* LIGAND DATABASE FILE (OPLS2005)
*
001      70    71    123    186     356
    1     0 S   NP   _N1_     1    28.12210    95.34389   -25.97942
    2     1 S   H    _HN1     2     1.02957    82.39569    -1.68389
    3     1 S   H    _H1_     3     1.02836    24.68806  -178.84445
    4     1 S   H    _H2_     4     1.02777   118.29850  -108.46591
    5     1 S   CT   _CA1     5     1.50157   120.10767   107.50507
    6     5 S   HC   _HA1     6     1.09576   105.18707    84.57876
    7     5 S   CO3  _C1_     7     1.53764   112.31919   -35.57821
    8     7 S   O2Z  _O11     8     1.26372   114.98035   -43.92521
    9     7 S   O2Z  _O12     9     1.26225   114.92406   135.01092
   10     5 S   CT   _CB1    10     1.53080   107.40455  -157.52382
   11    10 S   HC   HB11    11     1.09833   109.28765   -50.08893
   12    10 S   HC   HB12    12     1.09815   110.44474    66.44334
   13    10 S   CT   _CG1    13     1.53053   112.73309  -171.12135
   14    13 S   HC   HG11    14     1.09586   110.57008   -65.70784
   15    13 S   HC   HG12    15     1.09659   109.85853    53.53137
   16    13 S   C    _CD1    16     1.51860   112.16506   173.88718
   17    16 S   O    _OE1    17     1.22778   123.22751     4.40584
   18    16 S   N    _N2_    18     1.38579   111.86590  -175.62709
   19    18 S   H    _HN2    19     1.01570   119.12912     3.49788
   20    18 S   CT1  _CA2    20     1.45795   122.67424   177.34982
   21    20 S   HC   _HA2    21     1.09742   108.80881    27.00178
   22    20 S   C    _C2_    22     1.52996   107.19154   -89.95178
   23    22 S   O    _O2_    23     1.22968   123.12254   -25.47206
   24    20 S   CT   _CB2    32     1.53168   112.44983   150.18847
   25    24 S   HC   HB21    33     1.09597   110.37631    54.46004
   26    24 S   HC   HB22    34     1.09440   109.79679   173.33244
   27    22 S   N    _N3_    24     1.38523   112.49571   157.25354
   28    27 S   H    _HN3    25     1.01657   120.32980    -2.37413
   29    24 S   S    _SG2    35     1.82521   111.34082   -66.32250
   30    27 S   CT   _CA3    26     1.45349   122.54035   178.43865
   31    30 S   HC   HA31    27     1.09568   107.89764   -53.81126
   32    30 S   HC   HA32    28     1.09560   107.53893    62.54575
   33    29 S   CT   _C10    36     1.85495    99.41821   179.91607
   34    33 S   HC   _H3_    37     1.09654   106.33933   -44.77995
   35    30 S   CO3  _C3_    29     1.52902   114.28977  -175.76293
   36    35 S   O2Z  _O31    30     1.26341   116.05832     0.17471
   37    35 S   O2Z  _O32    31     1.26436   114.41118  -179.87489
   38    33 S   CA   _C9_    38     1.52148   109.62112    73.51518
   39    33 S   CT   _C11    51     1.55053   109.80512  -163.03153
   40    39 S   HC   _H4_    52     1.10061   108.27742   -56.20901
   41    38 S   CA   _C8_    39     1.39319   119.89943  -115.12696
   42    41 S   HA   _H10    40     1.08514   121.38663     0.32385
   43    39 S   CA   _C12    53     1.52705   112.96693  -175.88715
   44    39 S   CO3  _C19    68     1.54843   114.76598    63.04355
   45    44 S   O2Z  _O35    69     1.26381   116.23071    30.53450
   46    44 S   O2Z  _O34    70     1.26582   114.62705  -149.60097
   47    41 S   CA   _C7_    41     1.38987   118.64516  -179.59410
   48    47 S   HA   _H9_    42     1.08593   120.12184  -179.97202
   49    43 S   CA   _C13    54     1.40130   119.71484   122.09146
   50    49 S   HA   _H11    55     1.08731   120.40946     0.49496
   51    47 S   CA   _C6_    43     1.38936   119.73610     0.07133
   52    51 S   HA   _H8_    44     1.08503   120.31087   179.96044
   53    49 S   CA   _C14    56     1.39666   120.62787  -179.22091
   54    53 S   HA   _H12    57     1.08730   119.19545   179.84298
   55    51 S   CA   _C5_    45     1.38983   118.44588    -0.02798
   56    53 S   CA   _C15    58     1.39740   120.64646    -0.13417
   57    38 S   NB   _N4_    46     1.35851   117.80136    65.29854
   58    55 S   CT   _C4_    47     1.49783   120.04445   179.89913
   59    58 S   HC   _H5_    48     1.09442   110.24365    60.29153
   60    58 S   HC   _H6_    49     1.09483   110.86748   179.97202
   61    58 S   HC   _H7_    50     1.09444   110.22779   -60.35220
   62    56 S   CA   _C16    59     1.39541   119.15411    -0.08847
   63    62 S   HA   _H13    60     1.08536   121.95889  -179.82868
   64    56 S   OS   _O33    63     1.36949   114.96891   179.94405
   65    43 S   CA   _C17    61     1.40289   121.88516   -57.42416
   66    65 S   HA   _H14    62     1.08749   120.41217    -0.86139
   67    64 S   CT   _C18    64     1.42265   116.74454   179.91153
   68    67 S   HC   _H15    65     1.09429   107.75322  -180.00000
   69    67 S   HC   _H16    66     1.09503   111.13836    62.25086
   70    67 S   HC   _H17    67     1.09503   111.13990   -62.23988
  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   9   5   4   3
