* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    124    188     356
    1     0 S   NP   _N1_     1    28.70111    93.89000   -20.80213
    2     1 S   H    _HN1     2     1.02073    37.77296   126.73361
    3     1 S   H    _H1_     3     1.02093    77.28789   -87.50316
    4     1 S   H    _H2_     4     1.02099   100.36828    19.52521
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03433
    7     5 S   CO3  _C1_     7     1.53829   109.33942   -68.17175
    8     7 S   O2Z  _O11     8     1.25154   118.46701   -27.32737
    9     7 S   O2Z  _O12     9     1.24898   117.24946   152.26555
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74439
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98761
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04690   118.93088     8.54893
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08486   106.38580   -11.13132
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08733   110.25787    59.09630
   26    24 S   HC   HB22    34     1.08755   109.66015   178.71931
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52763  -172.12613
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27908
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C11    36     1.82613    98.11853   -78.18164
   34    33 S   HC   _H4_    37     1.09581   106.43196    41.82137
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13160
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33884
   38    33 S   CT   _C10    38     1.51843   110.68962   -80.01753
   39    38 S   HC   _H8_    39     1.09472   115.30959    35.33901
   40    38 S   HC   _H9_    40     1.09865   108.17893   154.76561
   41    38 S   CO   _C9_    41     1.53236   104.34493   -90.53619
   42    41 S   HC   _H3_    42     1.12018   111.06941  -138.84499
   43    41 S   N*   _N6_    43     1.51541   113.76352   104.07324
   44    41 S   OS   _O33    57     1.43959   106.66693   -19.68788
   45    43 S   CRAB _C8_    44     1.36971   126.05651  -118.96104
   46    45 S   HA   _H7_    45     1.08120   122.25041    -0.10835
   47    33 S   CT   _C12    58     1.52711   115.47795   165.97399
   48    47 S   HC   _H5_    59     1.09652   108.40448  -161.47459
   49    45 S   NNA  _N7_    46     1.31661   112.17584   179.85873
   50    47 S   CT   _C13    60     1.51824   117.81551   -38.63442
   51    50 S   HC   _H10    61     1.09287   110.35770    80.00035
   52    50 S   HC   _H11    62     1.09311   110.32413   -40.90234
   53    49 S   C56B _C6_    47     1.37267   104.85000     0.01978
   54    50 S   OS   _O34    63     1.41850   108.84846  -160.45723
   55    43 S   C56A _C7_    48     1.36631   126.85140    60.87615
   56    54 S   P1   _P1_    64     1.62517   118.25724   179.97202
   57    56 S   O2Z  _O35    65     1.50688   111.83742   173.63511
   58    56 S   HP   _H12    66     1.41047   103.78349    40.00541
   59    55 S   NB   _N5_    49     1.34164   127.59584     0.12972
   60    56 S   OS   _O36    67     1.62602   101.61083   -67.33248
   61    60 S   HO   _H13    68     0.98048   118.64357  -179.27530
   62    59 S   CQ   _C4_    50     1.35057   110.44753  -179.98022
   63    62 S   HA   _H6_    51     1.08515   115.65190  -179.98022
   64    62 S   NB   _N4_    52     1.35537   128.84807    -0.00000
   65    53 S   CA   _C5_    53     1.39086   132.43537  -179.96044
   66    65 S   NND  _N8_    54     1.40530   120.70167    -0.04846
   67    66 S   H    _H14    55     1.00288   119.42942    -3.11527
   68    66 S   H    _H15    56     1.00228   119.48080  -176.89247
  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  10   5   4   3
  14   8   2   1   1  11   6   5  12   5  10   8   6   3   6   4
   6   7   3   2   8   5   6   4   3   2   4   1   1   4   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    44    47    48    50  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    47    48    50    51    52    54  
