* LIGAND DATABASE FILE (OPLS2005)
*
001     119   120    225    336     670
    1     0 S   NP   _N1_     1    28.71200    92.54803   -20.84762
    2     1 S   H    _HN1     2     1.02773    90.50054   -77.53433
    3     1 S   H    _H1_     3     1.02964   104.94267    31.64949
    4     1 S   H    _H2_     4     1.02837    19.79161   130.20309
    5     1 S   CT   _CA1     5     1.50080   127.88299   163.26471
    6     5 S   HC   _HA1     6     1.09561   105.30456    47.68105
    7     5 S   CO3  _C1_     7     1.53838   112.64392   -72.73031
    8     7 S   O2Z  _O11     8     1.26343   115.01139   -37.09404
    9     7 S   O2Z  _O12     9     1.26268   114.96221   142.59203
   10     5 S   CT   _CB1    10     1.53111   107.50341   165.93062
   11    10 S   HC   HB11    11     1.09812   109.59343   -48.95422
   12    10 S   HC   HB12    12     1.09835   110.25081    67.70095
   13    10 S   CT   _CG1    13     1.52954   112.59826  -170.07106
   14    13 S   HC   HG11    14     1.09526   110.36383   -59.47064
   15    13 S   HC   HG12    15     1.09623   110.18507    59.74176
   16    13 S   C    _CD1    16     1.51676   112.34721  -179.78060
   17    16 S   O    _OE1    17     1.22689   123.29659   -11.71749
   18    16 S   N    _N2_    18     1.38563   111.42994   168.61556
   19    18 S   H    _HN2    19     1.01592   119.01889     2.09994
   20    18 S   CT1  _CA2    20     1.46139   123.52288  -176.70372
   21    20 S   HC   _HA2    21     1.09716   109.50376   -15.35666
   22    20 S   C    _C2_    22     1.53430   108.11787  -131.26444
   23    22 S   O    _O2_    23     1.23002   122.29738  -145.49353
   24    20 S   CT   _CB2    32     1.53509   110.98024   106.90818
   25    24 S   HC   HB21    33     1.09387   109.10686    53.86315
   26    24 S   HC   HB22    34     1.09473   110.21192   172.47204
   27    22 S   N    _N3_    24     1.38521   113.31910    41.75827
   28    27 S   H    _HN3    25     1.01533   118.89333    -0.48133
   29    24 S   S    _SG2    35     1.83079   111.69974   -68.21833
   30    27 S   CT   _CA3    26     1.45457   123.50220   175.33532
   31    30 S   HC   HA31    27     1.09519   109.29927    22.85027
   32    30 S   HC   HA32    28     1.09497   107.09177   139.86100
   33    29 S   CT   _C7_    36     1.87557   102.12163   158.92520
   34    30 S   CO3  _C3_    29     1.52926   113.12295  -100.67989
   35    34 S   O2Z  _O31    30     1.26403   115.41422   -43.75108
   36    34 S   O2Z  _O32    31     1.26357   114.97532   137.19891
   37    33 S   CO4  _C8_    37     1.57086   106.89008   166.58434
   38    37 S   O    _O33    38     1.23845   120.55425   -23.63098
   39    33 S   CT   _C6_    60     1.55477   110.14787   -68.38677
   40    39 S   HC   _H19    61     1.08884   107.68372  -170.97082
   41    39 S   HC   _H20    62     1.09903   107.73706    77.37963
   42    33 S   CT   _C30   115     1.55142   109.63373    50.65785
   43    42 S   HC   _H47   116     1.09501   111.74338   -66.07541
   44    42 S   HC   _H48   117     1.09324   110.85866   176.75689
   45    37 S   CT   _C9_    39     1.54958   120.96184   162.41253
   46    45 S   HC   _H4_    40     1.08651   108.92497   -24.85973
   47    42 S   OH   _O42   118     1.42364   113.51195    55.16104
   48    47 S   HO   _H49   119     0.97202   108.77270    48.12428
   49    45 S   CT   _C10    41     1.55063   109.96427    95.61579
   50    49 S   HC   _H5_    42     1.09317   109.44117   -29.43051
   51    45 S   CT   _C29   111     1.53973   107.42894  -140.39728
   52    51 S   HC   _H44   112     1.09534   112.28807   -65.99298
   53    51 S   HC   _H45   113     1.09148   111.92966   172.42754
   54    51 S   HC   _H46   114     1.09361   111.13166    52.71004
   55    49 S   CT   _C11    43     1.55874   117.81986  -151.84045
   56    55 S   HC   _H6_    44     1.10030   104.90362  -170.31046
