* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    128    205     369
    1     0 S   NP   _N1_     1    32.10060   100.51453   -20.54814
    2     1 S   H    _HN1     2     1.02858    66.60753  -113.45603
    3     1 S   H    _H1_     3     1.02734    75.64015   130.09451
    4     1 S   H    _H2_     4     1.03472   174.38493  -103.36307
    5     1 S   CT   _CA1     5     1.50176    70.09902    11.00281
    6     5 S   HC   _HA1     6     1.09536   104.96866   122.15507
    7     5 S   CO3  _C1_     7     1.53766   113.26092     1.45441
    8     7 S   O2Z  _O11     8     1.26441   115.05404   -28.64912
    9     7 S   O2Z  _O12     9     1.26230   115.19345   150.86509
   10     5 S   CT   _CB1    10     1.52997   107.35467  -119.30569
   11    10 S   HC   HB11    11     1.09555   109.35411   -39.50052
   12    10 S   HC   HB12    12     1.09836   110.42408    76.04532
   13    10 S   CT   _CG1    13     1.53283   113.05519  -162.08482
   14    13 S   HC   HG11    14     1.09539   110.86838   -94.88359
   15    13 S   HC   HG12    15     1.09625   111.67858    24.57083
   16    13 S   C    _CD1    16     1.51492   109.52687   144.76025
   17    16 S   O    _OE1    17     1.22765   122.20412    96.21417
   18    16 S   N    _N2_    18     1.38445   112.22123   -80.88053
   19    18 S   H    _HN2    19     1.01932   118.89784    -5.15305
   20    18 S   CT1  _CA2    20     1.45918   123.35922   172.63369
   21    20 S   HC   _HA2    21     1.09669   108.76915    30.56939
   22    20 S   C    _C2_    22     1.53248   108.73037   -86.27983
   23    22 S   O    _O2_    23     1.23107   121.12422   152.45749
   24    20 S   CT   _CB2    32     1.53148   111.66010   154.06625
   25    24 S   HC   HB21    33     1.09643   110.00753    59.87099
   26    24 S   HC   HB22    34     1.09580   110.40452   177.53145
   27    22 S   N    _N3_    24     1.38379   114.37442   -35.13226
   28    27 S   H    _HN3    25     1.01576   119.32248     2.74723
   29    24 S   S    _SG2    35     1.82658   111.41228   -62.44884
   30    27 S   CT   _CA3    26     1.45275   123.35130  -177.54553
   31    30 S   HC   HA31    27     1.09558   108.18440   -46.07247
   32    30 S   HC   HA32    28     1.09546   107.25233    70.30601
   33    29 S   CM   _C16    36     1.75805    99.22564   146.08174
   34    30 S   CO3  _C3_    29     1.53057   114.37131  -168.26565
   35    34 S   O2Z  _O31    30     1.26436   116.36191     1.92071
   36    34 S   O2Z  _O32    31     1.26427   114.40017  -178.30823
   37    33 S   CM   _C15    37     1.35475   121.55316   -90.72770
   38    37 S   N4   _N5_    38     1.35979   120.80457  -178.79196
   39    37 S   CO3  _C18    69     1.54556   121.05368     3.86037
   40    39 S   O2Z  _O36    70     1.26571   115.15697    82.53807
   41    39 S   O2Z  _O35    71     1.26419   114.83448   -97.95167
   42    38 S   C4   _C14    39     1.34886   137.47792  -165.66296
   43    42 S   O    _O34    40     1.20855   133.84917    -5.25673
   44    38 S   C4T  _C13    43     1.44951   124.96115    13.46910
   45    44 S   HC   _H5_    44     1.09709   112.47906    75.77782
   46    42 S   C4T  _C12    41     1.56153    89.73295   170.72163
   47    46 S   HC   _H4_    42     1.09641   112.21767   121.83773
   48    44 S   S    _S1_    45     1.81103   108.50902   -51.24423
   49    33 S   CT   _C17    46     1.52288   114.57300    87.86543
   50    49 S   HC   _H12    47     1.09537   110.75775   -36.82139
   51    49 S   HC   _H13    48     1.09578   109.61882    81.87029
   52    46 S   N    _N4_    49     1.47857   113.71251  -110.00591
