* LIGAND DATABASE FILE (OPLS2005)
*
001      72    73    125    183     357
    1     0 S   NP   _N1_     1    29.05025    94.96871   -26.46619
    2     1 S   H    _HN1     2     1.02949    81.53763     1.25803
    3     1 S   H    _H1_     3     1.02828    26.19475  -165.95617
    4     1 S   H    _H2_     4     1.02791   122.95566  -105.19996
    5     1 S   CT   _CA1     5     1.50118   116.08937   109.90890
    6     5 S   HC   _HA1     6     1.09570   105.18818    87.23918
    7     5 S   CO3  _C1_     7     1.53774   112.45617   -33.03628
    8     7 S   O2Z  _O11     8     1.26377   115.00588   -42.37205
    9     7 S   O2Z  _O12     9     1.26220   114.94221   136.71151
   10     5 S   CT   _CB1    10     1.53062   107.42322  -154.72852
   11    10 S   HC   HB11    11     1.09840   109.39699   -49.08119
   12    10 S   HC   HB12    12     1.09811   110.43852    67.52326
   13    10 S   CT   _CG1    13     1.53019   112.63397  -170.00794
   14    13 S   HC   HG11    14     1.09573   110.73169   -66.09757
   15    13 S   HC   HG12    15     1.09666   109.72880    53.16538
   16    13 S   C    _CD1    16     1.51802   112.02452   173.69217
   17    16 S   O    _OE1    17     1.22749   123.20435    11.09340
   18    16 S   N    _N2_    18     1.38656   111.82571  -169.14377
   19    18 S   H    _HN2    19     1.01587   118.94988     1.76436
   20    18 S   CT1  _CA2    20     1.46215   123.28652   177.06168
   21    20 S   HC   _HA2    21     1.09732   109.34584     4.91685
   22    20 S   C    _C2_    22     1.53583   108.73236  -110.64673
   23    22 S   O    _O2_    23     1.23069   122.20794  -148.22800
   24    20 S   CT   _CB2    32     1.53256   111.62959   126.91727
   25    24 S   HC   HB21    33     1.09601   110.08069    56.94457
   26    24 S   HC   HB22    34     1.09526   110.34704   176.04294
   27    22 S   N    _N3_    24     1.38299   113.79760    39.17588
   28    27 S   H    _HN3    25     1.01569   119.62715    -3.16799
   29    24 S   S    _SG2    35     1.82540   111.79192   -63.97208
   30    27 S   CT   _CA3    26     1.45290   123.25258   177.25712
   31    30 S   HC   HA31    27     1.09547   107.50684   -65.07148
   32    30 S   HC   HA32    28     1.09557   107.99938    51.38471
   33    29 S   CT   _C16    36     1.81937    98.53970   177.98968
   34    33 S   HC   _H9_    37     1.09445   109.69522    64.46347
   35    33 S   HC   _H10    38     1.09516   109.12794   -50.00656
   36    30 S   CO3  _C3_    29     1.52971   114.04596   173.40662
   37    36 S   O2Z  _O31    30     1.26381   116.06370     0.12354
   38    36 S   O2Z  _O32    31     1.26421   114.42234  -179.81762
   39    33 S   CA   _C8_    39     1.51008   111.72165  -171.80602
   40    39 S   CA   _C7_    40     1.40830   123.50673   -93.06145
   41    40 S   CA   _C6_    41     1.40306   120.04636  -178.98471
   42    40 S   CO4  _C17    70     1.48689   120.06617     1.83398
   43    42 S   O    _O39    71     1.22442   123.51224  -156.51144
   44    42 S   HC   _H11    72     1.10060   116.89579    22.99072
   45    41 S   CA   _C5_    42     1.39267   118.88183    -0.59083
   46    41 S   OH   _O40    68     1.36672   119.62447  -179.22368
   47    46 S   HO   _H12    69     0.97017   110.58791  -179.07444
   48    45 S   NB   _N4_    43     1.35149   122.10632    -0.56683
   49    45 S   CT   _C4_    64     1.49938   122.43534  -179.82754
   50    49 S   HC   _H3_    65     1.09441   110.39513    61.14145
   51    49 S   HC   _H4_    66     1.09526   110.87846  -179.46771
   52    49 S   HC   _H5_    67     1.09443   110.40294   -60.15070
   53    39 S   CA   _C9_    44     1.40364   119.82452    86.90681
   54    53 S   NN   _N5_    45     1.40746   121.45903    -3.25341
   55    54 S   NN   _N6_    46     1.25053   109.75138    99.52098
   56    55 S   CA   _C10    47     1.40996   110.74504  -179.78878
   57    56 S   CA   _C11    48     1.40689   120.37253    60.02209
   58    57 S   HA   _H6_    49     1.08749   120.07369    -1.35869
   59    57 S   CA   _C12    50     1.39546   121.21860   178.51062
   60    59 S   HA   _H7_    51     1.08569   119.25582   179.94065