   57    49 S   OH   _O41   109     1.43442   108.93339    84.37809
   58    57 S   HO   _H43   110     0.97235   107.96036  -172.46516
   59    55 S   CT   _C12    45     1.55484   113.31447    74.03717
   60    59 S   HC   _H7_    46     1.09665   108.78444    38.87153
   61    55 S   CT   _C28   105     1.53235   113.18118   -55.80316
   62    61 S   HC   _H40   106     1.09377   111.99396    71.52145
   63    61 S   HC   _H41   107     1.09479   111.05771   -49.90941
   64    61 S   HC   _H42   108     1.09465   110.90864  -168.52717
   65    59 S   OS   _O34    47     1.44425   110.70352   -81.59456
   66    59 S   CT   _C27   101     1.53400   110.72157   158.12982
   67    66 S   HC   _H37   102     1.09474   111.42252    68.22791
   68    66 S   HC   _H38   103     1.09430   111.37812   -53.74788
   69    66 S   HC   _H39   104     1.09484   110.93009  -173.70586
   70    65 S   CO4  _C13    48     1.36674   117.36547   163.10115
   71    70 S   O    _O35    49     1.22451   125.72413    -6.00267
   72    70 S   CT   _C14    50     1.52230   110.29568   173.79101
   73    72 S   HC   _H8_    51     1.09775   106.90281    -3.86812
   74    72 S   CT   _C15    52     1.55693   109.00383   114.64160
   75    74 S   HC   _H9_    53     1.09352   109.12702     3.88181
   76    72 S   CT   _C26    97     1.52723   108.64438  -118.35997
   77    76 S   HC   _H34    98     1.09430   112.13957   -58.91434
   78    76 S   HC   _H35    99     1.09456   111.10611   179.23664
   79    76 S   HC   _H36   100     1.09613   110.27981    59.88911
   80    74 S   CT   _C16    54     1.56410   110.54372  -114.73100
   81    80 S   HC   _H10    55     1.09580   107.75976    35.43553
   82    74 S   OS   _O37    73     1.43472   111.91063   123.25644
   83    80 S   CT   _C17    56     1.56258   111.44035   152.68358
   84    83 S   HC   _H11    57     1.09337   109.14773    26.79167
   85    80 S   CT   _C18    69     1.53724   110.89443   -80.59403
   86    85 S   HC   _H22    70     1.09520   111.71757   -69.65796
   87    85 S   HC   _H23    71     1.09541   110.72728   169.85731
   88    85 S   HC   _H24    72     1.09479   111.12040    51.10679
   89    82 S   CO   _C19    74     1.43158   113.81568   -95.70230
   90    89 S   HC   _H12    75     1.09575   109.31575    40.13798
   91    83 S   CT   _C5_    58     1.56738   115.00858   -94.35540
   92    91 S   HC   _H3_    59     1.09735   105.37164   176.09174
   93    83 S   OH   _O36    67     1.42845   109.91540   142.67006
   94    93 S   HO   _H21    68     0.97274   108.66862  -175.26343
   95    89 S   CT   _C20    76     1.52738   109.25171   157.63727
   96    95 S   HC   _H25    77     1.09541   109.90526   -52.18574
   97    95 S   HC   _H26    78     1.09774   109.50416  -169.21743
   98    91 S   CT   _C4_    63     1.53046   111.37381   -69.76334
   99    98 S   HC   _H16    64     1.09199   111.70693    64.79688
  100    98 S   HC   _H17    65     1.09514   111.15257   -55.21705
  101    98 S   HC   _H18    66     1.09270   111.55862  -173.56846
  102    95 S   CT   _C21    79     1.53018   111.97738    70.30542
  103   102 S   HC   _H13    80     1.09807   110.88612   -68.74230
  104   102 S   CT   _C22    81     1.53508   109.48370    51.82004
  105   104 S   HC   _H14    82     1.09709   109.12279    69.71481
  106   102 S   OS   _O40    92     1.43340   110.62585   170.27421
  107   104 S   CT   _C23    83     1.53176   110.63818   -51.85894
  108   107 S   HC   _H15    84     1.09663   109.54298   -65.49216
  109   104 S   OH   _O39    90     1.42749   109.66995  -173.36664
  110   109 S   HO   _H30    91     0.97251   108.04538    58.95421
  111   106 S   CT   _C25    93     1.42096   113.54050    77.83776
  112   111 S   HC   _H31    94     1.09349   108.12968   175.76881
  113   111 S   HC   _H32    95     1.09415   110.69536    57.15983
  114   111 S   HC   _H33    96     1.09294   111.05491   -65.69627
