    2.29 KMAX    15.00 RMAX    2.75
ASSIGN SELE ATOM MIT2    9 H6            END -
       SELE ATOM MIT2    9 H4            END -
 KMIN    15.00 RMIN    2.48 KMAX    15.00 RMAX    2.93
ASSIGN SELE ATOM MIT2    9 H9            END -
       SELE ATOM MIT2    9 H4            END -
 KMIN    15.00 RMIN    3.23 KMAX    15.00 RMAX    3.68
ASSIGN SELE ATOM MIT2    9 H12           END -
       SELE ATOM MIT2    9 H6            END -
 KMIN    15.00 RMIN    3.07 KMAX    15.00 RMAX    3.52
ASSIGN SELE ATOM MIT2    9 H12           END -
       SELE ATOM MIT2    9 H7            END -
 KMIN    15.00 RMIN    2.60 KMAX    15.00 RMAX    3.05
ASSIGN SELE ATOM MIT2    9 H12           END -
       SELE ATOM MIT2    9 H9            END -
 KMIN    15.00 RMIN    2.08 KMAX    15.00 RMAX    2.53
ASSIGN SELE ATOM MIT2    9 H19           END -
       SELE ATOM MIT2    9 H4            END -
 KMIN    15.00 RMIN    1.98 KMAX    15.00 RMAX    2.43
ASSIGN SELE ATOM MIT2    9 H19           END -
       SELE ATOM MIT2    9 H6            END -
 KMIN    15.00 RMIN    2.23 KMAX    15.00 RMAX    2.68
ASSIGN SELE ATOM MIT2    9 H19           END -
       SELE ATOM MIT2    9 H7            END -
 KMIN    15.00 RMIN    2.53 KMAX    15.00 RMAX    2.98
ASSIGN SELE ATOM MIT2    9 H19           END -
       SELE ATOM MIT2    9 H9            END -
 KMIN    12.00 RMIN    3.46 KMAX    12.00 RMAX    3.91
ASSIGN SELE ATOM MIT2    9 H19           END -
       SELE ATOM MIT2    9 H%M1          END -
 KMIN    15.00 RMIN    3.01 KMAX    15.00 RMAX    3.46
ASSIGN SELE ATOM MIT2    9 H25           END -
       SELE ATOM MIT2    9 H19           END -
 KMIN    15.00 RMIN    2.43 KMAX    15.00 RMAX    2.88
ASSIGN SELE ATOM MIT2    9 H25           END -
       SELE ATOM MIT2    9 H23           END -
 KMIN    15.00 RMIN    2.17 KMAX    15.00 RMAX    2.62
ASSIGN SELE ATOM MIT2    9 H28           END -
       SELE ATOM MIT2    9 H19           END -
 KMIN    12.00 RMIN    3.47 KMAX    12.00 RMAX    3.92
ASSIGN SELE ATOM MIT2    9 H28           END -
       SELE ATOM MIT2    9 H23           END -
 KMIN    15.00 RMIN    2.81 KMAX    15.00 RMAX    3.26
ASSIGN SELE ATOM MIT2    9 H28           END -
       SELE ATOM MIT2    9 H25           END -
 KMIN    15.00 RMIN    2.41 KMAX    15.00 RMAX    2.86
ASSIGN SELE ATOM MIT2    9 H28           END -
       SELE ATOM MIT2    9 H26           END -
 KMIN    15.00 RMIN    2.37 KMAX    15.00 RMAX    2.82
ASSIGN SELE ATOM MIT2    9 H31           END -
       SELE ATOM MIT2    9 H28           END -
 KMIN    15.00 RMIN    2.29 KMAX    15.00 RMAX    2.74
ASSIGN SELE ATOM MIT2    9 H%M2          END -
       SELE ATOM MIT2    9 H28           END -
 KMIN    15.00 RMIN    1.92 KMAX    15.00 RMAX    2.37
ASSIGN SELE ATOM MIT2    9 H38           END -
       SELE ATOM MIT2    9 H23           END -
 KMIN    15.00 RMIN    2.18 KMAX    15.00 RMAX    2.63
ASSIGN SELE ATOM MIT2    9 H38           END -
       SELE ATOM MIT2    9 H25           END -
 KMIN    15.00 RMIN    2.48 KMAX    15.00 RMAX    2.93
ASSIGN SELE ATOM MIT2    9 H38           END -
       SELE ATOM MIT2    9 H26           END -
 KMIN    15.00 RMIN    2.64 KMAX    15.00 RMAX    3.09
ASSIGN SELE ATOM MIT2    9 H38           END -
       SELE ATOM MIT2    9 H28           END -
 KMIN    15.00 RMIN    2.45 KMAX    15.00 RMAX    2.90
ASSIGN SELE ATOM MIT2    9 H38           END -
       SELE ATOM MIT2    9 H31           END -
 KMIN    15.00 RMIN    1.78 KMAX    15.00 RMAX    2.23
ASSIGN SELE ATOM MIT2    9 H38           END -
       SELE ATOM MIT2    9 H%M2          END -
 KMIN    15.00 RMIN    3.22 KMAX    15.00 RMAX    3.67
ASSIGN SELE ATOM MIT2    9 H%M3          END -
       SELE ATOM MIT1    1 H%M7          END -
 KMIN    12.00 RMIN    5.07 KMAX    12.00 RMAX    5.52
ASSIGN SELE ATOM MIT2    9 H%M3          END -
       SELE ATOM B       4 H1*           END -
 KMIN    12.00 RMIN    4.83 KMAX    12.00 RMAX    5.28
ASSIGN SELE ATOM MIT2    9 H55           END -
       SELE ATOM MIT2    9 H26           END -
 KMIN    15.00 RMIN    3.08 KMAX    15.00 RMAX    3.53
ASSIGN SELE ATOM MIT2    9 H55           END -
       SELE ATOM MIT2    9 H%M2          END -
 KMIN    15.00 RMIN    2.78 KMAX    15.00 RMAX    3.23
ASSIGN SELE ATOM MIT2    9 H55           END -
       SELE ATOM MIT2    9 H38           END -
 KMIN    15.00 RMIN    1.82 KMAX    15.00 RMAX    2.27
ASSIGN SELE ATOM MIT2    9 H58           END -
       SELE ATOM MIT2    9 H31           END -
 KMIN    15.00 RMIN    2.78 KMAX    15.00 RMAX    3.23
ASSIGN SELE ATOM MIT2    9 H58           END -
       SELE ATOM MIT2    9 H%M2          END -
 KMIN    12.00 RMIN    3.96 KMAX    12.00 RMAX    4.41
ASSIGN SELE ATOM MIT2    9 H58           END -
       SELE ATOM MIT2    9 H38           END -
 KMIN    15.00 RMIN    2.81 KMAX    15.00 RMAX    3.26
ASSIGN SELE ATOM MIT2    9 H62           END -
       SELE ATOM MIT2    9 H58           END -