   38    39    40    41    44    47    48    50  
   36    37  
   37  
    0  
   39    40    41    42    43    45    55    44    47    48    50  
   40    41    42    43    44    47  
   41    42    43    44    47  
   42    43    45    46    49    53    55    59    44    47    48    50  
   43    45    55    44    47  
   45    46    49    53    55    59    62    65    44    47  
   47    48    50    51    52    54    45    55  
   46    49    53    55    59    65  
   49    53    55  
   48    50    51    52    54    56  
   50    51    52    54  
   53    55    59    64    65    66  
   51    52    54    56    57    58    60  
   52    54    56  
   54    56  
   55    59    62    64    65    66    67    68  
   56    57    58    60    61  
   59    62    63    64    65    66  
   57    58    60    61  
   58    60    61  
   60    61  
   62    63    64    65  
   61  
    0  
   63    64    65    66  
   64    65  
   65    66    67    68  
   66    67    68  
   67    68  
   68  
    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   0.107500   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.450000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   43   3.2500   0.1700  -0.500000   1.8000   1.6000   0.001000000  -0.511443539
   44   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   45   3.5000   0.0800   0.200000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   49   3.2500   0.1700  -0.490000   1.8000   1.6000   0.001000000  -0.511443539
   50   3.5000   0.0660   0.152900   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0800   0.150000   2.5000   1.7750   0.001000000  -0.843144165
   54   2.8500   0.1400  -0.461100   1.7660   1.5600   0.020110767  -0.896042159
   55   3.5000   0.0800   0.380000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.7400   0.2000   1.099000   2.1070   1.8700   0.005000000   0.000000000
   57   2.9800   0.2000  -0.666100   1.6890   1.4900   0.001000000  -0.126889456
   58   2.5000   0.0300  -0.056500   1.4250   1.2500   0.008598240   0.268726247
   59   3.2500   0.1700  -0.550000   1.8000   1.6000   0.001000000  -0.511443539
   60   2.8500   0.1400  -0.568200   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5000   0.0800   0.220000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   64   3.2500   0.1700  -0.530000   1.8000   1.6000   0.001000000  -0.511443539
   65   3.5000   0.0800   0.440000   2.0020   1.7750   0.001000000  -0.843144165
   66   3.2500   0.1700  -0.810000   1.8650   1.6500   0.051222218  -2.220205820
   67   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   68   0.5000   0.0300   0.370000   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   268.000  1.529
   33    47   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   250.000  1.527
   41    42   340.000  1.090
   41    43   275.000  1.479
   41    44   320.000  1.380
   43    45   440.000  1.371
   43    55   436.000  1.374
   45    46   367.000  1.080
   45    49   529.000  1.304
   49    53   414.000  1.391
   53    55   447.000  1.419
   53    65   469.000  1.404
   55    59   461.000  1.354
   59    62   502.000  1.324
   62    63   367.000  1.080
   62    64   502.000  1.324
   64    65   483.000  1.339
   65    66   481.000  1.340
   66    67   434.000  1.010
   66    68   434.000  1.010
   44    47   320.000  1.410
   47    48   340.000  1.090
   47    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    54   320.000  1.410
   54    56   405.000  1.623
   56    57   675.000  1.490
   56    58   225.000  1.411
   56    60   405.000  1.623
   60    61   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    75.00000  111.63000
   29    33    47    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    75.00000  109.43000
   33    47    44    50.00000  109.50000
   33    47    48    37.50000  110.70000
   33    47    50    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    41    42    45.00000  112.01100
