* LIGAND DATABASE FILE (OPLS2005)
*
001      96   100    193    327     592
    1     0 S   NP   _N1_     1    28.70049    95.00280   -24.68404
    2     1 S   H    _HN1     2     1.02786   111.72317   -90.46812
    3     1 S   H    _H1_     3     1.02950    79.03465    15.08467
    4     1 S   H    _H2_     4     1.02830    28.80844  -178.25538
    5     1 S   CT   _CA1     5     1.50111   128.61374   122.53748
    6     5 S   HC   _HA1     6     1.09573   105.20289    85.50534
    7     5 S   CO3  _C1_     7     1.53788   112.45121   -34.74366
    8     7 S   O2Z  _O11     8     1.26371   115.00600   -42.87529
    9     7 S   O2Z  _O12     9     1.26239   114.94649   136.26946
   10     5 S   CT   _CB1    10     1.53083   107.42786  -156.50750
   11    10 S   HC   HB11    11     1.09832   109.38230   -49.77010
   12    10 S   HC   HB12    12     1.09814   110.44268    66.83701
   13    10 S   CT   _CG1    13     1.52993   112.60363  -170.75163
   14    13 S   HC   HG11    14     1.09583   110.62137   -65.33992
   15    13 S   HC   HG12    15     1.09669   109.79916    53.89300
   16    13 S   C    _CD1    16     1.51800   112.23484   174.35312
   17    16 S   O    _OE1    17     1.22732   123.28635     6.43310
   18    16 S   N    _N2_    18     1.38659   111.67264  -173.70811
   19    18 S   H    _HN2    19     1.01582   118.95028     1.71235
   20    18 S   CT1  _CA2    20     1.46188   123.36315   177.57570
   21    20 S   HC   _HA2    21     1.09737   109.36075     1.57197
   22    20 S   C    _C2_    22     1.53534   108.58816  -113.90261
   23    22 S   O    _O2_    23     1.23057   122.28397  -147.84676
   24    20 S   CT   _CB2    32     1.53337   111.64733   123.58744
   25    24 S   HC   HB21    33     1.09585   110.13114    56.50054
   26    24 S   HC   HB22    34     1.09454   109.91341   175.61689
   27    22 S   N    _N3_    24     1.38329   113.68042    39.58951
   28    27 S   H    _HN3    25     1.01591   119.58120    -3.35853
   29    24 S   S    _SG2    35     1.82726   111.52558   -64.53018
   30    27 S   CT   _CA3    26     1.45288   123.20674   177.10964
   31    30 S   HC   HA31    27     1.09549   107.51067   -64.51117
   32    30 S   HC   HA32    28     1.09557   107.98375    51.92643
   33    29 S   CT   _C22    36     1.83024    99.86075   172.57905
   34    33 S   HC   _H3_    37     1.09779   104.71849   -54.64996
   35    30 S   CO3  _C3_    29     1.52958   114.08168   173.91746
   36    35 S   O2Z  _O31    30     1.26377   116.06415    -0.81613
   37    35 S   O2Z  _O32    31     1.26429   114.41216   179.24671
   38    33 S   CT   _C15    38     1.52096   113.37075    63.91171
   39    38 S   HC   _H45    39     1.09735   110.76870    43.14474
   40    38 S   HC   _H46    40     1.09384   111.85639   -74.73540
   41    38 S   CT   _C17    41     1.54758   105.70998   161.20422
   42    41 S   HC   _H49    42     1.09753   104.16119  -126.15874
   43    41 S   CM   _C7_    43     1.52007   115.62492   119.75401
   44    41 S   CT   _C23    53     1.58391   106.04425   -10.70138
   45    43 S   CM   _C4_    44     1.44575   117.68325   147.89574
   46    45 S   HC   _H30    45     1.08522   118.93885     0.52712
   47    44 S   CT   _C13    54     1.53791   111.73535  -135.27241
   48    47 S   HC   _H41    55     1.09735   110.54253   -63.04532
   49    47 S   HC   _H42    56     1.09820   108.79294  -177.94748
   50    44 S   CT   _C26    93     1.55378   111.92850   105.18116
   51    50 S   HC   _H55    94     1.09450   112.10336   -57.77230
   52    50 S   HC   _H56    95     1.09632   111.33936  -178.20289
   53    50 S   HC   _H57    96     1.09559   111.62637    63.57740
   54    45 S   CM   _C5_    46     1.33636   121.32784  -179.53775
   55    54 S   HC   _H31    47     1.08351   121.54357  -179.90309
   56    47 S   CT   _C11    57     1.52913   115.23612    60.50707
   57    56 S   HC   _H37    58     1.09575   107.12465   150.34239
   58    56 S   HC   _H38    59     1.09785   108.36782   -96.21838
   59    54 S   CO4  _C8_    48     1.47536   120.63518     0.16071
   60    59 S   O    _O25    49     1.22652   120.60622  -179.80617
   61    56 S   CT   _C19    60     1.54796   115.71227    25.71816
   62    61 S   HC   _H51    61     1.09506   106.90846   -86.75430
   63    59 S   OS   _O26    50     1.36845   117.15665     0.25488
   64    61 S   CT   _C20    62     1.54723   110.66957    29.92350
   65    64 S   HC   _H52    63     1.09115   107.64740  -174.89101
   66    43 S   CM   _C6_    51     1.33988   125.57977   -30.88479
   67    66 S   HC   _H32    52     1.08055   126.15204    -1.54775