 KMIN    15.00 RMIN    1.85 KMAX    15.00 RMAX    2.30
ASSIGN SELE ATOM MIT2    9 H69           END -
       SELE ATOM MIT2    9 H66           END -
 KMIN    15.00 RMIN    2.33 KMAX    15.00 RMAX    2.78
ASSIGN SELE ATOM MIT2    9 H71           END -
       SELE ATOM A       8 H1*           END -
 KMIN    15.00 RMIN    2.62 KMAX    15.00 RMAX    3.07
ASSIGN SELE ATOM MIT2    9 H71           END -
       SELE ATOM MIT2    9 H66           END -
 KMIN    12.00 RMIN    3.61 KMAX    12.00 RMAX    4.06
ASSIGN SELE ATOM MIT2    9 H71           END -
       SELE ATOM MIT2    9 H69           END -
 KMIN    15.00 RMIN    2.61 KMAX    15.00 RMAX    3.06
ASSIGN SELE ATOM MIT2    9 H72           END -
       SELE ATOM MIT2    9 H69           END -
 KMIN    15.00 RMIN    3.03 KMAX    15.00 RMAX    3.48
ASSIGN SELE ATOM MIT2    9 H75           END -
       SELE ATOM MIT2    9 H69           END -
 KMIN    15.00 RMIN    2.87 KMAX    15.00 RMAX    3.32
ASSIGN SELE ATOM MIT2    9 H%M4          END -
       SELE ATOM MIT2    9 H66           END -
 KMIN    15.00 RMIN    2.82 KMAX    15.00 RMAX    3.27
ASSIGN SELE ATOM MIT2    9 H%M4          END -
       SELE ATOM MIT2    9 H69           END -
 KMIN    12.00 RMIN    4.20 KMAX    12.00 RMAX    4.65
ASSIGN SELE ATOM MIT2    9 H100          END -
       SELE ATOM MIT2    9 H88           END -
 KMIN    15.00 RMIN    3.15 KMAX    15.00 RMAX    3.60
ASSIGN SELE ATOM MIT2    9 7H10          END -
       SELE ATOM B       1 H2            END -
 KMIN    15.00 RMIN    2.85 KMAX    15.00 RMAX    3.30
ASSIGN SELE ATOM MIT2    9 7H10          END -
       SELE ATOM MIT2    9 H83           END -
 KMIN    15.00 RMIN    2.21 KMAX    15.00 RMAX    2.66
ASSIGN SELE ATOM MIT2    9 0H11          END -
       SELE ATOM B       1 H2            END -
 KMIN    15.00 RMIN    2.25 KMAX    15.00 RMAX    2.70
ASSIGN SELE ATOM MIT2    9 0H11          END -
       SELE ATOM B       2 H1*           END -
 KMIN    15.00 RMIN    3.23 KMAX    15.00 RMAX    3.68
ASSIGN SELE ATOM MIT2    9 0H11          END -
       SELE ATOM MIT2    9 7H10          END -
 KMIN    15.00 RMIN    2.11 KMAX    15.00 RMAX    2.56
ASSIGN SELE ATOM MIT2    9 H%M6          END -
       SELE ATOM B       1 H1*           END -
 KMIN    12.00 RMIN    4.37 KMAX    12.00 RMAX    4.82
ASSIGN SELE ATOM MIT2    9 H%M6          END -
       SELE ATOM B       1 H2            END -
 KMIN    12.00 RMIN    4.05 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT2    9 7H11          END -
       SELE ATOM MIT2    9 H83           END -
 KMIN    15.00 RMIN    2.40 KMAX    15.00 RMAX    2.85
ASSIGN SELE ATOM MIT2    9 7H11          END -
       SELE ATOM MIT2    9 7H10          END -
 KMIN    15.00 RMIN    2.95 KMAX    15.00 RMAX    3.40
ASSIGN SELE ATOM MIT2    9 7H11          END -
       SELE ATOM MIT2    9 0H11          END -
 KMIN    15.00 RMIN    2.35 KMAX    15.00 RMAX    2.80
ASSIGN SELE ATOM MIT2    9 H%M7          END -
       SELE ATOM B       1 H1*           END -
 KMIN    12.00 RMIN    4.80 KMAX    12.00 RMAX    5.25
ASSIGN SELE ATOM MIT2    9 H%M7          END -
       SELE ATOM B       1 H2            END -
 KMIN    12.00 RMIN    3.94 KMAX    12.00 RMAX    4.39
ASSIGN SELE ATOM MIT2    9 6H12          END -
       SELE ATOM MIT2    9 7H10          END -
 KMIN    15.00 RMIN    2.35 KMAX    15.00 RMAX    2.80
ASSIGN SELE ATOM MIT2    9 H%M9          END -
       SELE ATOM MIT2    9 H64           END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX    4.50
ASSIGN SELE ATOM MIT2    9 H%M9          END -
       SELE ATOM MIT2    9 H66           END -
 KMIN    15.00 RMIN    3.19 KMAX    15.00 RMAX    3.65
ASSIGN SELE ATOM MIT2    9 H%M9          END -
       SELE ATOM MIT2    9 3H14          END -
 KMIN    15.00 RMIN    2.46 KMAX    15.00 RMAX    2.91
ASSIGN SELE ATOM MIT2   10 H6            END -
       SELE ATOM MIT2   10 H4            END -
 KMIN    15.00 RMIN    2.54 KMAX    15.00 RMAX    2.99
ASSIGN SELE ATOM MIT2   10 H9            END -
       SELE ATOM MIT2   10 H4            END -
 KMIN    15.00 RMIN    3.23 KMAX    15.00 RMAX    3.68
ASSIGN SELE ATOM MIT2   10 H12           END -
       SELE ATOM MIT2   10 H6            END -
 KMIN    15.00 RMIN    3.07 KMAX    15.00 RMAX    3.52
ASSIGN SELE ATOM MIT2   10 H12           END -
       SELE ATOM MIT2   10 H7            END -
 KMIN    15.00 RMIN    2.61 KMAX    15.00 RMAX    3.06
ASSIGN SELE ATOM MIT2   10 H12           END -
       SELE ATOM MIT2   10 H9            END -
 KMIN    15.00 RMIN    2.04 KMAX    15.00 RMAX    2.49
ASSIGN SELE ATOM MIT2   10 H19           END -
       SELE ATOM MIT2   10 H4            END -
 KMIN    15.00 RMIN    1.90 KMAX    15.00 RMAX    2.35
ASSIGN SELE ATOM MIT2   10 H19           END -
       SELE ATOM MIT2   10 H6            END -
 KMIN    15.00 RMIN    2.17 KMAX    15.00 RMAX    2.62
ASSIGN SELE ATOM MIT2   10 H19           END -
       SELE ATOM MIT2   10 H7            END -