   38    41    43    75.00000  107.44000
   38    41    44    90.00000  108.56700
   40    38    39    33.00000  107.80000
   41    38    39    45.00000  108.72000
   41    38    40    45.00000  108.72000
   41    43    45    70.00000  128.80000
   41    43    55    70.00000  125.80000
   41    44    47    60.00000  109.50000
   43    41    42    55.00000  103.44000
   43    45    46    35.00000  123.05000
   43    45    49    70.00000  113.90000
   43    55    53    70.00000  106.20000
   43    55    59    70.00000  126.20000
   45    49    53    70.00000  103.80000
   49    45    46    35.00000  123.05000
   49    53    55    70.00000  110.40000
   49    53    65    70.00000  132.40000
   53    55    59    70.00000  127.70000
   53    65    64    70.00000  117.30000
   53    65    66    70.00000  123.50000
   55    43    45    70.00000  105.40000
   55    59    62    70.00000  111.00000
   59    62    63    35.00000  115.45000
   59    62    64    70.00000  129.10000
   62    64    65    70.00000  118.60000
   64    62    63    35.00000  115.45000
   64    65    66    70.00000  119.30000
   65    53    55    85.00000  116.20000
   65    66    67    35.00000  120.00000
   65    66    68    35.00000  120.00000
   68    66    67    35.00000  120.00000
   44    41    42    35.00000  109.50000
   44    41    43   105.00000  106.22000
   44    47    48    35.00000  109.50000
   44    47    50    50.00000  109.50000
   47    33    34    37.50000  110.70000
   47    33    38    58.35000  112.70000
   47    50    51    37.50000  110.70000
   47    50    52    37.50000  110.70000
   47    50    54    50.00000  109.50000
   50    47    48    37.50000  110.70000
   50    54    56    75.00000  119.24600
   52    50    51    33.00000  107.80000
   54    50    51    35.00000  109.50000
   54    50    52    35.00000  109.50000
   54    56    57   100.00000  115.86100
   54    56    58    60.00000  100.09000
   54    56    60   120.00000  102.38000
   56    60    61    50.00000  113.86100
   58    56    57    50.00000  114.77800
   60    56    57   100.00000  115.86100
   60    56    58    60.00000  100.09000
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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   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    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    47    44   0.56750  1.0 1.0
   29    33    47    44  -0.07550 -1.0 2.0
   29    33    47    44   0.20000  1.0 3.0
   29    33    47    48   0.15000  1.0 3.0
   29    33    47    50   0.44750  1.0 1.0
   29    33    47    50  -0.17800 -1.0 2.0
   29    33    47    50   0.20200  1.0 3.0
   33    38    41    42   0.15000  1.0 3.0
   33    38    41    43  -0.64600  1.0 1.0
   33    38    41    43   0.58400 -1.0 2.0
   33    38   -41    44   0.62750  1.0 1.0
   33    38   -41    44  -0.30950 -1.0 2.0
   33    38   -41    44   0.27300  1.0 3.0
   33    47    50    51   0.15000  1.0 3.0
   33    47    50    52   0.15000  1.0 3.0
   33    47    50    54   0.62750  1.0 1.0
   33    47    50    54  -0.30950 -1.0 2.0
   33    47    50    54   0.27300  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    47    44   0.23400  1.0 3.0
   34    33    47    48   0.15000  1.0 3.0
   34    33    47    50   0.15000  1.0 3.0
   38    33   -47    44   0.62750  1.0 1.0
   38    33   -47    44  -0.30950 -1.0 2.0
   38    33   -47    44   0.27300  1.0 3.0
   38    33    47    48   0.15000  1.0 3.0
   38    33    47    50   0.56750  1.0 1.0
   38    33    47    50  -0.07550 -1.0 2.0
   38    33    47    50   0.20000  1.0 3.0
   38    41    43    45   1.10250  1.0 1.0
   38    41    43    45   0.01650 -1.0 2.0
   38    41    43    45   0.39100  1.0 3.0
   38    41    43    55   1.10250  1.0 1.0
   38    41    43    55   0.01650 -1.0 2.0
   38    41    43    55   0.39100  1.0 3.0
   38    41   -44    47   0.06250  1.0 1.0
   38    41   -44    47  -0.01100 -1.0 2.0