   53    52 S   H    _H11    50     1.01710   119.23608    11.62141
   54    52 S   C    _C11    51     1.39021   122.39517  -171.50826
   55    54 S   O    _O33    52     1.22959   123.86350     2.32818
   56    54 S   CT1  _C10    53     1.53009   112.43608  -176.64526
   57    56 S   HC   _H3_    54     1.09744   108.16979   -38.24830
   58    56 S   CA   _C7_    55     1.51515   110.72073    82.22299
   59    56 S   NT   _N6_    66     1.46660   108.81680  -154.28252
   60    59 S   H    _H14    67     1.01928   109.39243   174.97001
   61    59 S   H    _H15    68     1.01932   109.54358    58.90731
   62    58 S   CA   _C6_    56     1.40299   119.99049  -114.00403
   63    62 S   HA   _H8_    57     1.08728   120.51090    -1.00054
   64    62 S   CA   _C5_    58     1.39619   120.60316   178.74789
   65    64 S   HA   _H7_    59     1.08632   119.92926  -179.93147
   66    64 S   CA   _C4_    60     1.39319   120.11663    -0.07402
   67    66 S   HA   _H6_    61     1.08611   120.04342  -179.90935
   68    66 S   CA   _C9_    62     1.39299   119.92136    -0.01978
   69    68 S   HA   _H10    63     1.08623   120.01348  -179.83929
   70    58 S   CA   _C8_    64     1.40432   121.34425    64.56613
   71    70 S   HA   _H9_    65     1.08764   120.37819     0.95654
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   8   5   4   3
  11   2   1   1  13  12   5   1   1   9   4  10   5   8   4   4
   2   1   1   7   3   9   4  11   6  12   4   1   1   8   4   6
   3   5   3   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    48    49    50    51    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    44    48    49    50    51    39    40    41  
   35    36  
   36  
    0  
   38    42    43    46    44    45    48    49    50    51    39    40    41  
   42    43    46    47    44    45    48    49    52    39    40    41  
   40    41    42    44    49  
   41  
    0  
   43    46    47    44    45    48    52    53    54  
   46    47    44    52  
   45    48    49    50    51    52    53    54    46    47  
   48    49    52    46    47  
   47    48    49    52    53    54    55    56  
   48    52    53    54  
   49    50    51    52  
   50    51  
   51  
    0  
   53    54    55    56    57    58    59  
   54    55    56  
   55    56    57    58    62    70    59    60    61  
   56    57    58    59  
   57    58    62    63    64    68    70    71    59    60    61  
   58    62    70    59    60    61  
   62    63    64    65    66    68    69    70    71    59    60    61  
   60    61    62    70  
   61  
    0  
   63    64    65    66    67    68    70    71  
   64    65    66    70  
   65    66    67    68    69    70  
   66    67    68  
   67    68    69    70    71  
   68    69    70  
   69    70    71  
   70    71  
   71  
    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  -0.175000   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   3.5500   0.0760   0.007500   2.0020   1.7750   0.023028004  -0.852763146
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.259000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.2500   0.1700  -0.296300   1.8100   1.6000   0.054801302  -1.445846770
   39   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   42   3.7500   0.1050   0.629000   1.9250   1.7000   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   44   3.5000   0.0660   0.219000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   3.6000   0.3550  -0.324000   2.0300   1.8000   0.025682759  -1.666211680
   49   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.2500   0.1700  -0.500000   2.1120   1.8750   0.051222218  -2.220205820