 KMIN    15.00 RMIN    2.63 KMAX    15.00 RMAX    3.08
ASSIGN SELE ATOM MIT2   10 H19           END -
       SELE ATOM MIT2   10 H9            END -
 KMIN    12.00 RMIN    3.96 KMAX    12.00 RMAX    4.41
ASSIGN SELE ATOM MIT2   10 H19           END -
       SELE ATOM MIT2   10 H%M1          END -
 KMIN    15.00 RMIN    2.94 KMAX    15.00 RMAX    3.39
ASSIGN SELE ATOM MIT2   10 H25           END -
       SELE ATOM MIT2   10 H19           END -
 KMIN    15.00 RMIN    3.19 KMAX    15.00 RMAX    3.64
ASSIGN SELE ATOM MIT2   10 H25           END -
       SELE ATOM MIT2   10 H23           END -
 KMIN    15.00 RMIN    2.25 KMAX    15.00 RMAX    2.70
ASSIGN SELE ATOM MIT2   10 H28           END -
       SELE ATOM MIT2    9 7H10          END -
 KMIN    12.00 RMIN    4.08 KMAX    12.00 RMAX    4.54
ASSIGN SELE ATOM MIT2   10 H28           END -
       SELE ATOM MIT2    9 0H11          END -
 KMIN    15.00 RMIN    2.52 KMAX    15.00 RMAX    2.97
ASSIGN SELE ATOM MIT2   10 H28           END -
       SELE ATOM MIT2   10 H19           END -
 KMIN    12.00 RMIN    4.56 KMAX    12.00 RMAX    5.01
ASSIGN SELE ATOM MIT2   10 H28           END -
       SELE ATOM MIT2   10 H23           END -
 KMIN    15.00 RMIN    2.47 KMAX    15.00 RMAX    2.92
ASSIGN SELE ATOM MIT2   10 H28           END -
       SELE ATOM MIT2   10 H25           END -
 KMIN    15.00 RMIN    2.42 KMAX    15.00 RMAX    2.87
ASSIGN SELE ATOM MIT2   10 H28           END -
       SELE ATOM MIT2   10 H26           END -
 KMIN    15.00 RMIN    2.15 KMAX    15.00 RMAX    2.60
ASSIGN SELE ATOM MIT2   10 H31           END -
       SELE ATOM MIT2   10 H28           END -
 KMIN    15.00 RMIN    2.22 KMAX    15.00 RMAX    2.67
ASSIGN SELE ATOM MIT2   10 H%M2          END -
       SELE ATOM MIT2   10 H28           END -
 KMIN    15.00 RMIN    1.94 KMAX    15.00 RMAX    2.39
ASSIGN SELE ATOM MIT2   10 H38           END -
       SELE ATOM B       3 H4*           END -
 KMIN    15.00 RMIN    2.80 KMAX    15.00 RMAX    3.20 
ASSIGN SELE ATOM MIT2   10 H38           END -
       SELE ATOM MIT2    9 H%M5          END -
 KMIN    12.00 RMIN    4.31 KMAX    12.00 RMAX    4.76
ASSIGN SELE ATOM MIT2   10 H38           END -
       SELE ATOM MIT2   0 H23           END -
 KMIN    15.00 RMIN    2.22 KMAX    15.00 RMAX    2.67
ASSIGN SELE ATOM MIT2   10 H38           END -
       SELE ATOM MIT2   10 H25           END -
 KMIN    15.00 RMIN    2.40 KMAX    15.00 RMAX    2.85
ASSIGN SELE ATOM MIT2   10 H38           END -
       SELE ATOM MIT2   10 H26           END -
 KMIN    15.00 RMIN    2.46 KMAX    15.00 RMAX    2.91
ASSIGN SELE ATOM MIT2   10 H38           END -
       SELE ATOM MIT2   10 H28           END -
 KMIN    15.00 RMIN    2.40 KMAX    15.00 RMAX    2.85
ASSIGN SELE ATOM MIT2   10 H38           END -
       SELE ATOM MIT2   10 H31           END -
 KMIN    15.00 RMIN    1.70 KMAX    15.00 RMAX    2.15
ASSIGN SELE ATOM MIT2   10 H38           END -
       SELE ATOM MIT2   10 H%M2          END -
 KMIN    12.00 RMIN    3.36 KMAX    12.00 RMAX    3.81
ASSIGN SELE ATOM MIT2   10 H%M3          END -
       SELE ATOM B       1 H2            END -
 KMIN    15.00 RMIN    2.61 KMAX    15.00 RMAX    3.06
ASSIGN SELE ATOM MIT2   10 H%M3          END -
       SELE ATOM MIT2    9 4H10          END -
 KMIN    15.00 RMIN    2.75 KMAX    15.00 RMAX    3.20
ASSIGN SELE ATOM MIT2   10 H%M3          END -
       SELE ATOM MIT2    9 7H10          END -
 KMIN    15.00 RMIN    3.00 KMAX    15.00 RMAX    3.45
ASSIGN SELE ATOM MIT2   10 H%M3          END -
       SELE ATOM MIT2    9 0H11          END -
 KMIN    15.00 RMIN    2.84 KMAX    15.00 RMAX    3.24
ASSIGN SELE ATOM MIT2   10 H55           END -
       SELE ATOM B       3 H4*           END -
 KMIN    12.00 RMIN    4.09 KMAX    12.00 RMAX    4.54
ASSIGN SELE ATOM MIT2   10 H55           END -
       SELE ATOM MIT2    9 H%M5          END -
 KMIN    12.00 RMIN    3.51 KMAX    12.00 RMAX    3.96
ASSIGN SELE ATOM MIT2   10 H55           END -
       SELE ATOM MIT2    9 7H10          END -
 KMIN    15.00 RMIN    3.29 KMAX    15.00 RMAX    3.69
ASSIGN SELE ATOM MIT2   10 H55           END -
       SELE ATOM MIT2   10 H23           END -
 KMIN    12.00 RMIN    3.33 KMAX    12.00 RMAX    3.78
ASSIGN SELE ATOM MIT2   10 H55           END -
       SELE ATOM MIT2   10 H26           END -
 KMIN    15.00 RMIN    2.96 KMAX    15.00 RMAX    3.41
ASSIGN SELE ATOM MIT2   10 H55           END -
       SELE ATOM MIT2   10 H%M2          END -
 KMIN    15.00 RMIN    2.79 KMAX    15.00 RMAX    3.24
ASSIGN SELE ATOM MIT2   10 H55           END -
       SELE ATOM MIT2   10 H38           END -
 KMIN    15.00 RMIN    1.73 KMAX    15.00 RMAX    2.18
ASSIGN SELE ATOM MIT2   10 H58           END -
       SELE ATOM MIT2    9 H94           END -
 KMIN    15.00 RMIN    3.07 KMAX    15.00 RMAX    3.52
ASSIGN SELE ATOM MIT2   10 H58           END -
       SELE ATOM MIT2    9 H%M5          END -
