* LIGAND DATABASE FILE (OPLS2005)
*
001      74    76    134    202     385
    1     0 S   NP   _N1_     1    29.43339    91.29587   -20.49091
    2     1 S   H    _HN1     2     1.03041   112.82708   -26.61317
    3     1 S   H    _H1_     3     1.02956   108.55324    92.23045
    4     1 S   H    _H2_     4     1.02790     6.33701    12.99292
    5     1 S   CT   _CA1     5     1.50108   105.19270  -149.57886
    6     5 S   HC   _HA1     6     1.09569   105.32829    57.56009
    7     5 S   CO3  _C1_     7     1.53724   112.33149   -62.88832
    8     7 S   O2Z  _O11     8     1.26373   115.01302   -47.83470
    9     7 S   O2Z  _O12     9     1.26231   114.94808   131.41147
   10     5 S   CT   _CB1    10     1.52983   107.35784   175.30222
   11    10 S   HC   HB11    11     1.09748   109.08472   -53.36820
   12    10 S   HC   HB12    12     1.09804   110.45795    63.09392
   13    10 S   CT   _CG1    13     1.52800   113.21062  -173.85921
   14    13 S   HC   HG11    14     1.09557   111.26496   -66.38505
   15    13 S   HC   HG12    15     1.09601   110.78253    52.96527
   16    13 S   C    _CD1    16     1.51435   109.86919   172.31466
   17    16 S   O    _OE1    17     1.22868   121.67038   -95.11885
   18    16 S   N    _N2_    18     1.38368   113.09670    83.34345
   19    18 S   H    _HN2    19     1.01564   119.22881     5.75360
   20    18 S   CT1  _CA2    20     1.45749   122.55849   179.04387
   21    20 S   HC   _HA2    21     1.09619   108.68164    28.10022
   22    20 S   C    _C2_    22     1.53024   107.24448   -88.53424
   23    22 S   O    _O2_    23     1.22959   122.98629   -25.36118
   24    20 S   CT   _CB2    32     1.53208   112.52141   151.66466
   25    24 S   HC   HB21    33     1.09659   109.89430    59.80319
   26    24 S   HC   HB22    34     1.09576   110.87205   177.06402
   27    22 S   N    _N3_    24     1.38665   112.43563   157.30344
   28    27 S   H    _HN3    25     1.01518   119.82176     1.04568
   29    24 S   S    _SG2    35     1.82768   114.61366   -60.36103
   30    27 S   CT   _CA3    26     1.45423   122.54102   176.16212
   31    30 S   HC   HA31    27     1.09562   108.59202    36.07541
   32    30 S   HC   HA32    28     1.09477   107.17884   153.08234
   33    29 S   CT   _C13    36     1.82831    99.95703   -60.64020
   34    33 S   HC   _H9_    37     1.09413   108.50245   -37.16601
   35    33 S   HC   _H10    38     1.09409   107.42179    80.62019
   36    30 S   CO3  _C3_    29     1.53090   114.18471   -86.60047
   37    36 S   O2Z  _O31    30     1.26320   116.13843   -23.83264
   38    36 S   O2Z  _O32    31     1.26474   114.45637   156.96110
   39    33 S   CT   _C12    39     1.53574   111.15582  -158.15639
   40    39 S   HC   _H6_    40     1.09638   109.41269    57.76928
   41    39 S   CT   _C11    41     1.53019   113.88291  -179.09821
   42    41 S   HC   _H5_    42     1.09744   110.31550  -153.90346
   43    41 S   CT   _C10    43     1.51581   102.40708    89.49845
   44    43 S   HC   _H4_    44     1.09638   110.98387   -82.28011
   45    41 S   OS   _O35    65     1.41502   113.72985   -29.94338
   46    43 S   CO   _C9_    45     1.52035   101.45951    37.52691
   47    46 S   HC   _H3_    46     1.09646   112.22263    86.19789
   48    43 S   OH   _O42    63     1.41862   112.19410   157.48039
   49    48 S   HO   _H12    64     0.97252   108.61281   -51.57971
   50    45 S   P2   _P1_    66     1.63506   119.14173   -91.57908
   51    50 S   O2Z  _O37    67     1.51208   107.69688   177.63520
   52    50 S   O2Z  _O36    68     1.51226   108.70259    44.97034
   53    46 S   N*   _N7_    47     1.45066   113.51016  -151.53438
   54    39 S   OS   _O34    62     1.44440   110.23711   -60.77853
