* LIGAND DATABASE FILE (OPLS2005)
*
001      75    76    128    203     380
    1     0 S   NP   _N1_     1    28.82152    94.06907   -23.54843
    2     1 S   H    _HN1     2     1.02857   104.37360   -79.00754
    3     1 S   H    _H1_     3     1.02984    84.55544    28.11090
    4     1 S   H    _H2_     4     1.02790    25.75439   179.39348
    5     1 S   CT   _CA1     5     1.50141   132.46954   140.67702
    6     5 S   HC   _HA1     6     1.09566   105.25260    75.08655
    7     5 S   CO3  _C1_     7     1.53768   112.45782   -45.14744
    8     7 S   O2Z  _O11     8     1.26369   115.04876   -40.72379
    9     7 S   O2Z  _O12     9     1.26251   114.94888   138.40766
   10     5 S   CT   _CB1    10     1.52992   107.31794  -167.02672
   11    10 S   HC   HB11    11     1.09797   109.06429   -51.05383
   12    10 S   HC   HB12    12     1.09762   110.27590    65.57501
   13    10 S   CT   _CG1    13     1.52956   113.16705  -172.35371
   14    13 S   HC   HG11    14     1.09588   110.33170   -65.74091
   15    13 S   HC   HG12    15     1.09640   110.15990    53.59089
   16    13 S   C    _CD1    16     1.51870   112.04557   173.56319
   17    16 S   O    _OE1    17     1.22714   123.17518    -8.38506
   18    16 S   N    _N2_    18     1.38623   111.77643   172.59901
   19    18 S   H    _HN2    19     1.01578   119.01205     0.83345
   20    18 S   CT1  _CA2    20     1.46222   123.32123   178.93247
   21    20 S   HC   _HA2    21     1.09584   109.14721    -7.32892
   22    20 S   C    _C2_    22     1.53410   108.49396  -122.37819
   23    22 S   O    _O2_    23     1.23038   122.38842  -148.00571
   24    20 S   CT   _CB2    32     1.53390   111.56207   115.20236
   25    24 S   HC   HB21    33     1.09650   109.56908    56.62260
   26    24 S   HC   HB22    34     1.09476   111.45301   174.20025
   27    22 S   N    _N3_    24     1.38375   113.50468    39.57320
   28    27 S   H    _HN3    25     1.01640   119.47119    -3.68573
   29    24 S   S    _SG2    35     1.82865   113.33170   -62.55563
   30    27 S   CT   _CA3    26     1.45274   123.10501   176.82454
   31    30 S   HC   HA31    27     1.09555   107.54180   -62.93833
   32    30 S   HC   HA32    28     1.09558   107.91915    53.44998
   33    29 S   CT   _C10    36     1.84672   100.25175   -78.43599
   34    33 S   HC   _H3_    37     1.09407   106.14985    37.85890
   35    30 S   CO3  _C3_    29     1.52922   114.16636   175.39143
   36    35 S   O2Z  _O31    30     1.26359   116.07271    -1.83312
   37    35 S   O2Z  _O32    31     1.26428   114.40327   178.22172
   38    33 S   CA   _C9_    38     1.51895   111.69279   -80.74431
   39    33 S   CM   _C11    50     1.51417   108.17008   154.84451
   40    39 S   HC   _H9_    51     1.09081   115.94634    51.15198
   41    38 S   CA   _C4_    39     1.40510   119.48649   118.25931
   42    41 S   HA   _H5_    40     1.08767   120.33066     0.02798
   43    39 S   CMA  _C12    52     1.35515   126.39247  -126.98147
   44    43 S   OM   _O33    53     1.26747   126.09067    -3.57528
   45    41 S   CA   _C5_    41     1.39590   120.80975   179.98022
   46    45 S   HA   _H6_    42     1.08615   119.82592   179.92598
   47    43 S   OS   _O34    54     1.42117   109.99068   177.85032
   48    45 S   CA   _C6_    43     1.39070   119.63293    -0.17246
   49    47 S   CT   _C13    55     1.44223   114.39687  -128.59747
   50    49 S   HC   _H4_    56     1.09787   110.49957   -48.08370
   51    48 S   CA   _C7_    44     1.39184   120.71120    -0.05935
   52    51 S   HA   _H7_    45     1.08592   121.02020  -179.85329
   53    48 S   OH   _O39    48     1.36625   118.22219  -179.97202
   54    53 S   HO   _H17    49     0.97233   108.50766   179.68286
   55    49 S   CO3  _C21    57     1.54256   105.88178  -164.73773
