* LIGAND DATABASE FILE (OPLS2005)
*
001      70    72    127    196     368
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02094    69.57532    68.83628
    3     1 S   H    _H1_     3     1.02096    43.59598  -138.69945
    4     1 S   H    _H2_     4     1.02068   104.03580   -36.23595
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    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     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04690   118.93088     8.54895
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08448   106.42696   -11.15906
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08733   110.25787    59.09629
   26    24 S   HC   HB22    34     1.08755   109.66015   178.71915
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C11    36     1.83426    98.14559  -178.21567
   34    33 S   HC   _H5_    37     1.09402   106.01475    36.16216
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CT   _C10    38     1.52145   113.05919   160.04427
   39    38 S   HC   _H4_    39     1.09726   109.08792  -160.55781
   40    38 S   CO   _C9_    40     1.52383   102.84813    82.16915
   41    40 S   HC   _H3_    41     1.11573   112.34749   -88.32705
   42    38 S   OS   _O36    65     1.41382   114.43909   -40.02894
   43    40 S   N*   _N7_    42     1.51147   113.06603   153.58939
   44    40 S   OS   _O34    57     1.44248   105.94932    31.20159
   45    42 S   P1   _P1_    66     1.62811   118.40726   -79.96942
   46    45 S   O2Z  _O37    67     1.50619   111.98812   173.68695
   47    45 S   HP   _H12    68     1.41090   103.64268    40.01443
   48    43 S   CRAB _C4_    43     1.37361   125.93720   -87.47290
   49    48 S   HA   _H7_    44     1.08122   122.12068    -0.11869
   50    33 S   CT   _C12    58     1.52953   109.95380   -87.07433
   51    50 S   HC   _H6_    59     1.09889   113.11876    27.63786
   52    45 S   OS   _O38    69     1.62521   101.51969   -67.27991
   53    52 S   HO   _H13    70     0.98119   118.68161  -179.45035
   54    48 S   NNA  _N4_    45     1.31854   112.31623   180.00000
   55    50 S   CT   _C13    60     1.52586   112.38743   150.10952
   56    55 S   HC   _H9_    61     1.09046   109.89475    59.98991
   57    55 S   HC   _H10    62     1.09024   109.94220   -60.92150
   58    54 S   CB   _C5_    46     1.36386   103.91842     0.04846
   59    55 S   OH   _O35    63     1.41526   108.55237   179.54243
   60    59 S   HO   _H11    64     0.97198   107.08192   179.98022
   61    43 S   CN   _C8_    47     1.36352   127.23141    92.49525
   62    61 S   NNC  _N6_    48     1.35107   126.12880     0.00000
   63    62 S   CDX  _C7_    49     1.31560   113.06326   179.98022
   64    63 S   NNB  _N5_    50     1.41474   122.61296     0.00000
   65    64 S   H    _H8_    51     1.01584   117.42268  -179.95154
   66    63 S   NND  _N8_    54     1.37043   122.06383  -179.97202
   67    66 S   H    _H14    55     0.99353   118.28507     0.01978
   68    66 S   H    _H15    56     0.99342   118.27475   180.00000
   69    58 S   C    _C6_    52     1.43728   128.64659  -179.97202
   70    69 S   O    _O33    53     1.22376   123.78813    -0.06853
  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
  15   8   2   1   1  15   7  14   6   8  10   8   4   3   2   6
   3   6   4   1   1   6   4   3   2   7   1   1   6   7   7   6
   3   3   1   1   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    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    50    51    55    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    43    44    50    51    55    56    57    59    42    45  
   38    39    40    44    50    51    55    42  
   36    37  
   37  
    0  
   39    40    41    43    48    61    44    50    51    55    42    45    46    47    52  
   40    41    43    44    50    42    45  
   41    43    48    49    54    58    61    62    44    50    51    55    42    45  
   43    48    61    44    50    42  
   45    46    47    52    53    43    44    50  
   48    49    54    58    61    62    63    69    44    50  
   50    51    55    56    57    59    48    61  
   46    47    52    53  
   47    52    53  
