* LIGAND DATABASE FILE (OPLS2005)
*
001     117   120    218    344     649
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02122   101.48745   -45.19640
    3     1 S   H    _H1_     3     1.02066    75.37651    61.36369
    4     1 S   H    _H2_     4     1.02071    39.12842  -150.74731
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08519   110.61667    58.77943
   26    24 S   HC   HB22    34     1.08547   109.95733   179.17291
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C23    36     1.85250    97.16520   161.86914
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CT   _C18    37     1.56155   112.53671    39.95430
   38    37 S   HC   _H49    38     1.10097   107.77311   -58.27149
   39    33 S   CT   _C22    97     1.56561   114.11361   169.81737
   40    33 S   OH   _O42   116     1.44677   105.11294   -74.82353
   41    40 S   HO   _H83   117     0.96370   105.30908    59.28870
   42    37 S   CO4  _C10    39     1.54076   116.26259    58.86750
   43    42 S   O    _O35    40     1.22807   122.85378   -35.72589
   44    39 S   OH   _O41    98     1.43556   108.32220    56.47301
   45    44 S   HO   _H82    99     0.96597   105.98646   -63.57191
   46    42 S   CA   _C5_    41     1.48704   119.13988   148.98504
   47    46 S   CA   _C6_    42     1.39942   120.59507     3.66362
   48    47 S   CA   _C7_    43     1.40224   119.18563   178.19572
   49    47 S   CT   _C16    81     1.49978   121.22277    -0.13417
   50    49 S   HC   _H45    82     1.09771   108.15899    91.50852
   51    49 S   HC   _H46    83     1.09650   111.42559  -150.85248
   52    48 S   CA   _C4_    44     1.39424   120.59675     1.20869
   53    52 S   HA   _H44    45     1.08910   120.00925   179.69739
   54    48 S   NE   _N33    72     1.41452   121.34323  -178.36362
   55    37 S   CT   _C20    84     1.54498   109.49301  -173.39559
   56    55 S   HC   _H51    85     1.09895   108.52816    62.79040
   57    52 S   CA   _C8_    46     1.39172   119.99950    -0.37325
   58    54 S   CT   _C27    73     1.44749   120.26797   -90.44262
   59    58 S   HC   _H62    74     1.09304   110.10726  -179.96574
   60    58 S   HC   _H63    75     1.09392   110.17498    60.01563
   61    58 S   HC   _H64    76     1.09313   110.26816   -59.92951
   62    54 S   CT   _C28    77     1.44672   120.26035    88.97878
   63    62 S   HC   _H65    78     1.09383   110.09329   179.97202
   64    62 S   HC   _H66    79     1.09307   110.29280    60.03052
   65    62 S   HC   _H67    80     1.09342   110.22180   -60.06312
   66    55 S   CT   _C17    86     1.53843   112.05330   -54.91411
   67    66 S   HC   _H47    87     1.09834   108.65732   175.85235
   68    66 S   HC   _H48    88     1.09593   110.31722   -68.50794
   69    46 S   CA   _C9_    47     1.40118   119.33647  -176.82602
   70    57 S   N    _N31    50     1.39749   119.12856   179.76261
   71    70 S   H    _H78    51     1.02554   116.11323  -179.97202
   72    66 S   CT   _C21    89     1.54580   112.59501    55.21198
   73    72 S   HC   _H52    90     1.10037   106.85895    64.29887
   74    69 S   OH   _O39    48     1.36620   122.08809     1.91090
   75    74 S   HO   _H80    49     0.96825   110.03367    -0.03956
   76    70 S   C    _C15    52     1.40320   128.11317    -0.02798
   77    76 S   O    _O38    53     1.22657   126.74676     0.66205
   78    72 S   CT   _C19    91     1.54691   110.17045   179.84174
   79    78 S   HC   _H50    92     1.09750   107.25750   -44.41087
   80    76 S   CT1  _C31    54     1.51675   111.00924  -179.97202
   81    80 S   HC   _H74    55     1.09434   109.77777    60.04120
   82    80 S   HC   _H75    56     1.09436   108.97320   -59.08967
   83    78 S   CM   _C12    93     1.50824   111.82559    74.82960
   84    78 S   NT   _N34   107     1.46734   111.89114  -161.17649
   85    80 S   NT   _N32    57     1.44114   109.88386  -179.47511
   86    85 S   H    _H79    58     1.02539   110.02598   -59.97821
   87    83 S   CM   _C11    94     1.34788   123.52424    24.07233