  15   7   2   1   1  12  13   6   7   4  12   4   1   1   6   3
   8   4   7   3   7   3   5   9   4   3   2   1   1   5   3   5
   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    57    39    40    43    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    47    55    57    39    40    43    49    65    44    45    46  
   38    41    57    39    40    43    44  
   36    37  
   37  
    0  
   41    42    47    48    51    55    57    58    39    40    43    44  
   40    43    49    50    53    62    65    66    44    45    46    41    57  
   43    49    65    44    45    46  
   42    47    48    51    52    55    57  
   47    48    51    57  
   49    50    53    54    56    62    63    65    66    44    45    46  
   45    46    49    65  
   46  
    0  
   48    51    52    55    57    58  
   51    52    55  
   50    53    54    56    62    65    66    64  
   53    54    56    65  
   52    55    57    58    59    60    61  
   55    57    58  
   54    56    62    63    65    64    67  
   56    62    64  
   57    58    59    60    61  
   62    63    65    66    64    67    68    69    70  
   58    59    60    61  
   59    60    61  
   60    61  
   61  
    0  
   63    65    66    64    67  
   65    66    64  
   67    68    69    70    65  
   66  
    0  
   68    69    70  
   69    70  
   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   0.222500   2.4950   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.3810   1.2100   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   3.5500   0.0700   0.370000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.045000   2.4950   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.5500   0.0700  -0.447000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.155000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   47   3.5500   0.0700   0.227000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.065000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5500   0.0700  -0.447000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.155000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0700   0.370000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.2500   0.1700  -0.678000   1.8650   1.6500   0.001000000  -0.511443539
   58   3.5000   0.0660  -0.065000   2.4950   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   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   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    57   483.000  1.339
   41    42   367.000  1.080
   41    47   469.000  1.400
   47    48   367.000  1.080
   47    51   469.000  1.400
   51    52   367.000  1.080
   51    55   469.000  1.400
   55    57   483.000  1.339
   55    58   317.000  1.510
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   39    40   340.000  1.090
   39    43   317.000  1.510
   39    44   317.000  1.522
   43    49   469.000  1.400
   43    65   469.000  1.400
   49    50   367.000  1.080
   49    53   469.000  1.400
   53    54   367.000  1.080
   53    56   469.000  1.400
   56    62   469.000  1.400
   56    64   450.000  1.364
   62    63   367.000  1.080
   62    65   469.000  1.400
   65    66   367.000  1.080
   64    67   320.000  1.410
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   44    45   656.000  1.250
   44    46   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    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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    57    75.00000  115.74700
   33    39    40    37.50000  110.70000
   33    39    43    70.00000  112.17500
   33    39    44    70.00000  109.69300
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    47    63.00000  120.00000
   38    57    55    70.00000  117.00000
   41    47    48    35.00000  120.00000
   41    47    51    63.00000  120.00000
   47    41    42    35.00000  120.00000
   47    51    52    35.00000  120.00000
   47    51    55    63.00000  120.00000
   51    47    48    35.00000  120.00000
   51    55    57    70.00000  124.00000
   51    55    58    70.00000  120.00000
   55    51    52    35.00000  120.00000
   55    58    59    35.00000  109.50000
   55    58    60    35.00000  109.50000
   55    58    61    35.00000  109.50000
   57    38    41    70.00000  124.00000
   58    55    57    75.00000  115.74700
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    49    70.00000  120.00000
   39    43    65    70.00000  120.00000
   39    44    45    70.00000  117.00000
   39    44    46    70.00000  117.00000
   43    39    40    35.00000  109.50000
   43    49    50    35.00000  120.00000
   43    49    53    63.00000  120.00000
   43    65    62    63.00000  120.00000
   43    65    66    35.00000  120.00000
   49    53    54    35.00000  120.00000
   49    53    56    63.00000  120.00000
   53    49    50    35.00000  120.00000
   53    56    62    63.00000  120.00000