  115    89 S   OS   _O38    85     1.42975   112.84960   -78.91213
  116   107 S   CT   _C24    86     1.52566   111.89093   175.55067
  117   116 S   HC   _H27    87     1.09557   110.89287   -60.77400
  118   116 S   HC   _H28    88     1.09586   110.31015  -178.66265
  119   116 S   HC   _H29    89     1.09393   111.71719    60.70672
  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  12   5   4   3
  18   2   1   1  19   6  17   6   5   6   3   2  13   8   1   1
  17   7   5   2   1   1  15   9   3   1  13   7   5   2   1   1
  10   4   2   1   1  11   4  13   8  20   7   5   2   1   1  14
   9  10  13   6   5   2   1   1  12   6   7   5   2   1  11   6
   5   3   2   1   1  14   6  12   7   6   8   6   3   1   3   2
   1   1   4   3   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    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    45    91    39    40    41    42    43    44    47  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    45    46    49    83    91    92    39    40    41    98    51    42    43    44    47    48  
   35    36  
   36  
    0  
   38    45    46    49    50    55    91    39    40    41    57    51    52    53    54    42    43    44    47  
   45    46    49    39    51    42  
   40    41    98    99   100   101    93    42    43    44    47    45    80    83    84    91    92  
   41    98    42    83    91    92  
   98    42    83    91    92  
   43    44    47    48    45    91  
   44    47    48  
   47    48  
   46    49    50    55    56    59    61    57    58    51    52    53    54  
   49    50    55    57    51    52    53    54  
   48  
    0  
   50    55    56    59    60    65    66    61    62    63    64    57    58    51    52    53    54  
   55    56    59    61    57    58    51  
   52    53    54    55    57  
   53    54  
   54  
    0  
   56    59    60    65    70    66    67    68    69    61    62    63    64    57    58  
   59    60    65    66    61    62    63    64    57  
   58    59    61  
    0  
   60    65    70    71    72    66    67    68    69    61    62    63    64  
   65    70    66    67    68    69    61  
   62    63    64    65    66  
   63    64  
   64  
    0  
   70    71    72    73    74    76    66    67    68    69  
   67    68    69    70  
   68    69  
   69  
    0  
   71    72    73    74    75    80    82    76    77    78    79  
   72    73    74    76  
   73    74    75    80    81    83    85    82    89    76    77    78    79  
   74    75    80    82    76    77    78    79  
   75    80    81    83    84    91    93    85    86    87    88    82    89    90    95   115    76    77    78    79  
   80    81    83    85    82    89    76  
   77    78    79    80    82  
   78    79  
   79  
    0  
   81    83    84    91    92    98    93    94    85    86    87    88    82    89  
   83    84    91    93    85    86    87    88    82  
   89    90    95    96    97   102   107   115    83    85  
   84    91    92    98    99   100   101    93    94    85    86    87    88  
   91    92    98    93    94    85  
   86    87    88    91    93  
   87    88  
   88  
    0  
   90    95    96    97   102   103   104   107   108   115   116   106  
   95    96    97   102   107   115  
   92    98    99   100   101    93    94  
   98    99   100   101    93  
   94    98  
    0  
   96    97   102   103   104   105   107   115   109   106   111  
   97   102   103   104   115   106  
  102   103   104   115   106  
   99   100   101  
  100   101  
  101  
    0  
  103   104   105   107   108   115   116   109   110   106   111   112   113   114  
  104   105   107   109   106   111  
  105   107   108   115   116   117   118   119   109   110   106   111  
  107   108   115   116   109   110   106  
  111   112   113   114   107   109  
  108   115   116   117   118   119   109   110  