   88    83 S   OH   _O40   105     1.38310   111.76900  -154.20405
   89    88 S   HO   _H81   106     0.96044   109.56124   178.23675
   90    84 S   CT   _C29   108     1.46066   110.26158  -165.01433
   91    90 S   HC   _H68   109     1.09337   110.09444   179.96574
   92    90 S   HC   _H69   110     1.09377   110.26186    60.01795
   93    90 S   HC   _H70   111     1.09255   110.25727   -59.98725
   94    84 S   CT   _C30   112     1.46073   110.30256    72.48128
   95    94 S   HC   _H71   113     1.09289   110.16394   179.96044
   96    94 S   HC   _H72   114     1.09403   110.18653    59.95554
   97    94 S   HC   _H73   115     1.09376   110.18974   -59.94745
   98    85 S   CT   _C32    59     1.46243   111.52580   179.55589
   99    87 S   CO4  _C13    95     1.50404   119.97339     4.32626
  100    99 S   O    _O36    96     1.23184   117.87050   169.42979
  101    87 S   C    _C14   100     1.47454   120.99711  -176.79472
  102   101 S   O    _O37   101     1.22639   121.48901   -60.04987
  103    98 S   CT   _C24    60     1.53338   109.31617  -178.66002
  104   103 S   HC   _H53    61     1.09613   111.15193   -60.34918
  105   103 S   HC   _H54    62     1.09558   111.34004    59.94042
  106   103 S   HC   _H55    63     1.09592   111.09874  -179.67076
  107    98 S   CT   _C25    64     1.53195   109.09848   -58.57941
  108   107 S   HC   _H56    65     1.09639   111.16029    60.18196
  109   107 S   HC   _H57    66     1.09694   111.12554   -58.99719
  110   107 S   HC   _H58    67     1.09520   111.34827  -179.40719
  111    98 S   CT   _C26    68     1.53368   109.26156    61.42651
  112   111 S   HC   _H59    69     1.09586   111.10829   -60.24994
  113   111 S   HC   _H60    70     1.09562   111.35079    60.16203
  114   111 S   HC   _H61    71     1.09594   111.15650  -179.57433
  115   101 S   N    _N30   102     1.37317   113.23610   119.98271
  116   115 S   H    _H76   103     1.01444   118.49311    -0.04423
  117   115 S   H    _H77   104     1.01534   122.86048   180.00000
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  11   5   4   3
  20   2   1   1  20   9  19   6   1  11   4   8   2  13  15  18
  11   4   3  10   4   9   7   4   8   7   3   2   1   3   2   1
   1   9   4   3   5   8   3  11   5   1   1   7   4  16   6   8
   4   3  11  10  14   4   9   3   1   7   3   2   1   3   2   1
   1  12   4   1   4   3  11   4   3   2   7   3   2   1   3   2
   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    55    72    99    39    44    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    46    49    55    56    66    72    73    78    87    99   100    39    44    45    40    41  
   35    36  
   36  
    0  
   38    42    43    46    47    69    49    50    51    55    56    66    67    68    72    99    39    44    40    41  
   42    43    46    49    55    56    66    39    40  
   44    45   101    84    40    41    42    55    66    67    68    72    73    78    79    83    87    99   100  
   41    42    44    55    72    99  
    0  
   43    46    47    48    57    69    74    49    55    56    66  
   46    47    69    55  
   45    66    72    73    78    87    99   100  
   72    99  
   47    48    52    57    69    74    75    70    54    49    50    51    55  
   48    52    53    57    69    74    54    58    62    49    50    51    55    56    66  
   52    53    57    69    70    54    58    59    60    61    62    63    64    65    49    50    51    55  
   50    51    55    56    66    67    68    72    52    54    69  
   51    55    56    66  
   55    56    66  
   53    57    69    74    70    71    76    54    58    62  
   57    69    70    54  
   58    59    60    61    62    63    64    65    57  
   56    66    67    68    72    73    78  
   66    67    68    72  
   69    74    75    70    71    76    77    80  
   59    60    61    62    63    64    65  
   60    61    62  
   61    62  
   62  
   63    64    65  
   64    65  
   65  
    0  
   67    68    72    73    78    79    83    99    84  
   68    72    73    78  