   68    64 S   CT   _C10    64     1.54649   109.16041    72.25081
   69    68 S   HC   _H35    65     1.09482   111.21894   -65.76190
   70    68 S   HC   _H36    66     1.09608   110.40469   176.01724
   71    33 S   CT   _C25    90     1.55746   116.13798  -173.91775
   72    68 S   CT   _C9_    67     1.52651   111.80641    56.97015
   73    72 S   HC   _H33    68     1.09581   108.27471    67.09305
   74    72 S   HC   _H34    69     1.09727   108.68666  -178.08031
   75    71 S   OH   _O28    91     1.43457   106.01847    76.80287
   76    75 S   HO   _H62    92     0.97344   107.45208   -57.33501
   77    72 S   CT   _C18    70     1.53885   113.30657   -56.33066
   78    77 S   HC   _H50    71     1.09825   106.63061   -66.96805
   79    77 S   CT   _C16    72     1.54108   110.05243   177.75711
   80    79 S   HC   _H47    73     1.09795   110.18954    50.31021
   81    79 S   HC   _H48    74     1.09763   109.83097   164.87133
   82    79 S   CT   _C21    75     1.52805   113.39514   -72.45920
   83    82 S   HC   _H53    76     1.09540   109.82335    69.92452
   84    82 S   CT   _C12    77     1.52552   112.15031   -52.40661
   85    84 S   HC   _H39    78     1.09632   110.09451   -72.59722
   86    84 S   HC   _H40    79     1.09749   109.26479   172.98379
   87    82 S   OH   _O27    88     1.42529   108.43738  -173.39046
   88    87 S   HO   _H61    89     0.97246   107.50652  -179.59944
   89    84 S   CT   _C14    80     1.52940   112.30230    51.39326
   90    89 S   HC   _H43    81     1.09450   107.18071    70.15146
   91    89 S   HC   _H44    82     1.09753   108.81865  -175.77557
   92    61 S   CT   _C24    83     1.58203   112.85185   158.19293
   93    92 S   CT   _C27    84     1.55408   109.03126    46.43582
   94    93 S   HC   _H58    85     1.09477   111.89895   -67.34431
   95    93 S   HC   _H59    86     1.09309   112.93722   173.11633
   96    93 S   HC   _H60    87     1.09609   110.69893    53.07958
  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  10   5   4   3
  17   8   2   1   1  13   6   5  20   7  12  19   8   4  15   7
   6   7   3   2   1   5   3  12   5   4   4   2  21   8   2  14
   7   1   1  11   6   5   4  11   5   4   1   1  16   7  12   6
   5  10   6   9   6   5   2   1   7   3   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    71    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    44    64    71    75  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    47    61    64    65    68    71    75    76    50  
   38    39    40    41    44    64    71    75  
   36    37  
   37  
    0  
   39    40    41    42    43    45    66    44    47    64    71    75    50  
   40    41    42    43    44    71  
   41    42    43    44    71  
   42    43    45    46    54    63    66    67    44    47    48    49    56    64    71    75    50    51    52    53  
   43    45    66    44    47    71    50  
   45    46    54    55    59    63    66    67    44    47    71    50  
   47    48    49    56    57    58    61    64    65    68    71    75    76    50    51    52    53    45    66  
   46    54    55    59    60    63    66    67  
   54    55    59    66  
   48    49    56    57    58    61    62    64    92    71    75    50    51    52    53  
   49    56    57    58    61    71    50  
   56    57    58    61    71    50  
   51    52    53    56    64    71    75  
   52    53    71  
   53    71  
   71  
   55    59    60    63    66  
   59    60    63  
   57    58    61    62    64    65    68    77    89    92    93    71  
   58    61    62    64    92  
   61    62    64    92  
   60    63    66    67  
   63    66  
   62    64    65    68    69    70    72    77    78    79    84    89    90    91    92    93    94    95    96    71    75  
   64    65    68    77    89    92    93    71  
   66    67  
   65    68    69    70    72    73    74    77    89    92    93    71    75    76  
   68    69    70    72    92    71    75  
   67  
    0  
   69    70    72    73    74    77    78    79    92    71    75  
   70    72    73    74    77    71  
   72    73    74    77    71  
   75    76    72    92  
   73    74    77    78    79    80    81    82    89    92    93  
   74    77    78    79    92  
   77    78    79    92  
   76  
    0  
   78    79    80    81    82    83    84    89    90    91    92    93    94    95    96    87  
   79    80    81    82    89    92    93  
   80    81    82    83    84    85    86    89    92    93    87    88  
   81    82    83    84    92    87  
   82    83    84    92    87  
   83    84    85    86    89    90    91    92    87    88  