  115   116   117   118   119   109  
  110   115   116  
    0  
  112   113   114  
  113   114  
  114  
    0  
  116   117   118   119  
  117   118   119  
  118   119  
  119  
    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   0.167500   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   66   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   71   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   72   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   74   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   83   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   94   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   95   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  104   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
  107   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  109   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  110   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  111   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  115   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  116   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  117   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  118   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  119   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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   317.000  1.522
   33    39   268.000  1.529
   33    42   268.000  1.529
   37    38   570.000  1.229
   37    45   317.000  1.522
   45    46   340.000  1.090
   45    49   268.000  1.529
   45    51   268.000  1.529
   49    50   340.000  1.090
   49    55   268.000  1.529
   49    57   320.000  1.410
   55    56   340.000  1.090
   55    59   268.000  1.529
   55    61   268.000  1.529
   59    60   340.000  1.090
   59    65   320.000  1.410
   59    66   268.000  1.529
   65    70   214.000  1.327
   70    71   570.000  1.229
   70    72   317.000  1.522
   72    73   340.000  1.090
   72    74   268.000  1.529
   72    76   268.000  1.529
   74    75   340.000  1.090
   74    80   268.000  1.529
   74    82   320.000  1.410
   80    81   340.000  1.090
   80    83   268.000  1.529
   80    85   268.000  1.529
   83    84   340.000  1.090
   83    91   268.000  1.529
   83    93   320.000  1.410
   91    92   340.000  1.090
   91    39   268.000  1.529
   91    98   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
   93    94   553.000  0.945
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   340.000  1.090
   82    89   320.000  1.380
   89    90   340.000  1.090
   89    95   250.000  1.527
   89   115   320.000  1.380
   95    96   340.000  1.090
   95    97   340.000  1.090
   95   102   268.000  1.529
  102   103   340.000  1.090
  102   104   268.000  1.529
  102   106   320.000  1.410
  104   105   340.000  1.090
  104   107   268.000  1.529
  104   109   320.000  1.410
  107   108   340.000  1.090
  107   115   320.000  1.410
  107   116   268.000  1.529
  116   117   340.000  1.090
  116   118   340.000  1.090
  116   119   340.000  1.090
  109   110   553.000  0.945
  106   111   320.000  1.410
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    79   340.000  1.090
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   57    58   553.000  0.945
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    47   320.000  1.410
   47    48   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  110.18000
   29    33    39    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    45    70.00000  116.00000
   33    39    91    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    42    43    37.50000  110.70000
   33    42    44    37.50000  110.70000
   33    42    47    50.00000  109.50000
   37    45    46    35.00000  109.50000
   37    45    49    63.00000  111.10000
   37    45    51    63.00000  111.10000