   72    73    78  
   74    75    70    71    76  
   71    76    77    80    81    82    85    74  
   76    77    80  
   73    78    79    83    87    99   100    88    84    90    94  
   78    79    83    99    84  
   75  
    0  
   77    80    81    82    85    86    98  
   80    81    82    85  
   79    83    87    99   101    88    89    84    90    91    92    93    94    95    96    97  
   83    87    88    84    90    94  
   81    82    85    86    98   103   107   111  
   82    85    86    98  
   85    86    98  
   87    99   100   101   102   115    88    89    84    90    94  
   90    91    92    93    94    95    96    97    87    88  
   86    98   103   104   105   106   107   108   109   110   111   112   113   114  
   98   103   107   111  
   99   100   101   102   115   116   117    88    89  
   89    99   101  
    0  
   91    92    93    94    95    96    97  
   92    93    94  
   93    94  
   94  
   95    96    97  
   96    97  
   97  
    0  
  103   104   105   106   107   108   109   110   111   112   113   114  
  100   101   102   115  
  101  
  102   115   116   117  
  115   116   117  
  104   105   106   107   108   109   110   111   112   113   114  
  105   106   107   111  
  106   107   111  
  107   111  
  108   109   110   111   112   113   114  
  109   110   111  
  110   111  
  111  
  112   113   114  
  113   114  
  114  
    0  
  116   117  
  117  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.432500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   41   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   42   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700   0.210000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   70   3.2500   0.1700  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   71   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   72   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   75   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   76   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   77   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   78   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   84   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   85   3.3000   0.1700  -0.702500   1.8650   1.6500   0.051222218  -2.220205820
   86   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   87   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
   88   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   89   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   90   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   99   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  100   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  101   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.500000   1.8100   1.6000   0.001000000  -1.480495490
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
  116   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
  117   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    39   268.000  1.529
   33    40   320.000  1.410
   37    38   340.000  1.090
   37    42   317.000  1.522
   37    55   268.000  1.529
   42    43   570.000  1.229
   42    46   310.000  1.470
   46    47   469.000  1.400
   46    69   469.000  1.400
   47    48   469.000  1.400
   47    49   317.000  1.510
   48    52   469.000  1.400
   48    54   481.000  1.340
   52    53   367.000  1.080
   52    57   469.000  1.400
   57    69   469.000  1.400
   57    70   360.000  1.404
   69    74   450.000  1.364
   74    75   553.000  0.945
   70    71   434.000  1.010
   70    76   490.000  1.335
   76    77   570.000  1.229
   76    80   317.000  1.522
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    85   305.000  1.457
   85    86   434.000  1.010
   85    98   382.000  1.448
   98   103   268.000  1.529
   98   107   268.000  1.529
   98   111   268.000  1.529
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   54    58   382.000  1.448
   54    62   382.000  1.448