 KMIN    12.00 RMIN    3.136 KMAX    12.00 RMAX    3.81
ASSIGN SELE ATOM MIT2   10 H58           END -
       SELE ATOM MIT2   10 H31           END -
 KMIN    15.00 RMIN    2.80 KMAX    15.00 RMAX    3.25
ASSIGN SELE ATOM MIT2   10 H58           END -
       SELE ATOM MIT2   10 H%M2          END -
 KMIN    12.00 RMIN    3.93 KMAX    12.00 RMAX    4.38
ASSIGN SELE ATOM MIT2   10 H58           END -
       SELE ATOM MIT2   10 H38           END -
 KMIN    15.00 RMIN    3.09 KMAX    15.00 RMAX    3.54
ASSIGN SELE ATOM MIT2   10 H62           END -
       SELE ATOM MIT2   10 H58           END -
 KMIN    15.00 RMIN    1.86 KMAX    15.00 RMAX    2.31
ASSIGN SELE ATOM MIT2   10 H69           END -
       SELE ATOM MIT2   10 H66           END -
 KMIN    15.00 RMIN    2.32 KMAX    15.00 RMAX    2.77
ASSIGN SELE ATOM MIT2   10 H71           END -
       SELE ATOM MIT2   10 H66           END -
 KMIN    12.00 RMIN    3.61 KMAX    12.00 RMAX    4.06
ASSIGN SELE ATOM MIT2   10 H71           END -
       SELE ATOM MIT2   10 H69           END -
 KMIN    15.00 RMIN    2.60 KMAX    15.00 RMAX    3.05
ASSIGN SELE ATOM MIT2   10 H72           END -
       SELE ATOM MIT2   10 H69           END -
 KMIN    15.00 RMIN    3.03 KMAX    15.00 RMAX    3.48
ASSIGN SELE ATOM MIT2   10 H75           END -
       SELE ATOM MIT2   10 H69           END -
 KMIN    15.00 RMIN    2.90 KMAX    15.00 RMAX    3.35
ASSIGN SELE ATOM MIT2   10 H%M4          END -
       SELE ATOM MIT2   10 H66           END -
 KMIN    15.00 RMIN    2.93 KMAX    15.00 RMAX    3.38
ASSIGN SELE ATOM MIT2   10 H%M4          END -
       SELE ATOM MIT2   10 H69           END -
 KMIN    12.00 RMIN    3.85 KMAX    12.00 RMAX    4.30
ASSIGN SELE ATOM MIT2   10 H91           END -
       SELE ATOM MIT2   10 H88           END -
 KMIN    15.00 RMIN    3.04 KMAX    15.00 RMAX    3.49
ASSIGN SELE ATOM MIT2   10 H94           END -
       SELE ATOM MIT2    9 H58           END -
 KMIN    15.00 RMIN    3.02 KMAX    15.00 RMAX    3.47
ASSIGN SELE ATOM MIT2   10 H%M5          END -
       SELE ATOM MIT2    9 H55           END -
 KMIN    15.00 RMIN    3.28 KMAX    15.00 RMAX    3.73
ASSIGN SELE ATOM MIT2   10 H%M5          END -
       SELE ATOM MIT2    9 H58           END -
 KMIN    15.00 RMIN    3.21 KMAX    15.00 RMAX    3.66
ASSIGN SELE ATOM MIT2   10 0H10          END -
       SELE ATOM MIT2    9 H55           END -
 KMIN    15.00 RMIN    2.86 KMAX    15.00 RMAX    3.31
ASSIGN SELE ATOM MIT2   10 0H10          END -
       SELE ATOM MIT2   10 H88           END -
 KMIN    12.00 RMIN    3.49 KMAX    12.00 RMAX    3.94
ASSIGN SELE ATOM MIT2   10 4H10          END -
       SELE ATOM MIT2    9 H%M3          END -
 KMIN    15.00 RMIN    2.85 KMAX    15.00 RMAX    3.31
ASSIGN SELE ATOM MIT2   10 7H10          END -
       SELE ATOM MIT2    9 H28           END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX    4.45
ASSIGN SELE ATOM MIT2   10 7H10          END -
       SELE ATOM MIT2    9 H%M3          END -
 KMIN    15.00 RMIN    2.77 KMAX    15.00 RMAX    3.22
ASSIGN SELE ATOM MIT2   10 7H10          END -
       SELE ATOM MIT2    9 H55           END -
 KMIN    15.00 RMIN    3.29 KMAX    15.00 RMAX    3.69 
ASSIGN SELE ATOM MIT2   10 7H10          END -
       SELE ATOM MIT2   10 0H10          END -
 KMIN    15.00 RMIN    2.40 KMAX    15.00 RMAX    2.85
ASSIGN SELE ATOM MIT2   10 7H10          END -
       SELE ATOM MIT2   10 4H10          END -
 KMIN    15.00 RMIN    2.69 KMAX    15.00 RMAX    3.14
ASSIGN SELE ATOM MIT2   10 0H11          END -
       SELE ATOM MIT2    9 H28           END -
 KMIN    15.00 RMIN    2.61 KMAX    15.00 RMAX    3.06
ASSIGN SELE ATOM MIT2   10 H011          END -
       SELE ATOM MIT2    9 H%M3          END -
 KMIN    15.00 RMIN    2.84 KMAX    15.00 RMAX    3.24 
ASSIGN SELE ATOM MIT2   10 0H11          END -
       SELE ATOM MIT2   10 7H10          END -
 KMIN    15.00 RMIN    2.24 KMAX    15.00 RMAX    2.69
ASSIGN SELE ATOM MIT2   10  7H11          END -
       SELE ATOM MIT2   10 H83           END -
 KMIN    15.00 RMIN    2.21 KMAX    15.00 RMAX    2.66
ASSIGN SELE ATOM MIT2   10 7H11          END -
       SELE ATOM MIT2   10 7H10          END -
 KMIN    15.00 RMIN    2.99 KMAX    15.00 RMAX    3.44
ASSIGN SELE ATOM MIT2   10 7H11          END -
       SELE ATOM MIT2   10 0H11          END -
 KMIN    15.00 RMIN    2.34 KMAX    15.00 RMAX    2.79
ASSIGN SELE ATOM MIT2   10 H%M7          END -
       SELE ATOM MIT1    2 H%M3          END -
 KMIN    12.00 RMIN    4.74 KMAX    12.00 RMAX    5.19
ASSIGN SELE ATOM MIT2   10 H%M7          END -
       SELE ATOM B       5 H4*           END -
 KMIN    12.00 RMIN    4.34 KMAX    12.00 RMAX    4.79
ASSIGN SELE ATOM MIT2   10 H%M7          END -
       SELE ATOM B       5 H1*           END -
 KMIN    12.00 RMIN    3.56 KMAX    12.00 RMAX    4.02
ASSIGN SELE ATOM MIT2   10 H%M7          END -
       SELE ATOM B       6 H1*           END -