   84    85    86    89    87    88  
   85    86    89    90    91    92    93    87    88  
   86    89    90    91    92    87  
   89    90    91    92    87  
   88    89  
    0  
   90    91    92    93    94    95    96  
   91    92    93  
   92    93  
   93    94    95    96  
   94    95    96  
   95    96  
   96  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   44   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   61   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.8500   0.1400  -0.165000   1.5900   1.4000   0.020110767  -0.896042159
   64   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760  -0.030000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   72   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   76   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   77   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   88   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   89   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   93   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    34   340.000  1.090
   33    38   268.000  1.529
   33    71   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   268.000  1.529
   41    42   340.000  1.090
   41    43   317.000  1.510
   41    44   268.000  1.529
   43    45   380.000  1.444
   43    66   549.000  1.340
   45    46   340.000  1.080
   45    54   549.000  1.340
   54    55   340.000  1.080
   54    59   320.000  1.462
   59    60   570.000  1.229
   59    63   214.000  1.327
   63    66   440.000  1.360
   66    67   340.000  1.080
   44    47   268.000  1.529
   44    71   268.000  1.529
   44    50   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    56   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    61   268.000  1.529
   61    62   340.000  1.090
   61    64   268.000  1.529
   61    92   268.000  1.529
   64    65   340.000  1.090
   64    68   268.000  1.529
   64    71   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    77   268.000  1.529
   77    78   340.000  1.090
   77    79   268.000  1.529
   77    92   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    82   268.000  1.529
   82    83   340.000  1.090
   82    84   268.000  1.529
   82    87   320.000  1.410
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    89   268.000  1.529
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   268.000  1.529
   92    93   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   340.000  1.090
   87    88   553.000  0.945
   71    75   320.000  1.410
   75    76   553.000  0.945
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    71    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    71    44    58.35000  112.70000
   33    71    64    58.35000  112.70000
   33    71    75    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    42    37.50000  110.70000
   38    41    43    70.00000  112.02700
   38    41    44    58.35000  112.70000
   40    38    39    33.00000  107.80000
   41    38    39    37.50000  110.70000
   41    38    40    37.50000  110.70000
   41    43    45    70.00000  124.00000
   41    43    66    70.00000  124.00000
   41    44    47    58.35000  112.70000
   41    44    71    58.35000  112.70000
   41    44    50    58.35000  112.70000
   43    41    42    35.00000  109.50000
   43    45    46    35.00000  120.00000
   43    45    54    70.00000  123.01800
   43    66    63    80.00000  120.01400
   43    66    67    35.00000  120.00000
   45    54    55    35.00000  120.00000
   45    54    59    65.00000  118.96000
   54    45    46    35.00000  120.00000
   54    59    60    80.00000  123.72100
   54    59    63    90.00000  111.29400
   59    54    55    40.00000  117.72500
   59    63    66    90.00000  114.22900
   63    59    60    83.00000  123.40000
   63    66    67    55.00000  109.52600
   66    43    45    70.00000  123.01800
   44    41    42    37.50000  110.70000
   44    41    43    70.00000  112.02700
   44    47    48    37.50000  110.70000
   44    47    49    37.50000  110.70000
   44    47    56    58.35000  112.70000
   44    71    64    58.35000  112.70000
   44    71    75    50.00000  109.50000
   44    50    51    37.50000  110.70000
   44    50    52    37.50000  110.70000
   44    50    53    37.50000  110.70000
   47    56    57    37.50000  110.70000
   47    56    58    37.50000  110.70000
   47    56    61    58.35000  112.70000
   49    47    48    33.00000  107.80000
   56    47    48    37.50000  110.70000
   56    47    49    37.50000  110.70000
   56    61    62    37.50000  110.70000
   56    61    64    58.35000  112.70000
   56    61    92    58.35000  112.70000