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    55   268.000  1.529
   55    56   340.000  1.090
   55    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    72   268.000  1.529
   72    73   340.000  1.090
   72    78   268.000  1.529
   72    39   268.000  1.529
   78    79   340.000  1.090
   78    83   317.000  1.510
   78    84   382.000  1.448
   83    87   549.000  1.340
   83    88   510.000  1.338
   87    99   320.000  1.462
   87   101   410.000  1.444
   99   100   570.000  1.229
   99    39   317.000  1.522
   39    44   320.000  1.410
   44    45   553.000  0.945
  101   102   570.000  1.229
  101   115   490.000  1.335
  115   116   434.000  1.010
  115   117   434.000  1.010
   88    89   553.000  0.945
   84    90   382.000  1.448
   84    94   382.000  1.448
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   340.000  1.090
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   340.000  1.090
   40    41   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    39    75.00000  111.63000
   29    33    40    85.00000  114.68000
   33    37    38    37.50000  110.70000
   33    37    42    63.00000  111.10000
   33    37    55    58.35000  112.70000
   33    39    72    58.35000  112.70000
   33    39    99    63.00000  111.10000
   33    39    44    50.00000  109.50000
   33    40    41    55.00000  108.50000
   37    42    43    80.00000  120.40000
   37    42    46    65.00000  115.47100
   37    55    49    58.35000  112.70000
   37    55    56    37.50000  110.70000
   37    55    66    58.35000  112.70000
   42    37    38    35.00000  109.50000
   42    46    47    60.00000  119.52600
   42    46    69    60.00000  119.52600
   46    42    43    75.00000  123.78400
   46    47    48    63.00000  120.00000
   46    47    49    70.00000  120.00000
   46    69    57    63.00000  120.00000
   46    69    74    70.00000  120.00000
   47    48    52    63.00000  120.00000
   47    48    54    70.00000  120.10000
   47    49    50    35.00000  109.50000
   47    49    51    35.00000  109.50000
   47    49    55    70.00000  112.17500
   48    52    53    35.00000  120.00000
   48    52    57    63.00000  120.00000
   48    54    58    50.00000  120.00000
   48    54    62    50.00000  120.00000
   52    57    69    63.00000  120.00000
   52    57    70    70.00000  119.01900
   57    52    53    35.00000  120.00000
   57    69    74    70.00000  120.00000
   57    70    71    45.00000  118.23600
   57    70    76    65.00000  121.96500
   69    46    47    63.00000  120.00000
   69    74    75    35.00000  113.00000
   70    57    69    70.00000  119.01900
   70    76    77    80.00000  122.90000
   70    76    80    70.00000  116.60000
   76    70    71    35.00000  119.80000
   76    80    81    35.00000  109.50000
   76    80    82    35.00000  109.50000
   76    80    85    75.00000  111.54000
   80    76    77    80.00000  120.40000
   80    85    86    50.00000  111.55300
   80    85    98    51.80000  107.20000
   82    80    81    33.00000  107.80000
   85    80    81    50.00000  109.55000
   85    80    82    50.00000  109.55000
   85    98   103    56.20000  109.47000
   85    98   107    56.20000  109.47000
   85    98   111    56.20000  109.47000
   98    85    86    35.00000  109.50000
   98   103   104    37.50000  110.70000
   98   103   105    37.50000  110.70000
   98   103   106    37.50000  110.70000
   98   107   108    37.50000  110.70000
   98   107   109    37.50000  110.70000
   98   107   110    37.50000  110.70000
   98   111   112    37.50000  110.70000
   98   111   113    37.50000  110.70000
   98   111   114    37.50000  110.70000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
  107    98   103    58.35000  112.70000
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
  111    98   103    58.35000  112.70000
  111    98   107    58.35000  112.70000
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   54    48    52    70.00000  120.10000
   54    58    59    35.00000  109.50000
   54    58    60    35.00000  109.50000