 KMIN    15.00 RMIN    2.94 KMAX    15.00 RMAX    3.70
ASSIGN SELE ATOM MIT2   10 6H12          END -
       SELE ATOM MIT2    9 H%M3          END -
 KMIN    15.00 RMIN    3.04 KMAX    15.00 RMAX    3.49
ASSIGN SELE ATOM MIT2   10 H%M9          END -
       SELE ATOM MIT2   10 H64           END -
 KMIN    12.00 RMIN    4.00 KMAX    12.00 RMAX    4.45
ASSIGN SELE ATOM MIT2   10 H%M9          END -
       SELE ATOM MIT2   10 H66           END -
 KMIN    15.00 RMIN    2.72 KMAX    15.00 RMAX    3.17
ASSIGN SELE ATOM MIT2   10 H%M9          END -
       SELE ATOM MIT2   10 3H14          END -
 KMIN    15.00 RMIN    2.31 KMAX    15.00 RMAX    2.76
ASSIGN SELE ATOM MIT1    1 H66           END -
       SELE ATOM MIT1    1 2H13          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT1    2 H66           END -
       SELE ATOM MIT1    2 2H13          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT2   9 H66           END -
       SELE ATOM MIT2   9 2H13          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT2   10 H66           END -
       SELE ATOM MIT2   10 2H13          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT1    1 H66           END -
       SELE ATOM MIT1    1 6H13          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT1    2 H66           END -
       SELE ATOM MIT1    2 6H13          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT2    9 H66           END -
       SELE ATOM MIT2    9 6H13          END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT2   10 H66           END -
       SELE ATOM MIT2   10 6H13           END -
 KMIN    12.00 RMIN    4.50 KMAX    12.00 RMAX    20.00
ASSIGN SELE ATOM MIT1    1 H64           END -
       SELE ATOM MIT1    1 2H13          END -
 KMIN    15.00 RMIN    2.50 KMAX    15.00 RMAX    3.50
ASSIGN SELE ATOM MIT1    2 H64           END -
       SELE ATOM MIT1    2 2H13          END -
 KMIN    15.00 RMIN    2.50 KMAX    15.00 RMAX    3.50
ASSIGN SELE ATOM MIT2    9 H64           END -
       SELE ATOM MIT2    9 2H13          END -
 KMIN    15.00 RMIN    2.50 KMAX    15.00 RMAX    3.50
ASSIGN SELE ATOM MIT2   10 H64           END -
       SELE ATOM MIT2   10 2H13          END -
 KMIN    15.00 RMIN    2.50 KMAX    15.00 RMAX    3.50
ASSIGN SELE ATOM B       2 O2            END -
       SELE ATOM MIT2    9 MG2           END -
 KMIN    25.00 RMIN    4.00 KMAX    25.00 RMAX    4.40
ASSIGN SELE ATOM B       3 O2            END -
       SELE ATOM MIT2    9 MG2           END -
 KMIN    25.00 RMIN    4.00 KMAX    25.00 RMAX    4.40
ASSIGN SELE ATOM A       6 N2            END -
       SELE ATOM MIT2    9 MG2           END -
 KMIN    25.00 RMIN    4.00 KMAX    25.00 RMAX    4.40
ASSIGN SELE ATOM A       7 N2            END -
       SELE ATOM MIT2    9 MG2           END -
 KMIN    25.00 RMIN    4.00 KMAX    25.00 RMAX    4.40
ASSIGN SELE ATOM A       2 O2            END -
       SELE ATOM MIT1    1 MG1           END -
 KMIN    25.00 RMIN    4.00 KMAX    25.00 RMAX    4.40
ASSIGN SELE ATOM A       3 O2            END -
       SELE ATOM MIT1    1 MG1           END -
 KMIN    25.00 RMIN    4.00 KMAX    25.00 RMAX    4.40
ASSIGN SELE ATOM B       6 N2            END -
       SELE ATOM MIT1    1 MG1           END -
 KMIN    25.00 RMIN    4.00 KMAX    25.00 RMAX    4.40
ASSIGN SELE ATOM B       7 N2            END -
       SELE ATOM MIT1    1 MG1           END -
 KMIN    25.00 RMIN    4.00 KMAX    25.00 RMAX    4.40
ASSIGN SELE ATOM MIT1    1 0H10        END -                  
       SELE ATOM MIT1    1 4H10        END -
 KMIN    15.00 RMIN     2.00 KMAX    15.00 RMAX        2.50
ASSIGN SELE ATOM MIT1    2 0H10        END -
       SELE ATOM MIT1    2 4H10        END - 
 KMIN    15.00 RMIN     2.00 KMAX    15.00 RMAX        2.50
ASSIGN SELE ATOM MIT2    10 0H10        END -
       SELE ATOM MIT2    10 4H10        END -  
 KMIN    15.00 RMIN     2.00 KMAX    15.00 RMAX        2.50
ASSIGN SELE ATOM MIT2     9 0H10        END -
       SELE ATOM MIT2     9 4H10        END -
 KMIN    15.00 RMIN     2.00 KMAX    15.00 RMAX        2.50
ASSIGN SELE ATOM MIT1     1 H94         END -
       SELE ATOM MIT1     1 H88         END -
 KMIN    15.00 RMIN     2.00 KMAX    15.00 RMAX        3.00
ASSIGN SELE ATOM MIT1     2 H94         END -
       SELE ATOM MIT1     2 H88         END - 
 KMIN    15.00 RMIN     2.00 KMAX    15.00 RMAX        3.00
ASSIGN SELE ATOM MIT2    10 H94         END -
       SELE ATOM MIT2    10 H88         END -  
 KMIN    15.00 RMIN     2.00 KMAX    15.00 RMAX        3.00
ASSIGN SELE ATOM MIT2     9 H94         END -
       SELE ATOM MIT2     9 H88         END -
 KMIN    15.00 RMIN     2.00 KMAX    15.00 RMAX        3.00
ASSIGN SELE ATOM MIT1     1 4H10         END -
       SELE ATOM MIT1     1 H%M5         END -
 KMIN    15.00 RMIN     3.50 KMAX    12.00 RMAX        4.50
ASSIGN SELE ATOM MIT1     2 4H10         END -             