   52    53  
   49    54    58    61    62    69  
   54    58    61  
   51    55    56    57    59    60  
   55    56    57    59  
   53  
    0  
   58    61    62    64    69    70  
   56    57    59    60  
   57    59    60  
   59    60  
   61    62    63    64    65    69    70  
   60  
    0  
   62    63    64    69    70    66  
   63    64    65    69    66    67    68  
   64    65    69    70    66    67    68  
   65    69    70    66    67    68  
   69    70    66  
   67    68    69  
   68  
    0  
   70  
    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   0.212900   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.450000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   42   2.8500   0.1400  -0.461100   1.7660   1.5600   0.020110767  -0.896042159
   43   3.2500   0.1700  -0.500000   1.8000   1.6000   0.001000000  -0.511443539
   44   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   45   3.7400   0.2000   1.099000   2.1070   1.8700   0.005000000   0.000000000
   46   2.9800   0.2000  -0.666100   1.6890   1.4900   0.001000000  -0.126889456
   47   2.5000   0.0300  -0.056500   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0800   0.200000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   2.8500   0.1400  -0.568200   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   54   3.2500   0.1700  -0.490000   1.8000   1.6000   0.001000000  -0.511443539
   55   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0800   0.120000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5000   0.0800   0.340000   2.5000   1.7750   0.001000000  -0.843144165
   62   3.2500   0.1700  -0.510000   1.9250   1.7000   0.054801302  -2.445846770
   63   3.5000   0.0800   0.460000   2.1120   1.8750   0.001000000  -0.126889456
   64   3.2500   0.1700  -0.560000   2.1120   1.8750   0.051222218  -2.220205820
   65   0.0000   0.0000   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   66   3.2500   0.1700  -0.800000   2.1120   1.8750   0.051222218  -2.220205820
   67   0.5000   0.0300   0.400000   0.9960   0.8600   0.030040813  -0.651083722
   68   0.5000   0.0300   0.400000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.7500   0.1050   0.520000   1.9250   1.7000   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.510000   1.5250   1.4250   0.001000000  -1.480495490
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    50   268.000  1.529
   38    39   340.000  1.090
   38    40   250.000  1.527
   38    42   320.000  1.410
   40    41   340.000  1.090
   40    43   275.000  1.479
   40    44   320.000  1.380
   43    48   440.000  1.371
   43    61   436.000  1.374
   48    49   367.000  1.080
   48    54   529.000  1.304
   54    58   414.000  1.391
   58    61   520.000  1.370
   58    69   447.000  1.419
   61    62   461.000  1.354
   62    63   585.000  1.311
   63    64   427.000  1.381
   63    66   481.000  1.340
   64    65   434.000  1.010
   64    69   418.000  1.388
   69    70   570.000  1.229
   66    67   434.000  1.010
   66    68   434.000  1.010
   44    50   320.000  1.410
   50    51   340.000  1.090
   50    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    59   320.000  1.410
   59    60   553.000  0.945
   42    45   405.000  1.623
   45    46   675.000  1.490
   45    47   225.000  1.411
   45    52   405.000  1.623
   52    53   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    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    50    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    75.00000  109.43000
   33    38    42    50.00000  109.50000
   33    50    44    50.00000  109.50000
   33    50    51    37.50000  110.70000
   33    50    55    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    40    41    45.00000  112.01100
   38    40    43    75.00000  107.44000
   38    40    44    90.00000  108.56700
   38    42    45    75.00000  119.24600
   40    38    39    45.00000  108.72000
   40    43    48    70.00000  128.80000
   40    43    61    70.00000  125.80000
   40    44    50    60.00000  109.50000
   43    40    41    55.00000  103.44000
   43    48    49    35.00000  123.05000