   54    58    61    35.00000  109.50000
   54    62    63    35.00000  109.50000
   54    62    64    35.00000  109.50000
   54    62    65    35.00000  109.50000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   62    54    58    50.00000  115.00000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   49    47    48    70.00000  120.00000
   49    55    56    37.50000  110.70000
   49    55    66    58.35000  112.70000
   51    49    50    33.00000  107.80000
   55    37    38    37.50000  110.70000
   55    37    42    63.00000  111.10000
   55    49    50    37.50000  110.70000
   55    49    51    37.50000  110.70000
   55    66    67    37.50000  110.70000
   55    66    68    37.50000  110.70000
   55    66    72    58.35000  112.70000
   66    55    56    37.50000  110.70000
   66    72    73    37.50000  110.70000
   66    72    78    58.35000  112.70000
   66    72    39    58.35000  112.70000
   68    66    67    33.00000  107.80000
   72    66    67    37.50000  110.70000
   72    66    68    37.50000  110.70000
   72    78    79    37.50000  110.70000
   72    78    83    70.00000  112.02700
   72    78    84    56.20000  109.47000
   72    39    99    63.00000  111.10000
   72    39    44    50.00000  109.50000
   78    72    73    37.50000  110.70000
   78    83    87    70.00000  124.00000
   78    83    88    90.00000  109.34000
   78    84    90    51.80000  107.20000
   78    84    94    51.80000  107.20000
   83    78    79    35.00000  109.50000
   83    87    99    65.00000  118.96000
   83    87   101    70.00000  118.70000
   83    88    89    70.00000  107.45700
   87    99   100    80.00000  123.72100
   87    99    39    65.00000  118.62400
   87   101   102    80.00000  125.30000
   87   101   115    80.00000  111.56200
   99    39    44    90.00000  109.61100
   39    33    37    58.35000  112.70000
   39    72    73    37.50000  110.70000
   39    72    78    58.35000  112.70000
   39    99   100    80.00000  120.40000
   39    44    45    55.00000  108.50000
  101    87    99    55.00000  123.68000
  101   115   116    35.00000  119.80000
  101   115   117    35.00000  119.80000
  115   101   102    80.00000  122.90000
  117   115   116    35.00000  120.00000
   88    83    87    80.00000  121.38400
   84    78    79    35.00000  109.50000
   84    78    83    75.00000  110.70900
   84    90    91    35.00000  109.50000
   84    90    92    35.00000  109.50000
   84    90    93    35.00000  109.50000
   84    94    95    35.00000  109.50000
   84    94    96    35.00000  109.50000
   84    94    97    35.00000  109.50000
   92    90    91    33.00000  107.80000
   93    90    91    33.00000  107.80000
   93    90    92    33.00000  107.80000
   94    84    90    51.80000  107.20000
   96    94    95    33.00000  107.80000
   97    94    95    33.00000  107.80000
   97    94    96    33.00000  107.80000
   40    33    37    50.00000  109.50000
   40    33    39    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
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   78    72    39    99  -0.95700  1.0 1.0
   78    72    39    99  -0.18200 -1.0 2.0
   78    72    39    99   0.29450  1.0 3.0
   78    72    39    44   0.86500  1.0 1.0
   78    72    39    44  -0.17500 -1.0 2.0
   78    72    39    44   0.20800  1.0 3.0
   78    83   -87    99   7.00000 -1.0 2.0
   78    83    87   101   7.00000 -1.0 2.0
   78    83    88    89   2.00000 -1.0 2.0
   78    84    90    91   0.28000  1.0 3.0
   78    84    90    92   0.28000  1.0 3.0
   78    84    90    93   0.28000  1.0 3.0
   78    84    94    95   0.28000  1.0 3.0
   78    84    94    96   0.28000  1.0 3.0
   78    84    94    97   0.28000  1.0 3.0
   79    78    83    87   0.00000  1.0 1.0
   79    78    83    88   0.00000  1.0 1.0
   79    78    84    90   0.28000  1.0 3.0
   79    78    84    94   0.28000  1.0 3.0
   83    78    84    90  -0.60800  1.0 1.0
   83    78    84    90   1.10050 -1.0 2.0
   83    78    84    90   0.47000  1.0 3.0
   83    78    84    94  -0.60800  1.0 1.0
   83    78    84    94   1.10050 -1.0 2.0