       SELE ATOM MIT1     2 H%M5         END -
 KMIN    15.00 RMIN     3.50 KMAX    12.00 RMAX      4.50
ASSIGN SELE ATOM MIT2    10 4H10         END -             
       SELE ATOM MIT2    10 H%M5         END -
 KMIN    15.00 RMIN     3.50 KMAX    12.00 RMAX      4.50
ASSIGN SELE ATOM MIT2     9 4H10         END -
       SELE ATOM MIT2     9 H%M5         END -
 KMIN    15.00 RMIN     3.50 KMAX    12.00 RMAX      4.50
ASSIGN SELE ATOM MIT1     2 H%M3         END -
       SELE ATOM B        5 H22          END -
 KMIN    15.00 RMIN     3.00 KMAX    12.00 RMAX      4.50
ASSIGN SELE ATOM MIT2     9 H%M3         END -
       SELE ATOM A        5 H22          END -
 KMIN    15.00 RMIN     3.00 KMAX    12.00 RMAX      4.50
ASSIGN SELE ATOM MIT1     1 5H14          END -
       SELE ATOM A        3 H1*           END -
 KMIN    15.00 RMIN     2.50 KMAX    12.00 RMAX      4.50
ASSIGN SELE ATOM B        3 H1*          END -             
       SELE ATOM MIT2    10 H%M3         END -
 KMIN    12.00 RMIN     4.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        6 H1*          END -               
       SELE ATOM MIT1     1 H%M6         END -
 KMIN    12.00 RMIN     5.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        5 H1*          END -                  
       SELE ATOM MIT2    10 7H11         END -
 KMIN    12.00 RMIN     5.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        6 H1*          END -             
       SELE ATOM MIT2    10 H%M6         END -
 KMIN    12.00 RMIN     5.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        5 H1*           END -       
       SELE ATOM MIT1     1 7H11         END -
 KMIN    12.00 RMIN     5.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        3 H1*          END -
       SELE ATOM MIT1     1 H%M3         END -
 KMIN    12.00 RMIN     4.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        4 H6           END -             
       SELE ATOM B        3 H2*          END -
 KMIN    12.00 RMIN     2.50 KMAX    12.00 RMAX      4.00
ASSIGN SELE ATOM MIT1     2 H%M3         END -             
       SELE ATOM B        5 H1*          END -
 KMIN    12.00 RMIN     5.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM MIT2     9 H%M3         END -
       SELE ATOM A        5 H1*          END -
 KMIN    12.00 RMIN     5.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM MIT1     1 7H10         END -             
       SELE ATOM MIT1     2 H38          END -
 KMIN    12.00 RMIN     4.00 KMAX    12.00 RMAX      6.00
ASSIGN SELE ATOM MIT1     1 H38          END -
       SELE ATOM MIT1     2 7H10         END -
 KMIN    12.00 RMIN     4.00 KMAX    12.00 RMAX      6.00
ASSIGN SELE ATOM MIT2     9 7H10         END -
       SELE ATOM MIT2    10 H38          END -
 KMIN    12.00 RMIN     4.00 KMAX    12.00 RMAX      6.00
ASSIGN SELE ATOM MIT2     9 H38          END -
       SELE ATOM MIT2    10 7H10         END -
 KMIN    12.00 RMIN     4.00 KMAX    12.00 RMAX      6.00
!
! Backbone Constraints H2*/2** - H5*/H5** n, n-1
!
ASSIGN SELE ATOM B        1 1H2*          END -
       SELE ATOM B        2 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        1 2H2*         END -
       SELE ATOM B        2 1H5*          END -
 KMIN    12.00 RMIN    3.50 KMAX     12.00 RMAX     20.00
ASSIGN SELE ATOM B        1 1H2*          END -
       SELE ATOM B        2 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        1 2H2*         END -
       SELE ATOM B        2 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        2 1H2*          END -
       SELE ATOM B        3 2H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        2 2H2*         END -
       SELE ATOM B        3 1H5*          END -
 KMIN    12.00 RMIN    3.50 KMAX     12.00 RMAX     20.00
ASSIGN SELE ATOM B        2 1H2*          END -
       SELE ATOM B        3 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        2 2H2*         END -
       SELE ATOM B        3 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        3 1H2*          END -
       SELE ATOM B        4 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        3 2H2*         END -
       SELE ATOM B        4 1H5*          END -
 KMIN    12.00 RMIN    3.50 KMAX     12.00 RMAX     20.00
ASSIGN SELE ATOM B        3 1H2*          END -
       SELE ATOM B        4 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        3 2H2*         END -
       SELE ATOM B        4 2H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        4 1H2*          END -
       SELE ATOM B        5 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        4 2H2*         END -
       SELE ATOM B        5 1H5*          END -
 KMIN    12.00 RMIN    3.50 KMAX     12.00 RMAX     20.00
ASSIGN SELE ATOM B        4 1H2*          END -
       SELE ATOM B        5 1H5**         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        4 2H2*         END -