   43    48    54    70.00000  113.90000
   43    61    58    70.00000  106.20000
   43    61    62    70.00000  126.20000
   48    54    58    70.00000  103.80000
   54    48    49    35.00000  123.05000
   54    58    61    70.00000  110.40000
   54    58    69    70.00000  130.00000
   58    61    62    70.00000  127.70000
   58    69    64    70.00000  111.30000
   58    69    70    80.00000  128.80000
   61    43    48    70.00000  105.40000
   61    62    63    70.00000  112.20000
   62    63    64    70.00000  123.30000
   62    63    66    70.00000  119.30000
   63    64    65    35.00000  118.00000
   63    64    69    70.00000  125.20000
   63    66    67    35.00000  120.00000
   63    66    68    35.00000  120.00000
   64    69    70    80.00000  120.60000
   69    58    61    85.00000  119.20000
   69    64    65    35.00000  116.80000
   66    63    64    70.00000  116.00000
   68    66    67    35.00000  120.00000
   44    40    41    35.00000  109.50000
   44    40    43   105.00000  106.22000
   44    50    51    35.00000  109.50000
   44    50    55    50.00000  109.50000
   50    33    34    37.50000  110.70000
   50    33    38    58.35000  112.70000
   50    55    56    37.50000  110.70000
   50    55    57    37.50000  110.70000
   50    55    59    50.00000  109.50000
   55    50    51    37.50000  110.70000
   55    59    60    55.00000  108.50000
   57    55    56    33.00000  107.80000
   59    55    56    35.00000  109.50000
   59    55    57    35.00000  109.50000
   42    38    39    35.00000  109.50000
   42    38    40    90.00000  109.38000
   42    45    46   100.00000  115.86100
   42    45    47    60.00000  100.09000
   42    45    52   120.00000  102.38000
   45    52    53    50.00000  113.86100
   47    45    46    50.00000  114.77800
   52    45    46   100.00000  115.86100
   52    45    47    60.00000  100.09000
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    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   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   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    50    44   0.56750  1.0 1.0
   29    33    50    44  -0.07550 -1.0 2.0
   29    33    50    44   0.20000  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    55   0.44750  1.0 1.0
   29    33    50    55  -0.17800 -1.0 2.0
   29    33    50    55   0.20200  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    43  -0.64600  1.0 1.0
   33    38    40    43   0.58400 -1.0 2.0
   33    38   -40    44   0.62750  1.0 1.0
   33    38   -40    44  -0.30950 -1.0 2.0
   33    38   -40    44   0.27300  1.0 3.0
   33    38    42    45  -2.65550  1.0 1.0
   33    38    42    45  -0.22350 -1.0 2.0
   33    38    42    45   0.24150  1.0 3.0
   33    50    55    56   0.15000  1.0 3.0
   33    50    55    57   0.15000  1.0 3.0
   33    50    55    59   0.86500  1.0 1.0
   33    50    55    59  -0.17500 -1.0 2.0
   33    50    55    59   0.20800  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    42   0.23400  1.0 3.0
   34    33    50    44   0.23400  1.0 3.0
   34    33    50    51   0.15000  1.0 3.0
   34    33    50    55   0.15000  1.0 3.0
   38    33   -50    44   0.62750  1.0 1.0
   38    33   -50    44  -0.30950 -1.0 2.0
   38    33   -50    44   0.27300  1.0 3.0
   38    33    50    51   0.15000  1.0 3.0
   38    33    50    55   0.56750  1.0 1.0
   38    33    50    55  -0.07550 -1.0 2.0
   38    33    50    55   0.20000  1.0 3.0
   38    40    43    48   1.10250  1.0 1.0
   38    40    43    48   0.01650 -1.0 2.0
   38    40    43    48   0.39100  1.0 3.0
   38    40    43    61   1.10250  1.0 1.0
   38    40    43    61   0.01650 -1.0 2.0
   38    40    43    61   0.39100  1.0 3.0
   38    40   -44    50   0.06250  1.0 1.0
   38    40   -44    50  -0.01100 -1.0 2.0
   38    40   -44    50   0.28050  1.0 3.0
   38    42    45    46   0.00000  1.0 1.0
   38    42    45    47   0.15000  1.0 3.0
   38    42    45    52   0.91800  1.0 1.0
   38    42    45    52   0.22900 -1.0 2.0
   38    42    45    52   0.32050  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    43   0.15000  1.0 3.0
   39    38    40    44   0.23400  1.0 3.0