   58    56    57    33.00000  107.80000
   61    56    57    37.50000  110.70000
   61    56    58    37.50000  110.70000
   61    64    65    37.50000  110.70000
   61    64    68    58.35000  112.70000
   61    64    71    58.35000  112.70000
   61    92    77    58.35000  112.70000
   61    92    89    58.35000  112.70000
   61    92    93    58.35000  112.70000
   64    61    62    37.50000  110.70000
   64    68    69    37.50000  110.70000
   64    68    70    37.50000  110.70000
   64    68    72    58.35000  112.70000
   64    71    75    50.00000  109.50000
   68    64    65    37.50000  110.70000
   68    72    73    37.50000  110.70000
   68    72    74    37.50000  110.70000
   68    72    77    58.35000  112.70000
   70    68    69    33.00000  107.80000
   72    68    69    37.50000  110.70000
   72    68    70    37.50000  110.70000
   72    77    78    37.50000  110.70000
   72    77    79    58.35000  112.70000
   72    77    92    58.35000  112.70000
   74    72    73    33.00000  107.80000
   77    72    73    37.50000  110.70000
   77    72    74    37.50000  110.70000
   77    79    80    37.50000  110.70000
   77    79    81    37.50000  110.70000
   77    79    82    58.35000  112.70000
   77    92    89    58.35000  112.70000
   77    92    93    58.35000  112.70000
   79    77    78    37.50000  110.70000
   79    82    83    37.50000  110.70000
   79    82    84    58.35000  112.70000
   79    82    87    50.00000  109.50000
   81    79    80    33.00000  107.80000
   82    79    80    37.50000  110.70000
   82    79    81    37.50000  110.70000
   82    84    85    37.50000  110.70000
   82    84    86    37.50000  110.70000
   82    84    89    58.35000  112.70000
   82    87    88    55.00000  108.50000
   84    82    83    37.50000  110.70000
   84    89    90    37.50000  110.70000
   84    89    91    37.50000  110.70000
   84    89    92    58.35000  112.70000
   86    84    85    33.00000  107.80000
   89    84    85    37.50000  110.70000
   89    84    86    37.50000  110.70000
   89    92    93    58.35000  112.70000
   91    89    90    33.00000  107.80000
   92    61    62    37.50000  110.70000
   92    61    64    58.35000  112.70000
   92    77    78    37.50000  110.70000
   92    77    79    58.35000  112.70000
   92    89    90    37.50000  110.70000
   92    89    91    37.50000  110.70000
   92    93    94    37.50000  110.70000
   92    93    95    37.50000  110.70000
   92    93    96    37.50000  110.70000
   95    93    94    33.00000  107.80000
   96    93    94    33.00000  107.80000
   96    93    95    33.00000  107.80000
   87    82    83    35.00000  109.50000
   87    82    84    50.00000  109.50000
   71    33    34    37.50000  110.70000
   71    33    38    58.35000  112.70000
   71    44    47    58.35000  112.70000
   71    64    65    37.50000  110.70000
   71    64    68    58.35000  112.70000
   71    75    76    55.00000  108.50000
   50    44    47    58.35000  112.70000
   50    44    71    58.35000  112.70000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
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
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    71   0.01700  1.0 1.0
   24    29    33    71  -0.23550 -1.0 2.0
   24    29    33    71   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    71    44   0.44750  1.0 1.0
   29    33    71    44  -0.17800 -1.0 2.0
   29    33    71    44   0.20200  1.0 3.0
   29    33    71    64   0.44750  1.0 1.0
   29    33    71    64  -0.17800 -1.0 2.0
   29    33    71    64   0.20200  1.0 3.0
   29    33    71    75   0.56750  1.0 1.0
   29    33    71    75  -0.07550 -1.0 2.0
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   50    44    47    48   0.15000  1.0 3.0
   50    44    47    49   0.15000  1.0 3.0
   50    44    47    56   0.56750  1.0 1.0
   50    44    47    56  -0.07550 -1.0 2.0
   50    44    47    56   0.20000  1.0 3.0
   50    44    71    33   0.56750  1.0 1.0
   50    44    71    33  -0.07550 -1.0 2.0
   50    44    71    33   0.20000  1.0 3.0
   50    44    71    64   0.56750  1.0 1.0
   50    44    71    64  -0.07550 -1.0 2.0
   50    44    71    64   0.20000  1.0 3.0
   50    44    71    75   0.86500  1.0 1.0
   50    44    71    75  -0.17500 -1.0 2.0
   50    44    71    75   0.20800  1.0 3.0
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
   37    30    35    36  10.50000 -1.0 2.0
   41    45    43    66   1.10000 -1.0 2.0
   43    46    45    54   1.10000 -1.0 2.0
   59    55    54    45   1.10000 -1.0 2.0
   54    63    59    60  10.50000 -1.0 2.0
   63    67    66    43   1.10000 -1.0 2.0
END