       SELE ATOM B        5 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        5 1H2*          END -
       SELE ATOM B        6 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        5 2H2*         END -
       SELE ATOM B        6 1H5*          END -
 KMIN    12.00 RMIN    3.50 KMAX     12.00 RMAX     20.00
ASSIGN SELE ATOM B        5 1H2*          END -
       SELE ATOM B        6 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        5 2H2*         END -
       SELE ATOM B        6 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        6 1H2*          END -
       SELE ATOM B        7 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        6 2H2*         END -
       SELE ATOM B        7 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX     12.00 RMAX     20.00
ASSIGN SELE ATOM B        6 1H2*          END -
       SELE ATOM B        7 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        6 2H2*         END -
       SELE ATOM B        7 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        7 1H2*          END -
       SELE ATOM B        8 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        7 2H2*         END -
       SELE ATOM B        8 1H5*          END -
 KMIN    12.00 RMIN    3.50 KMAX     12.00 RMAX     20.00
ASSIGN SELE ATOM B        7 1H2*          END -
       SELE ATOM B        8 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B        7 2H2*         END -
       SELE ATOM B        8 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        1 1H2*          END -             
       SELE ATOM A        2 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        1 2H2*         END -
       SELE ATOM A        2 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        1 1H2*          END -             
       SELE ATOM A        2 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        1 2H2*         END -
       SELE ATOM A        2 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        2 1H2*          END -
       SELE ATOM A        3 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        2 2H2*         END -
       SELE ATOM A        3 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX     12.00 RMAX     20.00
ASSIGN SELE ATOM A        2 1H2*          END -
       SELE ATOM A        3 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        2 2H2*         END -
       SELE ATOM A        3 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        3 1H2*          END -             
       SELE ATOM A        4 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        3 2H2*         END -
       SELE ATOM A        4 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        3 1H2*          END -             
       SELE ATOM A        4 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        3 2H2*         END -
       SELE ATOM A        4 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        4 1H2*          END -             
       SELE ATOM A        5 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        4 2H2*         END -
       SELE ATOM A        5 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        4 1H2*          END -             
       SELE ATOM A        5 2H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        4 2H2*         END -
       SELE ATOM A        5 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        5 1H2*          END -
       SELE ATOM A        6 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        5 2H2*         END -
       SELE ATOM A        6 1H5*          END -
 KMIN    12.00 RMIN    3.50 KMAX     12.00 RMAX     20.00
ASSIGN SELE ATOM A        5 1H2*          END -
       SELE ATOM A        6 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        5 2H2*         END -
       SELE ATOM A        6 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        6 1H2*          END -             
       SELE ATOM A        7 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        6 2H2*         END -
       SELE ATOM A        7 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        6 1H2*          END -             
       SELE ATOM A        7 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        6 2H2*         END -
       SELE ATOM A        7 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        5 1H2*          END -
       SELE ATOM A        6 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        7 2H2*         END -
       SELE ATOM A        8 1H5*          END -
 KMIN    12.00 RMIN    3.50 KMAX     12.00 RMAX     20.00
ASSIGN SELE ATOM A        7 1H2*          END -
       SELE ATOM A        8 2H5*         END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A        7 2H2*         END -
       SELE ATOM A        8 2H5*         END -
 KMIN    12.00 RMIN     2.00 KMAX    12.00 RMAX     20.00
!