   53   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   54   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   56   3.5000   0.0660   0.278900   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
   60   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   61   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   70   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   240.000  1.763
   33    37   549.000  1.340
   33    49   317.000  1.510
   37    38   400.000  1.384
   37    39   230.000  1.545
   38    42   440.000  1.369
   38    44   305.000  1.456
   42    43   930.000  1.212
   42    46   250.000  1.540
   46    47   340.000  1.090
   46    44   268.000  1.529
   46    52   337.000  1.449
   44    45   340.000  1.090
   44    48   200.000  1.824
   48    49   222.000  1.810
   49    50   340.000  1.090
   49    51   340.000  1.090
   52    53   434.000  1.010
   52    54   490.000  1.335
   54    55   570.000  1.229
   54    56   317.000  1.522
   56    57   340.000  1.090
   56    58   275.000  1.474
   56    59   305.000  1.457
   58    62   469.000  1.400
   58    70   469.000  1.400
   62    63   367.000  1.080
   62    64   469.000  1.400
   64    65   367.000  1.080
   64    66   469.000  1.400
   66    67   367.000  1.080
   66    68   469.000  1.400
   68    69   367.000  1.080
   68    70   469.000  1.400
   70    71   367.000  1.080
   59    60   434.000  1.010
   59    61   434.000  1.010
   39    40   656.000  1.250
   39    41   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    65.00000  122.11800
   29    33    49    65.00000  117.37300
   33    37    38    75.00000  120.83300
   33    37    39    55.00000  124.75400
   33    49    48    75.00000  112.20000
   33    49    50    35.00000  109.50000
   33    49    51    35.00000  109.50000
   37    38    42    50.00000  132.10000
   37    38    44    50.00000  132.70000
   37    39    40    85.00000  113.83300
   37    39    41    85.00000  113.83300
   38    42    43    75.00000  131.60000
   38    42    46    95.00000   92.72400
   38    44    46   105.00000   87.49700
   38    44    45    50.00000  112.01000
   38    44    48    80.00000  108.62000
   42    46    47    40.00000  113.37500
   42    46    44   100.00000   86.36000
   42    46    52    75.00000  110.24000
   46    42    43    60.00000  136.58000
   46    44    45    37.50000  110.70000
   46    44    48    65.00000  119.05700
   46    52    53    38.00000  118.40000
   46    52    54    50.00000  121.90000
   44    38    42   100.00000   93.00000
   44    46    47    37.50000  110.70000
   44    48    49    85.00000   99.86700
   48    44    45    45.00000  109.41400
   48    49    50    35.00000  109.50000
   48    49    51    35.00000  109.50000
   49    33    37    70.00000  124.00000
   51    49    50    33.00000  107.80000
   52    46    47    50.00000  112.01000
   52    46    44    80.00000  110.05700
   52    54    55    80.00000  122.90000
   52    54    56    70.00000  116.60000
   54    52    53    35.00000  119.80000
   54    56    57    35.00000  109.50000
   54    56    58    70.00000  102.60000
   54    56    59    75.00000  111.54000
   56    54    55    80.00000  120.40000
   56    58    62    60.00000  125.54000
   56    58    70    60.00000  125.54000
   56    59    60    50.00000  111.55300
   56    59    61    50.00000  111.55300
   58    56    57    45.00000  110.88000
   58    62    63    35.00000  120.00000
   58    62    64    63.00000  120.00000
   58    70    68    63.00000  120.00000
   58    70    71    35.00000  120.00000