   45    37    38    80.00000  120.40000
   45    49    50    37.50000  110.70000
   45    49    55    58.35000  112.70000
   45    49    57    50.00000  109.50000
   45    51    52    37.50000  110.70000
   45    51    53    37.50000  110.70000
   45    51    54    37.50000  110.70000
   49    45    46    37.50000  110.70000
   49    55    56    37.50000  110.70000
   49    55    59    58.35000  112.70000
   49    55    61    58.35000  112.70000
   49    57    58    55.00000  108.50000
   55    49    50    37.50000  110.70000
   55    59    60    37.50000  110.70000
   55    59    65    50.00000  109.50000
   55    59    66    58.35000  112.70000
   55    61    62    37.50000  110.70000
   55    61    63    37.50000  110.70000
   55    61    64    37.50000  110.70000
   59    55    56    37.50000  110.70000
   59    65    70    83.00000  116.90000
   59    66    67    37.50000  110.70000
   59    66    68    37.50000  110.70000
   59    66    69    37.50000  110.70000
   65    59    60    35.00000  109.50000
   65    70    71    83.00000  123.40000
   65    70    72    81.00000  111.40000
   70    72    73    35.00000  109.50000
   70    72    74    63.00000  111.10000
   70    72    76    63.00000  111.10000
   72    70    71    80.00000  120.40000
   72    74    75    37.50000  110.70000
   72    74    80    58.35000  112.70000
   72    74    82    50.00000  109.50000
   72    76    77    37.50000  110.70000
   72    76    78    37.50000  110.70000
   72    76    79    37.50000  110.70000
   74    72    73    37.50000  110.70000
   74    80    81    37.50000  110.70000
   74    80    83    58.35000  112.70000
   74    80    85    58.35000  112.70000
   74    82    89    60.00000  109.50000
   80    74    75    37.50000  110.70000
   80    83    84    37.50000  110.70000
   80    83    91    58.35000  112.70000
   80    83    93    50.00000  109.50000
   80    85    86    37.50000  110.70000
   80    85    87    37.50000  110.70000
   80    85    88    37.50000  110.70000
   83    80    81    37.50000  110.70000
   83    91    92    37.50000  110.70000
   83    91    39    58.35000  112.70000
   83    91    98    58.35000  112.70000
   83    93    94    55.00000  108.50000
   91    83    84    37.50000  110.70000
   91    39    40    37.50000  110.70000
   91    39    41    37.50000  110.70000
   91    98    99    37.50000  110.70000
   91    98   100    37.50000  110.70000
   91    98   101    37.50000  110.70000
   39    33    37    63.00000  111.10000
   39    91    92    37.50000  110.70000
   41    39    40    33.00000  107.80000
   98    91    92    37.50000  110.70000
   98    91    39    58.35000  112.70000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
   93    83    84    35.00000  109.50000
   93    83    91    50.00000  109.50000
   85    80    81    37.50000  110.70000
   85    80    83    58.35000  112.70000
   87    85    86    33.00000  107.80000
   88    85    86    33.00000  107.80000
   88    85    87    33.00000  107.80000
   82    74    75    35.00000  109.50000
   82    74    80    50.00000  109.50000
   82    89    90    35.00000  109.50000
   82    89    95    90.00000  108.56700
   82    89   115    92.60000  111.55000
   89    95    96    45.00000  108.72000
   89    95    97    45.00000  108.72000
   89    95   102    75.00000  109.43000
   89   115   107    60.00000  109.50000
   95    89    90    45.00000  112.01100
   95   102   103    37.50000  110.70000
   95   102   104    58.35000  112.70000
   95   102   106    50.00000  109.50000
   97    95    96    33.00000  107.80000
  102    95    96    37.50000  110.70000
  102    95    97    37.50000  110.70000
  102   104   105    37.50000  110.70000
  102   104   107    58.35000  112.70000
  102   104   109    50.00000  109.50000
  102   106   111    60.00000  109.50000
  104   102   103    37.50000  110.70000
  104   107   108    37.50000  110.70000