   55    50 S   OS   _O38    69     1.62684    98.68557   -69.15127
   56    53 S   CRAB _C4_    48     1.37322   126.72516    85.54282
   57    56 S   HA   _H7_    49     1.08105   122.38264     0.17017
   58    55 S   P2   _P2_    70     1.62390   130.72646   173.62434
   59    58 S   O2Z  _O41    71     1.51093   109.63182    63.28142
   60    58 S   O2Z  _O39    72     1.51093   109.69089   -72.25760
   61    56 S   NNA  _N4_    50     1.31852   112.42173  -179.82983
   62    58 S   OS   _O40    73     1.63176    98.24292   175.12018
   63    62 S   HO   _H11    74     0.97869   115.82604   -80.42345
   64    61 S   CB   _C5_    51     1.36342   103.91304     0.13270
   65    53 S   CN   _C8_    52     1.36714   126.47292   -93.99162
   66    65 S   NNC  _N6_    53     1.35338   126.92594    -0.10653
   67    66 S   CDX  _C7_    54     1.31352   113.37186   179.92338
   68    67 S   NNB  _N5_    55     1.40832   122.82907     0.07133
   69    68 S   H    _H8_    56     1.01392   117.92443   179.93439
   70    67 S   NND  _N8_    59     1.36688   121.63801  -179.95154
   71    70 S   H    _H13    60     1.01385   120.42973     0.13417
   72    70 S   H    _H14    61     1.01289   122.09696   179.93439
   73    64 S   C    _C6_    57     1.43756   128.59133   179.95154
   74    73 S   O    _O33    58     1.22499   123.87574     0.34264
  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   7   5   4   3
  10   5   4   2   1   1  12   6  14   7  11   7   8  11   5   3
   1   7   3   2   9   2   5   6   3   4   3   2   6   1   1   7
   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    54  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    46    54    45  
   35    39    40    41    54  
   39    40    41    54  
   37    38  
   38  
    0  
   40    41    42    43    44    46    47    53    54    48    45    50  
   41    42    43    46    54    45  
   42    43    44    46    47    53    54    48    49    45    50    51    52    55  
   43    44    46    54    48    45    50  
   44    46    47    53    56    65    54    48    49    45    50  
   46    47    53    54    48    49    45  
   50    51    52    55    58    46    48    54  
   47    53    56    57    61    64    65    66    54    48    49  
   53    56    65    54    48  
   49    53    54  
    0  
   51    52    55    58    59    60    62  
   52    55    58  
   55    58  
   56    57    61    64    65    66    67    73    54  
   56    65  
   58    59    60    62    63  
   57    61    64    65    66    73  
   61    64    65  
   59    60    62    63  
   60    62    63  
   62    63  
   64    65    66    68    73    74  
   63  
    0  
   65    66    67    68    69    73    74  
   66    67    68    73    74    70  
   67    68    69    73    70    71    72  
   68    69    73    74    70    71    72  
   69    73    74    70    71    72  
   73    74    70  
   71    72    73  
   72  
    0  
   74  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.8500   0.1400  -0.610000   1.7660   1.5600   0.020110767  -0.896042159
   46   3.5000   0.0660   0.450000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.7400   0.2000   1.361100   2.1070   1.8700   0.005000000   0.000000000
   51   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   52   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   53   3.2500   0.1700  -0.500000   1.8000   1.6000   0.001000000  -0.511443539
   54   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   55   2.8500   0.1400  -0.022200   1.5900   1.4000   0.020110767  -0.896042159
   56   3.5000   0.0800   0.200000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   58   3.7400   0.2000   1.263600   2.1070   1.8700   0.005000000   0.000000000