   61    59 S   CA   _C13    52     1.39337   119.24274    -0.73088
   62    61 S   CA   _C14    53     1.39550   121.19683     0.21489
   63    62 S   HA   _H8_    54     1.08520   119.92429  -179.62258
   64    61 S   SY   _S2_    60     1.79774   119.62316   179.31187
   65    64 S   OY   _O38    61     1.46044   103.43334   -23.73351
   66    64 S   OY   _O36    62     1.45970   101.62982    96.35670
   67    64 S   OY   _O37    63     1.46018   103.06098  -143.39289
   68    56 S   CA   _C15    55     1.40661   121.48168  -122.76586
   69    68 S   SY   _S1_    56     1.80560   119.50877     1.27855
   70    69 S   OY   _O35    57     1.45988   102.20219    62.64238
   71    69 S   OY   _O33    58     1.46034   104.06640  -177.60510
   72    69 S   OY   _O34    59     1.46034   102.34208   -57.97337
  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   6   5   4   3
   9   4   3   2   1   1  11  11  12   5   1   1   9   3   1   7
   4   2   1   1   3   4   7  12   8   4   9   3   8  10   3   4
   2   1   1   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    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    53  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    48    53    54    42  
   35    39    40    53  
   39    40    53  
   37    38  
   38  
    0  
   40    41    45    48    53    54    55    46    42    43    44  
   41    45    48    53    54    49    46    47    42    43    44  
   45    48    53    49    50    51    52    46    47    42    43    44  
   43    44    45    46    53  
   44  
    0  
   48    53    54    49    50    51    52    46    47  
   47    48    49  
    0  
   53    54    55    49    50    51    52  
   50    51    52    53  
   51    52  
   52  
    0  
   54    55    56  
   55    56    57    68  
   56    57    58    59    62    68    69  
   57    58    59    60    61    62    63    68    69    70    71    72  
   58    59    60    61    62    68    69    64  
   59    60    61    68  
   60    61    62    63    68    64    65    66    67  
   61    62    64  
   62    63    68    69    64    65    66    67  
   63    68    69    70    71    72    64    65    66    67  
   68    69    64  
   65    66    67    68  
   66    67  
   67  
    0  
   69    70    71    72  
   70    71    72  
   71    72  
   72  
    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   0.210500   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   3.5500   0.0700  -0.455000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700   0.177000   2.0020   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700  -0.142000   2.0020   1.7750   0.001000000  -0.843144165
   42   3.7500   0.1050   0.565000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   44   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   45   3.5500   0.0700   0.370000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.2500   0.1700  -0.678000   1.8650   1.6500   0.001000000  -0.511443539
   49   3.5000   0.0660  -0.065000   2.4950   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5500   0.0700   0.515800   2.0020   1.7750   0.001000000  -0.843144165
   54   3.2500   0.1700  -0.030800   1.8375   1.6250   0.005000000   0.000000000
   55   3.2500   0.1700  -0.030800   1.8375   1.6250   0.005000000   0.000000000
   56   3.5500   0.0700   0.030800   2.0020   1.7750   0.001000000  -0.843144165
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700   0.007500   2.5000   1.7750   0.001000000  -0.843144165
   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   0.2500   1.291800   2.0025   1.7750   0.025682759  -1.666211680
   65   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   66   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   67   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   68   3.5500   0.0700   0.007500   2.5000   1.7750   0.001000000  -0.843144165
   69   3.5500   0.2500   1.291800   2.0025   1.7750   0.025682759  -1.666211680
   70   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   71   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   72   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