  104   107   115    50.00000  109.50000
  104   107   116    58.35000  112.70000
  104   109   110    55.00000  108.50000
  107   104   105    37.50000  110.70000
  107   116   117    37.50000  110.70000
  107   116   118    37.50000  110.70000
  107   116   119    37.50000  110.70000
  115    89    90    35.00000  109.50000
  115    89    95    90.00000  108.56700
  115   107   108    35.00000  109.50000
  116   107   108    37.50000  110.70000
  116   107   115    50.00000  109.50000
  118   116   117    33.00000  107.80000
  119   116   117    33.00000  107.80000
  119   116   118    33.00000  107.80000
  109   104   105    35.00000  109.50000
  109   104   107    50.00000  109.50000
  106   102   103    35.00000  109.50000
  106   102   104    50.00000  109.50000
  106   111   112    35.00000  109.50000
  106   111   113    35.00000  109.50000
  106   111   114    35.00000  109.50000
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   76    72    73    37.50000  110.70000
   76    72    74    58.35000  112.70000
   78    76    77    33.00000  107.80000
   79    76    77    33.00000  107.80000
   79    76    78    33.00000  107.80000
   66    59    60    37.50000  110.70000
   66    59    65    50.00000  109.50000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   61    55    56    37.50000  110.70000
   61    55    59    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   57    49    50    35.00000  109.50000
   57    49    55    50.00000  109.50000
   51    45    46    37.50000  110.70000
   51    45    49    58.35000  112.70000
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    33.00000  107.80000
   42    33    37    63.00000  111.10000
   42    33    39    58.35000  112.70000
   42    47    48    55.00000  108.50000
   44    42    43    33.00000  107.80000
   47    42    43    35.00000  109.50000
   47    42    44    35.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
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   82    89   115   107  -0.81800  1.0 1.0
   89    95   102   103   0.15000  1.0 3.0
   89    95   102   104   3.97050  1.0 1.0
   89    95   102   106   0.62750  1.0 1.0
   89    95   102   106  -0.30950 -1.0 2.0
   89    95   102   106   0.27300  1.0 3.0
   90    89    95    96   0.15000  1.0 3.0
   90    89    95    97   0.15000  1.0 3.0
   90    89    95   102   0.15000  1.0 3.0
   90    89   115   107   0.37050  1.0 3.0
   95    89   115   107   0.06250  1.0 1.0
   95    89   115   107  -0.01100 -1.0 2.0
   95    89   115   107   0.28050  1.0 3.0
   95   102   104   105   0.15000  1.0 3.0
   95   102  -104   107   0.56750  1.0 1.0
   95   102  -104   107  -0.07550 -1.0 2.0
   95   102  -104   107   0.20000  1.0 3.0
   95   102   104   109   0.86500  1.0 1.0
   95   102   104   109  -0.17500 -1.0 2.0
   95   102   104   109   0.20800  1.0 3.0
   95   102   106   111   0.06250  1.0 1.0
   95   102   106   111  -0.01100 -1.0 2.0
   95   102   106   111   0.28050  1.0 3.0
   96    95   102   103   0.15000  1.0 3.0
   96    95   102   104   0.15000  1.0 3.0
   96    95   102   106   0.23400  1.0 3.0
   97    95   102   103   0.15000  1.0 3.0
   97    95   102   104   0.15000  1.0 3.0
   97    95   102   106   0.23400  1.0 3.0
  102   104   107   108   0.15000  1.0 3.0
  102   104   107   115   0.62750  1.0 1.0
  102   104   107   115  -0.30950 -1.0 2.0
  102   104   107   115   0.27300  1.0 3.0
  102   104   107   116   0.56750  1.0 1.0
  102   104   107   116  -0.07550 -1.0 2.0
  102   104   107   116   0.20000  1.0 3.0
  102   104   109   110  -0.11600  1.0 1.0
  102   104   109   110  -0.09450 -1.0 2.0
  102   104   109   110   0.21250  1.0 3.0
  102   106   111   112   0.37050  1.0 3.0
  102   106   111   113   0.37050  1.0 3.0
  102   106   111   114   0.37050  1.0 3.0
  103   102   104   105   0.15000  1.0 3.0
  103   102   104   107   0.15000  1.0 3.0
  103   102   104   109   0.23400  1.0 3.0