   59   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   60   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   61   3.2500   0.1700  -0.490000   1.8000   1.6000   0.001000000  -0.511443539
   62   2.8500   0.1400  -0.692500   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.5000   0.0800   0.120000   2.5000   1.7750   0.001000000  -0.843144165
   65   3.5000   0.0800   0.340000   2.5000   1.7750   0.001000000  -0.843144165
   66   3.2500   0.1700  -0.510000   1.9250   1.7000   0.054801302  -2.445846770
   67   3.5000   0.0800   0.460000   2.1120   1.8750   0.001000000  -0.126889456
   68   3.2500   0.1700  -0.560000   2.1120   1.8750   0.051222218  -2.220205820
   69   0.0000   0.0000   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   70   3.2500   0.1700  -0.800000   2.1120   1.8750   0.051222218  -2.220205820
   71   0.5000   0.0300   0.400000   0.9960   0.8600   0.030040813  -0.651083722
   72   0.5000   0.0300   0.400000   0.9960   0.8600   0.030040813  -0.651083722
   73   3.7500   0.1050   0.520000   1.9250   1.7000   0.001000000  -0.126889456
   74   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    54   320.000  1.410
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    45   320.000  1.410
   43    44   340.000  1.090
   43    46   250.000  1.527
   43    48   320.000  1.410
   46    47   340.000  1.090
   46    53   275.000  1.479
   46    54   320.000  1.380
   53    56   440.000  1.371
   53    65   436.000  1.374
   56    57   367.000  1.080
   56    61   529.000  1.304
   61    64   414.000  1.391
   64    65   520.000  1.370
   64    73   447.000  1.419
   65    66   461.000  1.354
   66    67   585.000  1.311
   67    68   427.000  1.381
   67    70   481.000  1.340
   68    69   434.000  1.010
   68    73   418.000  1.388
   73    74   570.000  1.229
   70    71   434.000  1.010
   70    72   434.000  1.010
   48    49   553.000  0.945
   45    50   230.000  1.697
   50    51   525.000  1.480
   50    52   525.000  1.480
   50    55   230.000  1.697
   55    58   230.000  1.697
   58    59   525.000  1.480
   58    60   525.000  1.480
   58    62   230.000  1.697
   62    63   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    54    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    58.35000  112.70000
   39    41    45    50.00000  109.50000
   39    54    46    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    46    75.00000  109.43000
   41    43    48    50.00000  109.50000
   41    45    50   100.00000  120.50000
   43    41    42    37.50000  110.70000
   43    46    47    45.00000  112.01100
   43    46    53    75.00000  107.44000
   43    46    54    90.00000  108.56700
   43    48    49    55.00000  108.50000
   46    43    44    45.00000  108.72000
   46    53    56    70.00000  128.80000
   46    53    65    70.00000  125.80000
   53    46    47    55.00000  103.44000
   53    56    57    35.00000  123.05000
   53    56    61    70.00000  113.90000
   53    65    64    70.00000  106.20000
   53    65    66    70.00000  126.20000
   56    61    64    70.00000  103.80000
   61    56    57    35.00000  123.05000
   61    64    65    70.00000  110.40000
   61    64    73    70.00000  130.00000
   64    65    66    70.00000  127.70000
   64    73    68    70.00000  111.30000
   64    73    74    80.00000  128.80000
   65    53    56    70.00000  105.40000
   65    66    67    70.00000  112.20000
   66    67    68    70.00000  123.30000
   66    67    70    70.00000  119.30000
   67    68    69    35.00000  118.00000
   67    68    73    70.00000  125.20000
   67    70    71    35.00000  120.00000
   67    70    72    35.00000  120.00000
   68    73    74    80.00000  120.60000
   73    64    65    85.00000  119.20000
   73    68    69    35.00000  116.80000
   70    67    68    70.00000  116.00000