   62    64    65    35.00000  120.00000
   62    64    66    63.00000  120.00000
   64    62    63    35.00000  120.00000
   64    66    67    35.00000  120.00000
   64    66    68    63.00000  120.00000
   66    64    65    35.00000  120.00000
   66    68    69    35.00000  120.00000
   66    68    70    63.00000  120.00000
   68    66    67    35.00000  120.00000
   68    70    71    35.00000  120.00000
   70    58    62    63.00000  120.00000
   70    68    69    35.00000  120.00000
   59    56    57    50.00000  109.55000
   59    56    58    75.00000  112.33000
   61    59    60    43.60000  106.40000
   39    37    38    80.00000  114.48000
   41    39    40    80.00000  126.00000
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   0.00000  1.0 1.0
   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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37   1.00000 -1.0 2.0
   24    29    33    49   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   7.00000 -1.0 2.0
   29    33    37    39   7.00000 -1.0 2.0
   29    33    49    48   0.09700  1.0 1.0
   29    33    49    48   0.15600 -1.0 2.0
   29    33    49    48  -0.50800  1.0 3.0
   29    33    49    50   0.00000  1.0 1.0
   29    33    49    51   0.00000  1.0 1.0
   33    37    38    42   0.00000  1.0 1.0
   33    37    38    44   0.00000  1.0 1.0
   33    37    39    40  -0.04000 -1.0 2.0
   33    37    39    40  -0.29050  1.0 3.0
   33    37    39    41  -0.04000 -1.0 2.0
   33    37    39    41  -0.29050  1.0 3.0
   37    33    49    48   0.42700  1.0 1.0
   37    33    49    48  -0.70350 -1.0 2.0
   37    33    49    48  -0.43150  1.0 3.0
   37    33    49    50   0.00000  1.0 1.0
   37    33    49    51   0.00000  1.0 1.0
   37    38    42    43   3.00000 -1.0 2.0
   37    38    42    46   3.00000 -1.0 2.0
   37    38   -44    46   0.00000  1.0 1.0
   37    38    44    45   0.00000  1.0 1.0
   37    38   -44    48   0.00000  1.0 1.0
   38    37    39    40   1.91650 -1.0 2.0
   38    37    39    41   1.91650 -1.0 2.0
   38    42    46    47   0.00000  1.0 1.0
   38    42   -46    44   3.00000 -1.0 2.0
   38    42    46    52   0.00000  1.0 1.0
   38    44    48    49   0.01700  1.0 1.0
   38    44    48    49  -0.23550 -1.0 2.0
   38    44    48    49   0.21350  1.0 3.0
   42    38   -44    46   0.00000  1.0 1.0
   42    38    44    45   0.00000  1.0 1.0
   42    38    44    48   0.00000  1.0 1.0
   42    46   -44    38   3.00000 -1.0 2.0
   42    46   -44    45   0.15000  1.0 3.0
   42    46   -44    48   0.00000  1.0 1.0
   42    46    52    53   0.00000  1.0 1.0
   42    46    52    54  -0.42300  1.0 1.0
   42    46    52    54  -0.07000 -1.0 2.0
   42    46    52    54   0.04150  1.0 3.0
   43    42    46    47   0.00000  1.0 1.0
   43    42    46    44  -0.11250  1.0 1.0
   43    42    46    44   0.11400 -1.0 2.0
   43    42    46    44  -0.28950  1.0 3.0
   43    42    46    52   0.30150 -1.0 2.0
   46    44    48    49   0.25150  1.0 1.0
   46    44    48    49  -1.17200 -1.0 2.0
   46    44    48    49   0.53050  1.0 3.0
   46    52    54    55   3.04450 -1.0 2.0
   46    52    54    56   1.15000  1.0 1.0
   46    52    54    56   3.04450 -1.0 2.0
   47    46   -44    38   0.15000  1.0 3.0
   47    46    44    45   0.15000  1.0 3.0
   47    46    44    48   0.00000  1.0 1.0
   47    46    52    53   0.00000  1.0 1.0
   47    46    52    54   0.00000  1.0 1.0
   44    38   -42    43   3.00000 -1.0 2.0
   44    38   -42    46   3.00000 -1.0 2.0
   44    46    52    53   0.00000  1.0 1.0
   44    46    52    54  -0.43950  1.0 1.0
   44    46    52    54  -0.08100 -1.0 2.0
   44    46    52    54   0.03350  1.0 3.0