   39    38    42    45   0.03000  1.0 3.0
   40    38    42    45  -2.65550  1.0 1.0
   40    38    42    45  -0.22350 -1.0 2.0
   40    38    42    45   0.24150  1.0 3.0
   40    43    48    49   3.62500 -1.0 2.0
   40    43    48    54   3.62500 -1.0 2.0
   40    43    61    58   0.81400  1.0 1.0
   40    43    61    58   1.55550 -1.0 2.0
   40    43    61    62   3.62500 -1.0 2.0
   40    44   -50    33   0.06250  1.0 1.0
   40    44   -50    33  -0.01100 -1.0 2.0
   40    44   -50    33   0.28050  1.0 3.0
   40    44    50    51   0.37050  1.0 3.0
   40    44    50    55   0.06250  1.0 1.0
   40    44    50    55  -0.01100 -1.0 2.0
   40    44    50    55   0.28050  1.0 3.0
   41    40    43    48   0.00000  1.0 1.0
   41    40    43    61   0.00000  1.0 1.0
   41    40    44    50   0.37050  1.0 3.0
   43    40    44    50  -2.37750  1.0 1.0
   43    40    44    50  -0.08150 -1.0 2.0
   43    40    44    50   0.59000  1.0 3.0
   43    48   -54    58   3.62500 -1.0 2.0
   43    61    62    63   1.25000 -1.0 2.0
   48    43   -61    58   0.70250  1.0 1.0
   48    43   -61    58   1.56150 -1.0 2.0
   48    43    61    62   3.62500 -1.0 2.0
   48    54   -58    61   3.62500 -1.0 2.0
   48    54    58    69   3.62500 -1.0 2.0
   49    48    54    58   3.62500 -1.0 2.0
   54    58   -61    43   3.62500 -1.0 2.0
   54    58    61    62   3.62500 -1.0 2.0
   54    58    69    64   5.37500 -1.0 2.0
   54    58    69    70   0.41000 -1.0 2.0
   58    61    62    63   3.62500 -1.0 2.0
   61    43    48    49   3.62500 -1.0 2.0
   61    43   -48    54   3.62500 -1.0 2.0
   61    58    69    64   1.50000 -1.0 2.0
   61    58    69    70   1.05000 -1.0 2.0
   61    62   -63    64   3.62500 -1.0 2.0
   61    62    63    66   3.62500 -1.0 2.0
   62    63    64    65   3.62500 -1.0 2.0
   62    63    64    69   3.62500 -1.0 2.0
   62    63    66    67   0.70000 -1.0 2.0
   62    63    66    68   0.70000 -1.0 2.0
   63    64   -69    58   1.52500 -1.0 2.0
   63    64    69    70   3.04450 -1.0 2.0
   64    63    66    67   1.01500 -1.0 2.0
   64    63    66    68   1.01500 -1.0 2.0
   65    64    69    58   1.52500 -1.0 2.0
   65    64    69    70   2.45000 -1.0 2.0
   69    58    61    43   3.62500 -1.0 2.0
   69    58   -61    62   3.62500 -1.0 2.0
   66    63    64    65   3.62500 -1.0 2.0
   66    63    64    69   3.62500 -1.0 2.0
   44    40    43    48   0.10350  1.0 1.0
   44    40    43    48  -0.15350 -1.0 2.0
   44    40    43    61   0.10350  1.0 1.0
   44    40    43    61  -0.15350 -1.0 2.0
   44    50    55    56   0.23400  1.0 3.0
   44    50    55    57   0.23400  1.0 3.0
   44    50    55    59   3.69350  1.0 1.0
   44    50    55    59  -1.82950 -1.0 2.0
   50    33    38    39   0.15000  1.0 3.0
   50    33   -38    40   3.97050  1.0 1.0
   50    33    38    42   0.62750  1.0 1.0
   50    33    38    42  -0.30950 -1.0 2.0
   50    33    38    42   0.27300  1.0 3.0
   50    55    59    60  -0.11600  1.0 1.0
   50    55    59    60  -0.09450 -1.0 2.0
   50    55    59    60   0.21250  1.0 3.0
   51    50    55    56   0.15000  1.0 3.0
   51    50    55    57   0.15000  1.0 3.0
   51    50    55    59   0.23400  1.0 3.0
   56    55    59    60   0.19450  1.0 3.0
   57    55    59    60   0.19450  1.0 3.0
   42    38    40    41   0.23400  1.0 3.0
   42    38    40    43  -0.86350  1.0 1.0
   42    38    40    43   0.04750 -1.0 2.0
   42    38    40    44   1.11900  1.0 1.0
   42    38    40    44  -1.16350 -1.0 2.0
   42    38    40    44  -0.34150  1.0 3.0
   42    45    52    53  -0.22900  1.0 1.0
   42    45    52    53   0.09450 -1.0 2.0
   42    45    52    53  -0.07800  1.0 3.0
   46    45    52    53   0.00000  1.0 1.0
   47    45    52    53   0.15000  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
   36    30    35    37  10.50000 -1.0 2.0
   48    61    43    40   4.00000 -1.0 2.0
   54    49    48    43   1.10000 -1.0 2.0
   61    69    58    54   4.00000 -1.0 2.0
   58    62    61    43   4.00000 -1.0 2.0
   64    66    63    62  10.50000 -1.0 2.0
   65    63    64    69   1.00000 -1.0 2.0
   58    64    69    70  10.50000 -1.0 2.0
   68    63    66    67   1.00000 -1.0 2.0
END