   72    70    71    35.00000  120.00000
   54    39    40    35.00000  109.50000
   54    39    41    50.00000  109.50000
   54    46    47    35.00000  109.50000
   54    46    53   105.00000  106.22000
   48    43    44    35.00000  109.50000
   48    43    46    90.00000  111.58700
   45    41    42    35.00000  109.50000
   45    41    43    50.00000  109.50000
   45    50    51   100.00000  108.23000
   45    50    52   100.00000  108.23000
   45    50    55    45.00000  102.60000
   50    55    58    50.00000  132.62000
   52    50    51   140.00000  119.90000
   55    50    51   100.00000  108.23000
   55    50    52   100.00000  108.23000
   55    58    59   100.00000  108.23000
   55    58    60   100.00000  108.23000
   55    58    62    45.00000  102.60000
   58    62    63    45.00000  108.50000
   60    58    59   140.00000  119.90000
   62    58    59   100.00000  108.23000
   62    58    60   100.00000  108.23000
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    54   0.56750  1.0 1.0
   29    33    39    54  -0.07550 -1.0 2.0
   29    33    39    54   0.20000  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    43   0.56750  1.0 1.0
   33    39    41    43  -0.07550 -1.0 2.0
   33    39    41    43   0.20000  1.0 3.0
   33    39    41    45   0.62750  1.0 1.0
   33    39    41    45  -0.30950 -1.0 2.0
   33    39    41    45   0.27300  1.0 3.0
   33    39    54    46   0.06250  1.0 1.0
   33    39    54    46  -0.01100 -1.0 2.0
   33    39    54    46   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    54   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    54   0.23400  1.0 3.0
   39    41    43    44   0.15000  1.0 3.0
   39    41   -43    46   3.97050  1.0 1.0
   39    41    43    48   0.86500  1.0 1.0
   39    41    43    48  -0.17500 -1.0 2.0
   39    41    43    48   0.20800  1.0 3.0
   39    41    45    50  -2.65550  1.0 1.0
   39    41    45    50  -0.22350 -1.0 2.0
   39    41    45    50   0.24150  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    43   0.15000  1.0 3.0
   40    39    41    45   0.23400  1.0 3.0
   40    39    54    46   0.37050  1.0 3.0
   41    39   -54    46   0.06250  1.0 1.0
   41    39   -54    46  -0.01100 -1.0 2.0
   41    39   -54    46   0.28050  1.0 3.0
   41    43    46    47   0.15000  1.0 3.0
   41    43    46    53  -0.64600  1.0 1.0
   41    43    46    53   0.58400 -1.0 2.0
   41    43   -46    54   0.62750  1.0 1.0
   41    43   -46    54  -0.30950 -1.0 2.0
   41    43   -46    54   0.27300  1.0 3.0
   41    43    48    49  -0.11600  1.0 1.0
   41    43    48    49  -0.09450 -1.0 2.0
   41    43    48    49   0.21250  1.0 3.0
   41    45    50    51   0.00000  1.0 1.0
   41    45    50    52   0.00000  1.0 1.0
   41    45    50    55   0.05050  1.0 1.0
   41    45    50    55  -1.30700 -1.0 2.0
   41    45    50    55   0.91550  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    46   0.15000  1.0 3.0
   42    41    43    48   0.23400  1.0 3.0
   42    41    45    50   0.03000  1.0 3.0
   43    41    45    50  -2.65550  1.0 1.0
   43    41    45    50  -0.22350 -1.0 2.0
   43    41    45    50   0.24150  1.0 3.0
   43    46    53    56   1.10250  1.0 1.0
   43    46    53    56   0.01650 -1.0 2.0
   43    46    53    56   0.39100  1.0 3.0
   43    46    53    65   1.10250  1.0 1.0
   43    46    53    65   0.01650 -1.0 2.0
   43    46    53    65   0.39100  1.0 3.0
   43    46   -54    39   0.06250  1.0 1.0
   43    46   -54    39  -0.01100 -1.0 2.0
   43    46   -54    39   0.28050  1.0 3.0
   44    43    46    47   0.15000  1.0 3.0
   44    43    46    53   0.15000  1.0 3.0
   44    43    46    54   0.23400  1.0 3.0
   44    43    48    49   0.19450  1.0 3.0
   46    43    48    49  -0.11600  1.0 1.0