! DNA H1 - H2, H42 A    and B   
!
ASSIGN SELE ATOM A     1 H2           END -             
       SELE ATOM B     7 H1           END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX      20.00
ASSIGN SELE ATOM B     6 H1           END -
       SELE ATOM B     7 H1           END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX      20.00
ASSIGN SELE ATOM B     5 H1           END -             
       SELE ATOM B     6 H1           END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX       5.00
ASSIGN SELE ATOM A     7 H1           END -
       SELE ATOM B     1 H2          END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX      20.00
ASSIGN SELE ATOM A     6 H1           END -
       SELE ATOM A     7 H1           END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX      20.00
ASSIGN SELE ATOM A     5 H1           END -
       SELE ATOM A     6 H1           END -
 KMIN    12.00 RMIN     3.00 KMAX    12.00 RMAX       5.00
ASSIGN SELE ATOM A     5 H1           END -             
       SELE ATOM B     3 H42          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX       4.50
ASSIGN SELE ATOM A     3 H42          END -
       SELE ATOM B     5 H1           END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX       4.50
ASSIGN SELE ATOM A     6 H1           END -             
       SELE ATOM B     4 H42          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX       5.00
ASSIGN SELE ATOM A     4 H42          END -
       SELE ATOM B     6 H1           END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX       5.00
!
!  H2* - H5* / H5** 
!
ASSIGN SELE ATOM A     1 1H2*          END -             
       SELE ATOM A     1 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     1 1H2*          END -
       SELE ATOM A     1 2H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     2 1H2*          END -
       SELE ATOM A     2 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     2 1H2*          END -
       SELE ATOM A     2 2H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     4 1H2*          END -
       SELE ATOM A     4 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     4 1H2*          END -
       SELE ATOM A     4 2H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     5 1H2*          END -
       SELE ATOM A     5 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     5 1H2*          END -
       SELE ATOM A     5 2H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     8 1H2*         END -
       SELE ATOM A     8 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     8 1H2*         END -
       SELE ATOM A     8 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     1 1H2*         END -             
       SELE ATOM B     1 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     1 1H2*         END -
       SELE ATOM B     1 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     2 1H2*         END -
       SELE ATOM B     2 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     2 1H2*         END -
       SELE ATOM B     2 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     4 1H2*         END -
       SELE ATOM B     4 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     4 1H2*         END -
       SELE ATOM B     4 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     5 1H2*         END -
       SELE ATOM B     5 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     5 1H2*         END -
       SELE ATOM B     5 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     8 1H2*         END -
       SELE ATOM B     8 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     8 1H2*         END -
       SELE ATOM B     8 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
!
!  H2** - H5*, H5** 
!
ASSIGN SELE ATOM A     1 2H2*         END -             
       SELE ATOM A     1 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     1 2H2*         END -
       SELE ATOM A     1 2H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     2 2H2*         END -
       SELE ATOM A     2 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     2 2H2*         END -
       SELE ATOM A     2 2H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     4 2H2*         END -
       SELE ATOM A     4 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     4 2H2*         END -
       SELE ATOM A     4 2H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     5 2H2*         END -
       SELE ATOM A     5 1H5*          END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     5 2H2*         END -
       SELE ATOM A     5 2H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     8 2H2*        END -
       SELE ATOM A     8 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM A     8 2H2*        END -
       SELE ATOM A     8 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     1 2H2*        END -             
       SELE ATOM B     1 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     1 2H2*        END -
       SELE ATOM B     1 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     2 2H2*        END -
       SELE ATOM B     2 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     2 2H2*        END -
       SELE ATOM B     2 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     4 2H2*        END -
       SELE ATOM B     4 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     4 2H2*        END -
       SELE ATOM B     4 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     5 1H2*        END -
       SELE ATOM B     5 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     5 2H2*        END -
       SELE ATOM B     5 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     8 2H2*        END -
       SELE ATOM B     8 1H5*         END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00
ASSIGN SELE ATOM B     8 2H2*        END -
       SELE ATOM B     8 2H5*        END -
 KMIN    12.00 RMIN     3.50 KMAX    12.00 RMAX     20.00