   56    55 S   O2Z  _O38    58     1.26443   116.24704   -68.03612
   57    55 S   O2Z  _O37    59     1.26562   114.77378   111.98262
   58    49 S   CT   _C14    60     1.53599   110.24984    75.73232
   59    58 S   HC   _H10    61     1.09776   111.06517    66.34346
   60    58 S   HC   _H11    62     1.09770   110.60737   -48.45065
   61    38 S   CA   _C8_    46     1.40597   122.03604   -62.15091
   62    61 S   HA   _H8_    47     1.08749   120.45218     0.04423
   63    58 S   CA   _C15    63     1.50867   113.00777  -169.21739
   64    63 S   CA   _C16    64     1.40130   120.72714  -103.38662
   65    64 S   HA   _H12    65     1.08757   120.22131     0.82115
   66    64 S   CA   _C17    66     1.39633   120.51707  -179.01981
   67    66 S   HA   _H13    67     1.08612   119.28843   179.72660
   68    66 S   CA   _C18    68     1.39358   119.70014     0.08623
   69    68 S   CA   _C19    69     1.39235   120.20058    -0.52749
   70    68 S   OH   _O36    74     1.36718   120.45904   178.90818
   71    70 S   HO   _H16    75     0.97234   108.62068     3.86300
   72    63 S   CA   _C20    70     1.40220   120.01829    76.85955
   73    72 S   HA   _H14    71     1.08782   119.53670    -0.25717
   74    69 S   OH   _O35    72     1.36745   119.42644   179.13702
   75    74 S   HO   _H15    73     0.97288   108.46250   176.30181
  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   8   5   4   3
  13   6   2   1   1  12   7   3   8   4   6   2   7   3   9   6
  10   7   5   3   2   1   6   2   1   9   4   3   1   1   9   8
   4   7   3   7   6   3   1   3   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    61    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    51    61    62    39    40    43    44    47  
   38    41    61    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    48    51    52    61    62    39    40    43  
   40    43    44    47    49    41    61  
   43    44    47  
   42    45    46    48    51    61    62    53  
   45    46    48    61  
   44    47    49    50    55    58  
   47    49  
   46    48    51    52    61    53    54  
   48    51    53  
   49    50    55    56    57    58    59    60    63  
   51    52    61    62    53    54  
   50    55    56    57    58    59    60    63    64    72  
   55    56    57    58    59    60    63  
   52    61    62    53    54  
   61    62    53  
   54    61  
    0  
   56    57    58    59    60    63  
   57    58  
   58  
   59    60    63    64    65    66    69    72    73  
   60    63    64    72  
   63    64    72  
   62  
    0  
   64    65    66    67    68    69    72    73    74  
   65    66    67    68    69    72    73    70  
   66    67    68    72  
   67    68    69    72    74    70    71  
   68    69    70  
   69    72    73    74    75    70    71  
   72    73    74    75    70    71  
   71    72    74  
    0  
   73    74    75  
   74  
   75  
    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   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   58   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   69   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   70   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   72   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   73   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   74   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   75   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
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   317.000  1.510
   38    41   469.000  1.400
   38    61   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    48   469.000  1.400
   48    51   469.000  1.400
   48    53   450.000  1.364
   51    52   367.000  1.080
   51    61   469.000  1.400
   61    62   367.000  1.080