   46    43    48    49  -0.09450 -1.0 2.0
   46    43    48    49   0.21250  1.0 3.0
   46    53    56    57   3.62500 -1.0 2.0
   46    53    56    61   3.62500 -1.0 2.0
   46    53    65    64   0.81400  1.0 1.0
   46    53    65    64   1.55550 -1.0 2.0
   46    53    65    66   3.62500 -1.0 2.0
   47    46    53    56   0.00000  1.0 1.0
   47    46    53    65   0.00000  1.0 1.0
   47    46    54    39   0.37050  1.0 3.0
   53    46    54    39  -2.37750  1.0 1.0
   53    46    54    39  -0.08150 -1.0 2.0
   53    46    54    39   0.59000  1.0 3.0
   53    56   -61    64   3.62500 -1.0 2.0
   53    65    66    67   1.25000 -1.0 2.0
   56    53   -65    64   0.70250  1.0 1.0
   56    53   -65    64   1.56150 -1.0 2.0
   56    53    65    66   3.62500 -1.0 2.0
   56    61   -64    65   3.62500 -1.0 2.0
   56    61    64    73   3.62500 -1.0 2.0
   57    56    61    64   3.62500 -1.0 2.0
   61    64   -65    53   3.62500 -1.0 2.0
   61    64    65    66   3.62500 -1.0 2.0
   61    64    73    68   5.37500 -1.0 2.0
   61    64    73    74   0.41000 -1.0 2.0
   64    65    66    67   3.62500 -1.0 2.0
   65    53    56    57   3.62500 -1.0 2.0
   65    53   -56    61   3.62500 -1.0 2.0
   65    64    73    68   1.50000 -1.0 2.0
   65    64    73    74   1.05000 -1.0 2.0
   65    66   -67    68   3.62500 -1.0 2.0
   65    66    67    70   3.62500 -1.0 2.0
   66    67    68    69   3.62500 -1.0 2.0
   66    67    68    73   3.62500 -1.0 2.0
   66    67    70    71   0.70000 -1.0 2.0
   66    67    70    72   0.70000 -1.0 2.0
   67    68   -73    64   1.52500 -1.0 2.0
   67    68    73    74   3.04450 -1.0 2.0
   68    67    70    71   1.01500 -1.0 2.0
   68    67    70    72   1.01500 -1.0 2.0
   69    68    73    64   1.52500 -1.0 2.0
   69    68    73    74   2.45000 -1.0 2.0
   73    64    65    53   3.62500 -1.0 2.0
   73    64   -65    66   3.62500 -1.0 2.0
   70    67    68    69   3.62500 -1.0 2.0
   70    67    68    73   3.62500 -1.0 2.0
   54    39    41    42   0.23400  1.0 3.0
   54    39   -41    43   0.62750  1.0 1.0
   54    39   -41    43  -0.30950 -1.0 2.0
   54    39   -41    43   0.27300  1.0 3.0
   54    39    41    45   1.11900  1.0 1.0
   54    39    41    45  -1.16350 -1.0 2.0
   54    39    41    45  -0.34150  1.0 3.0
   54    46    53    56   0.10350  1.0 1.0
   54    46    53    56  -0.15350 -1.0 2.0
   54    46    53    65   0.10350  1.0 1.0
   54    46    53    65  -0.15350 -1.0 2.0
   48    43    46    47   0.23400  1.0 3.0
   48    43    46    53   2.76900  1.0 1.0
   48    43    46    53  -0.24350 -1.0 2.0
   48    43    46    53  -0.78250  1.0 3.0
   48    43    46    54   3.69350  1.0 1.0
   48    43    46    54  -1.82950 -1.0 2.0
   45    41    43    44   0.23400  1.0 3.0
   45    41    43    46   0.62750  1.0 1.0
   45    41    43    46  -0.30950 -1.0 2.0
   45    41    43    46   0.27300  1.0 3.0
   45    41    43    48   3.69350  1.0 1.0
   45    41    43    48  -1.82950 -1.0 2.0
   45    50    55    58   0.15000  1.0 3.0
   50    55    58    59   0.50000  1.0 3.0
   50    55    58    60   0.50000  1.0 3.0
   50    55    58    62   0.15000  1.0 3.0
   51    50    55    58   0.50000  1.0 3.0
   52    50    55    58   0.50000  1.0 3.0
   55    58    62    63   0.00000  1.0 1.0
   59    58    62    63   0.00000  1.0 1.0
   60    58    62    63   0.00000  1.0 1.0
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
   37    30    36    38  10.50000 -1.0 2.0
   56    65    53    46   4.00000 -1.0 2.0
   61    57    56    53   1.10000 -1.0 2.0
   65    73    64    61   4.00000 -1.0 2.0
   64    66    65    53   4.00000 -1.0 2.0
   68    70    67    66  10.50000 -1.0 2.0
   69    67    68    73   1.00000 -1.0 2.0
   64    68    73    74  10.50000 -1.0 2.0
   72    67    70    71   1.00000 -1.0 2.0
END