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   317.000  1.510
   39    40   469.000  1.400
   39    53   469.000  1.400
   40    41   469.000  1.400
   40    42   310.000  1.470
   41    45   469.000  1.400
   41    46   450.000  1.364
   45    48   483.000  1.339
   45    49   317.000  1.510
   48    53   483.000  1.339
   53    54   370.000  1.400
   54    55   555.000  1.240
   55    56   370.000  1.400
   56    57   469.000  1.400
   56    68   469.000  1.400
   57    58   367.000  1.080
   57    59   469.000  1.400
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   469.000  1.400
   61    64   225.000  1.779
   62    63   367.000  1.080
   62    68   469.000  1.400
   68    69   225.000  1.779
   69    70   735.000  1.471
   69    71   735.000  1.471
   69    72   735.000  1.471
   64    65   735.000  1.471
   64    66   735.000  1.471
   64    67   735.000  1.471
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   46    47   553.000  0.945
   42    43   570.000  1.229
   42    44   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    80.00000  109.48900
   33    39    40    70.00000  120.00000
   33    39    53    70.00000  120.00000
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    63.00000  120.00000
   39    40    42    60.00000  119.52600
   39    53    48    70.00000  124.00000
   39    53    54    70.00000  119.16000
   40    41    45    63.00000  120.00000
   40    41    46    70.00000  120.00000
   40    42    43    75.00000  123.78400
   40    42    44    35.00000  115.00000
   41    45    48    70.00000  124.00000
   41    45    49    70.00000  120.00000
   41    46    47    35.00000  113.00000
   45    48    53    70.00000  117.00000
   45    49    50    35.00000  109.50000
   45    49    51    35.00000  109.50000
   45    49    52    35.00000  109.50000
   48    53    54    75.00000  118.65000
   53    39    40    63.00000  120.00000
   53    54    55    80.00000  113.01500
   54    55    56    80.00000  113.01500
   55    56    57    70.00000  119.16000
   55    56    68    70.00000  119.16000
   56    57    58    35.00000  120.00000
   56    57    59    63.00000  120.00000
   56    68    62    63.00000  120.00000
   56    68    69    65.00000  117.06700
   57    59    60    35.00000  120.00000
   57    59    61    63.00000  120.00000
   59    57    58    35.00000  120.00000
   59    61    62    63.00000  120.00000
   59    61    64    65.00000  117.06700
   61    59    60    35.00000  120.00000
   61    62    63    35.00000  120.00000
   61    62    68    63.00000  120.00000
   61    64    65   100.00000  107.67100
   61    64    66   100.00000  107.67100
   61    64    67   100.00000  107.67100
   62    68    69    65.00000  117.06700
   68    56    57    63.00000  120.00000
   68    62    63    35.00000  120.00000
   68    69    70   100.00000  107.67100
   68    69    71   100.00000  107.67100
   68    69    72   100.00000  107.67100
   71    69    70   115.00000  120.17200
   72    69    70   115.00000  120.17200
   72    69    71   115.00000  120.17200
   64    61    62    65.00000  117.06700
   66    64    65   115.00000  120.17200
   67    64    65   115.00000  120.17200
   67    64    66   115.00000  120.17200
   49    45    48    75.00000  115.74700
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   46    41    45    70.00000  120.00000
   42    40    41    60.00000  119.52600
   44    42    43    35.00000  123.00000
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    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  -0.23050  1.0 1.0
   24    29    33    39   0.06200 -1.0 2.0
   24    29    33    39   0.47200  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  -0.16000  1.0 1.0
   29    33    39    40  -0.03200 -1.0 2.0
   29    33    39    40   0.04500  1.0 3.0
   29    33    39    53  -0.16000  1.0 1.0
   29    33    39    53  -0.03200 -1.0 2.0
   29    33    39    53   0.04500  1.0 3.0
   33    39    40    41   3.62500 -1.0 2.0
   33    39    40    42   3.62500 -1.0 2.0
   33    39    53    48   3.62500 -1.0 2.0
   33    39    53    54   3.62500 -1.0 2.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    53   0.00000  1.0 1.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    53   0.00000  1.0 1.0