   44    48   -49    33  -0.70200  1.0 1.0
   44    48   -49    33  -0.14350 -1.0 2.0
   44    48   -49    33   0.55200  1.0 3.0
   44    48    49    50   0.32350  1.0 3.0
   44    48    49    51   0.32350  1.0 3.0
   45    44    48    49   0.00000  1.0 1.0
   49    33   -37    38   7.00000 -1.0 2.0
   49    33    37    39   7.00000 -1.0 2.0
   52    46   -44    38   2.20050  1.0 1.0
   52    46   -44    38   0.63450 -1.0 2.0
   52    46   -44    38  -0.91300  1.0 3.0
   52    46    44    45   0.15000  1.0 3.0
   52    46    44    48   0.00000  1.0 1.0
   52    54    56    57   0.00000  1.0 1.0
   52    54    56    58   0.00000  1.0 1.0
   52    54    56    59   0.00000  1.0 1.0
   53    52    54    55   2.45000 -1.0 2.0
   53    52    54    56   2.45000 -1.0 2.0
   54    56    58    62   0.04300 -1.0 2.0
   54    56    58    70   0.04300 -1.0 2.0
   54    56    59    60   0.21900  1.0 1.0
   54    56    59    60  -0.24900 -1.0 2.0
   54    56    59    60   0.15200  1.0 3.0
   54    56    59    61   0.21900  1.0 1.0
   54    56    59    61  -0.24900 -1.0 2.0
   54    56    59    61   0.15200  1.0 3.0
   55    54    56    57   0.00000  1.0 1.0
   55    54    56    58   0.30150 -1.0 2.0
   55    54    56    59   0.30150 -1.0 2.0
   56    58    62    63   3.62500 -1.0 2.0
   56    58    62    64   3.62500 -1.0 2.0
   56    58    70    68   3.62500 -1.0 2.0
   56    58    70    71   3.62500 -1.0 2.0
   57    56    58    62   0.00000  1.0 1.0
   57    56    58    70   0.00000  1.0 1.0
   57    56    59    60   0.20000  1.0 3.0
   57    56    59    61   0.20000  1.0 3.0
   58    56    59    60   0.76500  1.0 1.0
   58    56    59    60   0.05700 -1.0 2.0
   58    56    59    60  -0.90900  1.0 3.0
   58    56    59    61   0.76500  1.0 1.0
   58    56    59    61   0.05700 -1.0 2.0
   58    56    59    61  -0.90900  1.0 3.0
   58    62    64    65   3.62500 -1.0 2.0
   58    62    64    66   3.62500 -1.0 2.0
   62    58    70    68   3.62500 -1.0 2.0
   62    58    70    71   3.62500 -1.0 2.0
   62    64    66    67   3.62500 -1.0 2.0
   62    64   -66    68   3.62500 -1.0 2.0
   63    62    64    65   3.62500 -1.0 2.0
   63    62    64    66   3.62500 -1.0 2.0
   64    66    68    69   3.62500 -1.0 2.0
   64    66    68    70   3.62500 -1.0 2.0
   65    64    66    67   3.62500 -1.0 2.0
   65    64    66    68   3.62500 -1.0 2.0
   66    68   -70    58   3.62500 -1.0 2.0
   66    68    70    71   3.62500 -1.0 2.0
   67    66    68    69   3.62500 -1.0 2.0
   67    66    68    70   3.62500 -1.0 2.0
   69    68    70    58   3.62500 -1.0 2.0
   69    68    70    71   3.62500 -1.0 2.0
   70    58    62    63   3.62500 -1.0 2.0
   70    58   -62    64   3.62500 -1.0 2.0
   59    56    58    62   0.18550 -1.0 2.0
   59    56    58    62   0.14000  1.0 3.0
   59    56    58    70   0.18550 -1.0 2.0
   59    56    58    70   0.14000  1.0 3.0
   39    37    38    42   0.00000  1.0 1.0
   39    37    38    44   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
   35    30    34    36  10.50000 -1.0 2.0
   29    49    33    37   1.10000 -1.0 2.0
   39    38    37    33   1.10000 -1.0 2.0
   44    42    38    37   1.00000 -1.0 2.0
   38    46    42    43  10.50000 -1.0 2.0
   53    54    52    46   1.00000 -1.0 2.0
   52    56    54    55  10.50000 -1.0 2.0
   62    70    58    56   4.00000 -1.0 2.0
   64    63    62    58   1.10000 -1.0 2.0
   66    65    64    62   1.10000 -1.0 2.0
   68    67    66    64   1.10000 -1.0 2.0
   70    69    68    66   1.10000 -1.0 2.0
   68    71    70    58   1.10000 -1.0 2.0
   40    37    39    41  10.50000 -1.0 2.0
END