   53    54   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    47   440.000  1.360
   47    49   320.000  1.410
   49    50   340.000  1.090
   49    55   317.000  1.522
   49    58   268.000  1.529
   55    56   656.000  1.250
   55    57   656.000  1.250
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    63   317.000  1.510
   63    64   469.000  1.400
   63    72   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   469.000  1.400
   68    70   450.000  1.364
   69    72   469.000  1.400
   69    74   450.000  1.364
   72    73   367.000  1.080
   74    75   553.000  0.945
   70    71   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    61    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    61    51    63.00000  120.00000
   38    61    62    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    48    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    48    51    63.00000  120.00000
   45    48    53    70.00000  120.00000
   48    45    46    35.00000  120.00000
   48    51    52    35.00000  120.00000
   48    51    61    63.00000  120.00000
   48    53    54    35.00000  113.00000
   51    61    62    35.00000  120.00000
   61    38    41    63.00000  120.00000
   61    51    52    35.00000  120.00000
   53    48    51    70.00000  120.00000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    47    80.00000  120.01400
   43    39    40    40.00000  120.50800
   43    47    49    90.00000  111.18400
   47    43    44    65.00000  121.00000
   47    49    50    35.00000  109.50000
   47    49    55    85.00000  109.63000
   47    49    58    50.00000  109.50000
   49    55    56    70.00000  117.00000
   49    55    57    70.00000  117.00000
   49    58    59    37.50000  110.70000
   49    58    60    37.50000  110.70000
   49    58    63    70.00000  112.17500
   55    49    50    35.00000  109.50000
   57    55    56    80.00000  126.00000
   58    49    50    37.50000  110.70000
   58    49    55    70.00000  109.69300
   58    63    64    70.00000  120.00000
   58    63    72    70.00000  120.00000
   60    58    59    33.00000  107.80000
   63    58    59    35.00000  109.50000
   63    58    60    35.00000  109.50000
   63    64    65    35.00000  120.00000
   63    64    66    63.00000  120.00000
   63    72    69    63.00000  120.00000
   63    72    73    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    63.00000  120.00000
   66    68    70    70.00000  120.00000
   68    66    67    35.00000  120.00000
   68    69    72    63.00000  120.00000
   68    69    74    70.00000  120.00000
   68    70    71    35.00000  113.00000
   69    72    73    35.00000  120.00000
   69    74    75    35.00000  113.00000
   72    63    64    63.00000  120.00000
   74    69    72    70.00000  120.00000
   70    68    69    70.00000  120.00000
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  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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    61  -0.16000  1.0 1.0
   29    33    38    61  -0.03200 -1.0 2.0
   29    33    38    61   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    61    51   3.62500 -1.0 2.0
   33    38    61    62   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    47   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    61   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    48   3.62500 -1.0 2.0
   41    38    61    51   3.62500 -1.0 2.0
   41    38    61    62   3.62500 -1.0 2.0
   41    45   -48    51   3.62500 -1.0 2.0
   41    45    48    53   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    48   3.62500 -1.0 2.0
   45    48    51    52   3.62500 -1.0 2.0
   45    48    51    61   3.62500 -1.0 2.0
   45    48    53    54   0.84100 -1.0 2.0
   46    45    48    51   3.62500 -1.0 2.0