   83    78    84    94   0.47000  1.0 3.0
   83    87    99   100   1.00000 -1.0 2.0
   83    87    99    39  -0.33500  1.0 1.0
   83    87    99    39   1.06600 -1.0 2.0
   83    87    99    39  -0.14000  1.0 3.0
   83    87   101   102   1.00000 -1.0 2.0
   83    87   101   115   0.49500  1.0 1.0
   83    87   101   115   1.31600 -1.0 2.0
   83    87   101   115  -0.02300  1.0 3.0
   87    83    88    89  -0.66100  1.0 1.0
   87    83    88    89   1.20850 -1.0 2.0
   87    83    88    89  -0.36000  1.0 3.0
   87    99    39    33   0.65300  1.0 1.0
   87    99    39    33  -0.03850 -1.0 2.0
   87    99    39    33   0.33900  1.0 3.0
   87    99   -39    72   0.65300  1.0 1.0
   87    99   -39    72  -0.03850 -1.0 2.0
   87    99   -39    72   0.33900  1.0 3.0
   87    99    39    44   0.65300  1.0 1.0
   87    99    39    44  -0.03850 -1.0 2.0
   87    99    39    44   0.33900  1.0 3.0
   87   101   115   116   2.56700 -1.0 2.0
   87   101   115   117   2.56700 -1.0 2.0
   99    87   101   102   2.50000 -1.0 2.0
   99    87   101   115   1.50000 -1.0 2.0
   99    39    44    45   0.91850  1.0 1.0
   99    39    44    45   0.57950  1.0 3.0
  100    99    39    33   0.30150 -1.0 2.0
  100    99    39    72   0.30150 -1.0 2.0
  100    99    39    44   0.30150 -1.0 2.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    42  -0.95700  1.0 1.0
   39    33    37    42  -0.18200 -1.0 2.0
   39    33    37    42   0.29450  1.0 3.0
   39    33   -37    55   0.56750  1.0 1.0
   39    33   -37    55  -0.07550 -1.0 2.0
   39    33   -37    55   0.20000  1.0 3.0
   39    33    40    41  -0.11600  1.0 1.0
   39    33    40    41  -0.09450 -1.0 2.0
   39    33    40    41   0.21250  1.0 3.0
   39    72    78    79   0.15000  1.0 3.0
   39    72   -78    83   0.34400  1.0 1.0
   39    72   -78    83   0.09450 -1.0 2.0
   39    72   -78    83   0.11100  1.0 3.0
   39    72    78    84   1.85550  1.0 1.0
   39    72    78    84  -0.84100 -1.0 2.0
  101    87    99   100   2.50000 -1.0 2.0
  101    87    99    39   1.50000 -1.0 2.0
  102   101   115   116   2.45000 -1.0 2.0
  102   101   115   117   2.45000 -1.0 2.0
   88    83    87    99   7.00000 -1.0 2.0
   88    83    87   101   7.00000 -1.0 2.0
   84    78    83    87   0.90200  1.0 1.0
   84    78    83    87   0.57900 -1.0 2.0
   84    78    83    87  -0.62100  1.0 3.0
   84    78    83    88   0.09700  1.0 1.0
   84    78    83    88   0.15600 -1.0 2.0
   84    78    83    88  -0.50800  1.0 3.0
   90    84    94    95   0.28000  1.0 3.0
   90    84    94    96   0.28000  1.0 3.0
   90    84    94    97   0.28000  1.0 3.0
   94    84    90    91   0.28000  1.0 3.0
   94    84    90    92   0.28000  1.0 3.0
   94    84    90    93   0.28000  1.0 3.0
   40    33    37    38   0.23400  1.0 3.0
   40    33    37    42  -0.09450  1.0 1.0
   40    33    37    42  -1.12950 -1.0 2.0
   40    33    37    42   0.54000  1.0 3.0
   40    33    37    55   0.86500  1.0 1.0
   40    33    37    55  -0.17500 -1.0 2.0
   40    33    37    55   0.20800  1.0 3.0
   40    33    39    72   0.86500  1.0 1.0
   40    33    39    72  -0.17500 -1.0 2.0
   40    33    39    72   0.20800  1.0 3.0
   40    33    39    99  -0.09450  1.0 1.0
   40    33    39    99  -1.12950 -1.0 2.0
   40    33    39    99   0.54000  1.0 3.0
   40    33    39    44   3.75450  1.0 1.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   37    46    42    43  10.50000 -1.0 2.0
   47    69    46    42   4.00000 -1.0 2.0
   48    49    47    46   4.00000 -1.0 2.0
   52    54    48    47   4.00000 -1.0 2.0
   57    53    52    48   1.10000 -1.0 2.0
   69    70    57    52   4.00000 -1.0 2.0
   57    74    69    46   4.00000 -1.0 2.0
   71    76    70    57   1.00000 -1.0 2.0
   70    80    76    77  10.50000 -1.0 2.0
   62    48    54    58   1.00000 -1.0 2.0
   78    88    83    87   1.10000 -1.0 2.0
   99   101    87    83   1.10000 -1.0 2.0
   87    39    99   100  10.50000 -1.0 2.0
   87   115   101   102  10.50000 -1.0 2.0
  117   101   115   116   1.00000 -1.0 2.0
END