  103   102   106   111   0.37050  1.0 3.0
  104   102   106   111   0.06250  1.0 1.0
  104   102   106   111  -0.01100 -1.0 2.0
  104   102   106   111   0.28050  1.0 3.0
  104   107  -115    89   0.06250  1.0 1.0
  104   107  -115    89  -0.01100 -1.0 2.0
  104   107  -115    89   0.28050  1.0 3.0
  104   107   116   117   0.15000  1.0 3.0
  104   107   116   118   0.15000  1.0 3.0
  104   107   116   119   0.15000  1.0 3.0
  105   104   107   108   0.15000  1.0 3.0
  105   104   107   115   0.23400  1.0 3.0
  105   104   107   116   0.15000  1.0 3.0
  105   104   109   110   0.19450  1.0 3.0
  107   104   109   110  -0.11600  1.0 1.0
  107   104   109   110  -0.09450 -1.0 2.0
  107   104   109   110   0.21250  1.0 3.0
  108   107   115    89   0.37050  1.0 3.0
  108   107   116   117   0.15000  1.0 3.0
  108   107   116   118   0.15000  1.0 3.0
  108   107   116   119   0.15000  1.0 3.0
  115    89    95    96   0.23400  1.0 3.0
  115    89    95    97   0.23400  1.0 3.0
  115    89   -95   102   0.62750  1.0 1.0
  115    89   -95   102  -0.30950 -1.0 2.0
  115    89   -95   102   0.27300  1.0 3.0
  115   107   116   117   0.23400  1.0 3.0
  115   107   116   118   0.23400  1.0 3.0
  115   107   116   119   0.23400  1.0 3.0
  116   107   115    89   0.06250  1.0 1.0
  116   107   115    89  -0.01100 -1.0 2.0
  116   107   115    89   0.28050  1.0 3.0
  109   104   107   108   0.23400  1.0 3.0
  109   104   107   115   3.69350  1.0 1.0
  109   104   107   115  -1.82950 -1.0 2.0
  109   104   107   116   0.86500  1.0 1.0
  109   104   107   116  -0.17500 -1.0 2.0
  109   104   107   116   0.20800  1.0 3.0
  106   102   104   105   0.23400  1.0 3.0
  106   102   104   107   0.62750  1.0 1.0
  106   102   104   107  -0.30950 -1.0 2.0
  106   102   104   107   0.27300  1.0 3.0
  106   102   104   109   3.69350  1.0 1.0
  106   102   104   109  -1.82950 -1.0 2.0
   76    72    74    75   0.15000  1.0 3.0
   76    72    74    80   0.56750  1.0 1.0
   76    72    74    80  -0.07550 -1.0 2.0
   76    72    74    80   0.20000  1.0 3.0
   76    72    74    82   0.62750  1.0 1.0
   76    72    74    82  -0.30950 -1.0 2.0
   76    72    74    82   0.27300  1.0 3.0
   66    59    65    70  -0.25900  1.0 1.0
   66    59    65    70  -0.47000 -1.0 2.0
   66    59    65    70   0.11750  1.0 3.0
   61    55    59    60   0.15000  1.0 3.0
   61    55    59    65   0.62750  1.0 1.0
   61    55    59    65  -0.30950 -1.0 2.0
   61    55    59    65   0.27300  1.0 3.0
   61    55    59    66   0.56750  1.0 1.0
   61    55    59    66  -0.07550 -1.0 2.0
   61    55    59    66   0.20000  1.0 3.0
   57    49    55    56   0.23400  1.0 3.0
   57    49    55    59   0.86500  1.0 1.0
   57    49    55    59  -0.17500 -1.0 2.0
   57    49    55    59   0.20800  1.0 3.0
   57    49    55    61   0.86500  1.0 1.0
   57    49    55    61  -0.17500 -1.0 2.0
   57    49    55    61   0.20800  1.0 3.0
   51    45    49    50   0.15000  1.0 3.0
   51    45    49    55   0.56750  1.0 1.0
   51    45    49    55  -0.07550 -1.0 2.0
   51    45    49    55   0.20000  1.0 3.0
   51    45    49    57   0.86500  1.0 1.0
   51    45    49    57  -0.17500 -1.0 2.0
   51    45    49    57   0.20800  1.0 3.0
   42    33    37    38   0.30150 -1.0 2.0
   42    33    37    45   0.60050  1.0 1.0
   42    33    37    45   0.05600 -1.0 2.0
   42    33    37    45   0.26150  1.0 3.0
   42    33    39    91   0.56750  1.0 1.0
   42    33    39    91  -0.07550 -1.0 2.0
   42    33    39    91   0.20000  1.0 3.0
   42    33    39    40   0.15000  1.0 3.0
   42    33    39    41   0.15000  1.0 3.0
   43    42    47    48   0.19450  1.0 3.0
   44    42    47    48   0.19450  1.0 3.0
IPHI
    8     5     7     9  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
   35    30    34    36  10.50000 -1.0 2.0
   33    45    37    38  10.50000 -1.0 2.0
   65    72    70    71  10.50000 -1.0 2.0
END