   39    40    41    45   3.62500 -1.0 2.0
   39    40    41    46   3.62500 -1.0 2.0
   39    40    42    43   1.05000 -1.0 2.0
   39    40    42    44   0.56600 -1.0 2.0
   39    53    54    55   1.25000 -1.0 2.0
   40    39    53    48   3.62500 -1.0 2.0
   40    39    53    54   3.62500 -1.0 2.0
   40    41   -45    48   3.62500 -1.0 2.0
   40    41    45    49   3.62500 -1.0 2.0
   40    41    46    47   0.84100 -1.0 2.0
   41    40    42    43   1.05000 -1.0 2.0
   41    40    42    44   0.56600 -1.0 2.0
   41    45    48    53   3.62500 -1.0 2.0
   41    45    49    50   0.00000  1.0 1.0
   41    45    49    51   0.00000  1.0 1.0
   41    45    49    52   0.00000  1.0 1.0
   45    41    46    47   0.84100 -1.0 2.0
   45    48   -53    39   3.62500 -1.0 2.0
   45    48    53    54   3.62500 -1.0 2.0
   48    45    49    50   0.00000  1.0 1.0
   48    45    49    51   0.00000  1.0 1.0
   48    45    49    52   0.00000  1.0 1.0
   48    53    54    55   1.25000 -1.0 2.0
   53    39   -40    41   3.62500 -1.0 2.0
   53    39    40    42   3.62500 -1.0 2.0
   53    54    55    56   5.00000 -1.0 2.0
   54    55    56    57   1.25000 -1.0 2.0
   54    55    56    68   1.25000 -1.0 2.0
   55    56    57    58   3.62500 -1.0 2.0
   55    56    57    59   3.62500 -1.0 2.0
   55    56    68    62   3.62500 -1.0 2.0
   55    56    68    69   3.62500 -1.0 2.0
   56    57    59    60   3.62500 -1.0 2.0
   56    57    59    61   3.62500 -1.0 2.0
   56    68    69    70   0.19500  1.0 1.0
   56    68    69    70   0.12000 -1.0 2.0
   56    68    69    71   0.19500  1.0 1.0
   56    68    69    71   0.12000 -1.0 2.0
   56    68    69    72   0.19500  1.0 1.0
   56    68    69    72   0.12000 -1.0 2.0
   57    56    68    62   3.62500 -1.0 2.0
   57    56    68    69   3.62500 -1.0 2.0
   57    59   -61    62   3.62500 -1.0 2.0
   57    59    61    64   3.62500 -1.0 2.0
   58    57    59    60   3.62500 -1.0 2.0
   58    57    59    61   3.62500 -1.0 2.0
   59    61    62    63   3.62500 -1.0 2.0
   59    61    62    68   3.62500 -1.0 2.0
   59    61    64    65   0.19500  1.0 1.0
   59    61    64    65   0.12000 -1.0 2.0
   59    61    64    66   0.19500  1.0 1.0
   59    61    64    66   0.12000 -1.0 2.0
   59    61    64    67   0.19500  1.0 1.0
   59    61    64    67   0.12000 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    64   3.62500 -1.0 2.0
   61    62   -68    56   3.62500 -1.0 2.0
   61    62    68    69   3.62500 -1.0 2.0
   62    61    64    65   0.19500  1.0 1.0
   62    61    64    65   0.12000 -1.0 2.0
   62    61    64    66   0.19500  1.0 1.0
   62    61    64    66   0.12000 -1.0 2.0
   62    61    64    67   0.19500  1.0 1.0
   62    61    64    67   0.12000 -1.0 2.0
   62    68    69    70   0.19500  1.0 1.0
   62    68    69    70   0.12000 -1.0 2.0
   62    68    69    71   0.19500  1.0 1.0
   62    68    69    71   0.12000 -1.0 2.0
   62    68    69    72   0.19500  1.0 1.0
   62    68    69    72   0.12000 -1.0 2.0
   63    62    68    56   3.62500 -1.0 2.0
   63    62    68    69   3.62500 -1.0 2.0
   68    56    57    58   3.62500 -1.0 2.0
   68    56   -57    59   3.62500 -1.0 2.0
   64    61    62    63   3.62500 -1.0 2.0
   64    61    62    68   3.62500 -1.0 2.0
   49    45    48    53   3.62500 -1.0 2.0
   46    41    45    48   3.62500 -1.0 2.0
   46    41    45    49   3.62500 -1.0 2.0
   42    40    41    45   3.62500 -1.0 2.0
   42    40    41    46   3.62500 -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
   37    30    36    38  10.50000 -1.0 2.0
   40    53    39    33   4.00000 -1.0 2.0
   41    42    40    39   4.00000 -1.0 2.0
   45    46    41    40   4.00000 -1.0 2.0
   49    48    45    41   4.00000 -1.0 2.0
   48    54    53    39   4.00000 -1.0 2.0
   57    68    56    55   4.00000 -1.0 2.0
   59    58    57    56   1.10000 -1.0 2.0
   61    60    59    57   1.10000 -1.0 2.0
   62    64    61    59   4.00000 -1.0 2.0
   68    63    62    61   1.10000 -1.0 2.0
   62    69    68    56   4.00000 -1.0 2.0
   40    44    42    43  10.50000 -1.0 2.0
END