   46    45    48    53   3.62500 -1.0 2.0
   48    51   -61    38   3.62500 -1.0 2.0
   48    51    61    62   3.62500 -1.0 2.0
   51    48    53    54   0.84100 -1.0 2.0
   52    51    61    38   3.62500 -1.0 2.0
   52    51    61    62   3.62500 -1.0 2.0
   61    38    41    42   3.62500 -1.0 2.0
   61    38   -41    45   3.62500 -1.0 2.0
   53    48    51    52   3.62500 -1.0 2.0
   53    48    51    61   3.62500 -1.0 2.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    61   0.18050 -1.0 2.0
   39    43    47    49  -2.26850  1.0 1.0
   39    43    47    49   3.39050 -1.0 2.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    47   7.00000 -1.0 2.0
   43    47    49    50   0.08050  1.0 3.0
   43    47    49    55  -0.48150  1.0 1.0
   43    47    49    55   0.09250 -1.0 2.0
   43    47    49    55  -0.12850  1.0 3.0
   43    47    49    58  -0.46850  1.0 1.0
   43    47    49    58   0.09300 -1.0 2.0
   43    47    49    58  -0.12850  1.0 3.0
   44    43    47    49   2.00000 -1.0 2.0
   47    49    55    56   0.30150 -1.0 2.0
   47    49    55    57   0.30150 -1.0 2.0
   47    49    58    59   0.23400  1.0 3.0
   47    49    58    60   0.23400  1.0 3.0
   47    49    58    63  -0.64350  1.0 1.0
   47    49    58    63  -0.04200 -1.0 2.0
   47    49    58    63   0.19800  1.0 3.0
   49    58    63    64   0.04150 -1.0 2.0
   49    58    63    72   0.04150 -1.0 2.0
   50    49    55    56   0.00000  1.0 1.0
   50    49    55    57   0.00000  1.0 1.0
   50    49    58    59   0.15000  1.0 3.0
   50    49    58    60   0.15000  1.0 3.0
   50    49    58    63   0.43200  1.0 3.0
   55    49    58    59  -0.11250  1.0 3.0
   55    49    58    60  -0.11250  1.0 3.0
   55    49    58    63  -2.95950  1.0 1.0
   55    49    58    63   0.02300  1.0 3.0
   58    49    55    56   0.41150 -1.0 2.0
   58    49    55    57   0.41150 -1.0 2.0
   58    63    64    65   3.62500 -1.0 2.0
   58    63    64    66   3.62500 -1.0 2.0
   58    63    72    69   3.62500 -1.0 2.0
   58    63    72    73   3.62500 -1.0 2.0
   59    58    63    64   0.00000  1.0 1.0
   59    58    63    72   0.00000  1.0 1.0
   60    58    63    64   0.00000  1.0 1.0
   60    58    63    72   0.00000  1.0 1.0
   63    64    66    67   3.62500 -1.0 2.0
   63    64    66    68   3.62500 -1.0 2.0
   64    63    72    69   3.62500 -1.0 2.0
   64    63    72    73   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    69    72   3.62500 -1.0 2.0
   66    68    69    74   3.62500 -1.0 2.0
   66    68    70    71   0.84100 -1.0 2.0
   67    66    68    69   3.62500 -1.0 2.0
   67    66    68    70   3.62500 -1.0 2.0
   68    69   -72    63   3.62500 -1.0 2.0
   68    69    72    73   3.62500 -1.0 2.0
   68    69    74    75   0.84100 -1.0 2.0
   69    68    70    71   0.84100 -1.0 2.0
   72    63    64    65   3.62500 -1.0 2.0
   72    63   -64    66   3.62500 -1.0 2.0
   72    69    74    75   0.84100 -1.0 2.0
   74    69    72    63   3.62500 -1.0 2.0
   74    69    72    73   3.62500 -1.0 2.0
   70    68    69    72   3.62500 -1.0 2.0
   70    68    69    74   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
   36    30    35    37  10.50000 -1.0 2.0
   41    61    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   48    46    45    41   1.10000 -1.0 2.0
   51    53    48    45   4.00000 -1.0 2.0
   61    52    51    48   1.10000 -1.0 2.0
   51    62    61    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   44    47    43    39  15.00000 -1.0 2.0
   56    49    55    57  10.50000 -1.0 2.0
   64    72    63    58   4.00000 -1.0 2.0
   66    65    64    63   1.10000 -1.0 2.0
   68    67    66    64   1.10000 -1.0 2.0
   69    70    68    66   4.00000 -1.0 2.0
   72    74    69    68   4.00000 -1.0 2.0
   69    73    72    63   1.10000 -1.0 2.0
END