   38    41   -44    47   0.28050  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    43   0.15000  1.0 3.0
   39    38    41    44   0.23400  1.0 3.0
   40    38    41    42   0.15000  1.0 3.0
   40    38    41    43   0.15000  1.0 3.0
   40    38    41    44   0.23400  1.0 3.0
   41    43    45    46   3.62500 -1.0 2.0
   41    43    45    49   3.62500 -1.0 2.0
   41    43    55    53   0.81400  1.0 1.0
   41    43    55    53   1.55550 -1.0 2.0
   41    43    55    59   3.62500 -1.0 2.0
   41    44   -47    33   0.06250  1.0 1.0
   41    44   -47    33  -0.01100 -1.0 2.0
   41    44   -47    33   0.28050  1.0 3.0
   41    44    47    48   0.37050  1.0 3.0
   41    44    47    50   0.06250  1.0 1.0
   41    44    47    50  -0.01100 -1.0 2.0
   41    44    47    50   0.28050  1.0 3.0
   42    41    43    45   0.00000  1.0 1.0
   42    41    43    55   0.00000  1.0 1.0
   42    41    44    47   0.37050  1.0 3.0
   43    41    44    47  -2.37750  1.0 1.0
   43    41    44    47  -0.08150 -1.0 2.0
   43    41    44    47   0.59000  1.0 3.0
   43    45   -49    53   3.62500 -1.0 2.0
   43    55    59    62   3.62500 -1.0 2.0
   45    43   -55    53   0.70250  1.0 1.0
   45    43   -55    53   1.56150 -1.0 2.0
   45    43    55    59   3.62500 -1.0 2.0
   45    49   -53    55   3.62500 -1.0 2.0
   45    49    53    65   3.62500 -1.0 2.0
   46    45    49    53   3.62500 -1.0 2.0
   49    53   -55    43   3.62500 -1.0 2.0
   49    53    55    59   3.62500 -1.0 2.0
   49    53    65    64   3.62500 -1.0 2.0
   49    53    65    66   3.62500 -1.0 2.0
   53    55    59    62   3.62500 -1.0 2.0
   53    65    66    67   0.70000 -1.0 2.0
   53    65    66    68   0.70000 -1.0 2.0
   55    43    45    46   3.62500 -1.0 2.0
   55    43   -45    49   3.62500 -1.0 2.0
   55    53    65    64   3.62500 -1.0 2.0
   55    53    65    66   3.62500 -1.0 2.0
   55    59    62    63   3.62500 -1.0 2.0
   55    59   -62    64   3.62500 -1.0 2.0
   59    62    64    65   3.62500 -1.0 2.0
   62    64   -65    53   3.62500 -1.0 2.0
   62    64    65    66   3.62500 -1.0 2.0
   63    62    64    65   3.62500 -1.0 2.0
   64    65    66    67   0.70000 -1.0 2.0
   64    65    66    68   0.70000 -1.0 2.0
   65    53    55    43   3.00000 -1.0 2.0
   65    53   -55    59   3.62500 -1.0 2.0
   44    41    43    45   0.10350  1.0 1.0
   44    41    43    45  -0.15350 -1.0 2.0
   44    41    43    55   0.10350  1.0 1.0
   44    41    43    55  -0.15350 -1.0 2.0
   44    47    50    51   0.23400  1.0 3.0
   44    47    50    52   0.23400  1.0 3.0
   44    47    50    54   1.11900  1.0 1.0
   44    47    50    54  -1.16350 -1.0 2.0
   44    47    50    54  -0.34150  1.0 3.0
   47    33    38    39   0.15000  1.0 3.0
   47    33    38    40   0.15000  1.0 3.0
   47    33   -38    41   3.97050  1.0 1.0
   47    50    54    56  -2.65550  1.0 1.0
   47    50    54    56  -0.22350 -1.0 2.0
   47    50    54    56   0.24150  1.0 3.0
   48    47    50    51   0.15000  1.0 3.0
   48    47    50    52   0.15000  1.0 3.0
   48    47    50    54   0.23400  1.0 3.0
   50    54    56    57   0.00000  1.0 1.0
   50    54    56    58   0.15000  1.0 3.0
   50    54    56    60   0.91800  1.0 1.0
   50    54    56    60   0.22900 -1.0 2.0
   50    54    56    60   0.32050  1.0 3.0
   51    50    54    56   0.03000  1.0 3.0
   52    50    54    56   0.03000  1.0 3.0
   54    56    60    61  -0.22900  1.0 1.0
   54    56    60    61   0.09450 -1.0 2.0
   54    56    60    61  -0.07800  1.0 3.0
   57    56    60    61   0.00000  1.0 1.0
   58    56    60    61   0.15000  1.0 3.0
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
   45    55    43    41   4.00000 -1.0 2.0
   49    46    45    43   1.10000 -1.0 2.0
   55    65    53    49   4.00000 -1.0 2.0
   53    59    55    43   4.00000 -1.0 2.0
   64    63    62    59   1.10000 -1.0 2.0
   64    66    65    53   4.00000 -1.0 2.0
   68    65    66    67   1.00000 -1.0 2.0
END