   53    56    64    70.00000  120.00000
   56    53    54    35.00000  120.00000
   56    62    63    35.00000  120.00000
   56    62    65    63.00000  120.00000
   56    64    67    75.00000  111.00000
   62    65    66    35.00000  120.00000
   65    43    49    63.00000  120.00000
   65    62    63    35.00000  120.00000
   64    56    62    70.00000  120.00000
   64    67    68    35.00000  109.50000
   64    67    69    35.00000  109.50000
   64    67    70    35.00000  109.50000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    43    70.00000  106.62600
   46    44    45    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   0.01700  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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  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    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    57   0.04300 -1.0 2.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    47   3.62500 -1.0 2.0
   33    38    57    55   3.62500 -1.0 2.0
   33    39    43    49   0.04150 -1.0 2.0
   33    39    43    65   0.04150 -1.0 2.0
   33    39    44    45   0.41150 -1.0 2.0
   33    39    44    46   0.41150 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    57   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43   0.43200  1.0 3.0
   34    33    39    44  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43  -0.94300  1.0 1.0
   38    33    39    43   1.32550 -1.0 2.0
   38    33    39    43  -0.07100  1.0 3.0
   38    33    39    44  -2.95950  1.0 1.0
   38    33    39    44   0.02300  1.0 3.0
   38    41    47    48   3.62500 -1.0 2.0
   38    41    47    51   3.62500 -1.0 2.0
   41    38    57    55   3.62500 -1.0 2.0
   41    47    51    52   3.62500 -1.0 2.0
   41    47   -51    55   3.62500 -1.0 2.0
   42    41    47    48   3.62500 -1.0 2.0
   42    41    47    51   3.62500 -1.0 2.0
   47    51    55    57   3.62500 -1.0 2.0
   47    51    55    58   3.62500 -1.0 2.0
   48    47    51    52   3.62500 -1.0 2.0
   48    47    51    55   3.62500 -1.0 2.0
   51    55   -57    38   3.62500 -1.0 2.0
   51    55    58    59   0.00000  1.0 1.0
   51    55    58    60   0.00000  1.0 1.0
   51    55    58    61   0.00000  1.0 1.0
   52    51    55    57   3.62500 -1.0 2.0
   52    51    55    58   3.62500 -1.0 2.0
   57    38    41    42   3.62500 -1.0 2.0
   57    38   -41    47   3.62500 -1.0 2.0
   57    55    58    59   0.00000  1.0 1.0
   57    55    58    60   0.00000  1.0 1.0
   57    55    58    61   0.00000  1.0 1.0
   58    55    57    38   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    57   0.29300  1.0 1.0
   39    33    38    57  -1.19700 -1.0 2.0
   39    33    38    57   0.60900  1.0 3.0
   39    43    49    50   3.62500 -1.0 2.0
   39    43    49    53   3.62500 -1.0 2.0
   39    43    65    62   3.62500 -1.0 2.0
   39    43    65    66   3.62500 -1.0 2.0
   40    39    43    49   0.00000  1.0 1.0
   40    39    43    65   0.00000  1.0 1.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    46   0.00000  1.0 1.0
   43    39    44    45   0.30150 -1.0 2.0
   43    39    44    46   0.30150 -1.0 2.0
   43    49    53    54   3.62500 -1.0 2.0
   43    49    53    56   3.62500 -1.0 2.0
   49    43    65    62   3.62500 -1.0 2.0
   49    43    65    66   3.62500 -1.0 2.0
   49    53   -56    62   3.62500 -1.0 2.0
   49    53    56    64   3.62500 -1.0 2.0
   50    49    53    54   3.62500 -1.0 2.0
   50    49    53    56   3.62500 -1.0 2.0
   53    56    62    63   3.62500 -1.0 2.0
   53    56    62    65   3.62500 -1.0 2.0
   53    56    64    67   1.63200 -1.0 2.0
   54    53    56    62   3.62500 -1.0 2.0
   54    53    56    64   3.62500 -1.0 2.0
   56    62   -65    43   3.62500 -1.0 2.0
   56    62    65    66   3.62500 -1.0 2.0
   56    64    67    68   0.08050  1.0 3.0
   56    64    67    69   0.08050  1.0 3.0
   56    64    67    70   0.08050  1.0 3.0
   62    56    64    67   1.63200 -1.0 2.0
   63    62    65    43   3.62500 -1.0 2.0
   63    62    65    66   3.62500 -1.0 2.0
   65    43    49    50   3.62500 -1.0 2.0
   65    43   -49    53   3.62500 -1.0 2.0
   64    56    62    63   3.62500 -1.0 2.0
   64    56    62    65   3.62500 -1.0 2.0
   44    39    43    49   0.04300 -1.0 2.0
   44    39    43    65   0.04300 -1.0 2.0
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
   41    57    38    33   4.00000 -1.0 2.0
   47    42    41    38   1.10000 -1.0 2.0
   51    48    47    41   1.10000 -1.0 2.0
   55    52    51    47   1.10000 -1.0 2.0
   58    57    55    51   4.00000 -1.0 2.0
   49    65    43    39   4.00000 -1.0 2.0
   53    50    49    43   1.10000 -1.0 2.0
   56    54    53    49   1.10000 -1.0 2.0
   62    64    56    53   4.00000 -1.0 2.0
   65    63    62    56   1.10000 -1.0 2.0
   62    66    65    43   1.10000 -1.0 2.0
   45    39    44    46  10.50000 -1.0 2.0
END
