* LIGAND DATABASE FILE (OPLS2005)
*
001      73    73    127    190     372
    1     0 S   NP   _N1_     1    28.59364    95.10880   -21.49116
    2     1 S   H    _HN1     2     1.02959    88.84333    32.59653
    3     1 S   H    _H1_     3     1.02838    32.74469   157.63750
    4     1 S   H    _H2_     4     1.02780    88.92613   -75.72795
    5     1 S   CT   _CA1     5     1.50100   143.50010   156.65999
    6     5 S   HC   _HA1     6     1.09571   105.28176    59.81898
    7     5 S   CO3  _C1_     7     1.53836   112.28186   -60.49303
    8     7 S   O2Z  _O11     8     1.26365   115.04128   -46.46781
    9     7 S   O2Z  _O12     9     1.26234   114.91341   132.75335
   10     5 S   CT   _CB1    10     1.53093   107.43728   177.75807
   11    10 S   HC   HB11    11     1.09821   109.49826   -50.43089
   12    10 S   HC   HB12    12     1.09827   110.34154    66.14374
   13    10 S   CT   _CG1    13     1.53012   112.62583  -171.53747
   14    13 S   HC   HG11    14     1.09601   110.33988   -59.96221
   15    13 S   HC   HG12    15     1.09625   110.14745    59.26622
   16    13 S   C    _CD1    16     1.51794   112.17879   179.67494
   17    16 S   O    _OE1    17     1.22728   123.22394    -8.70965
   18    16 S   N    _N2_    18     1.38611   111.65621   171.39581
   19    18 S   H    _HN2    19     1.01587   119.04693     2.26244
   20    18 S   CT1  _CA2    20     1.46282   123.38798  -176.16763
   21    20 S   HC   _HA2    21     1.09728   109.38370   -13.35328
   22    20 S   C    _C2_    22     1.53352   108.40871  -129.22390
   23    22 S   O    _O2_    23     1.23002   122.27800  -145.66842
   24    20 S   CT   _CB2    32     1.53491   111.13659   108.56744
   25    24 S   HC   HB21    33     1.09582   109.50263    56.15941
   26    24 S   HC   HB22    34     1.09493   110.62044   175.07145
   27    22 S   N    _N3_    24     1.38522   113.33074    41.70702
   28    27 S   H    _HN3    25     1.01528   118.90760    -0.57607
   29    24 S   S    _SG2    35     1.82887   111.46538   -64.99529
   30    27 S   CT   _CA3    26     1.45447   123.41634   175.09527
   31    30 S   HC   HA31    27     1.09526   109.20275    25.04945
   32    30 S   HC   HA32    28     1.09495   107.12978   142.04881
   33    29 S   CT   _C12    36     1.85497    99.79209   158.00134
   34    33 S   HC   _H4_    37     1.09806   106.09179   -44.85780
   35    30 S   CO3  _C3_    29     1.52929   113.14316   -98.40346
   36    35 S   O2Z  _O31    30     1.26402   115.41703   -44.17223
   37    35 S   O2Z  _O32    31     1.26358   114.97435   136.77199
   38    33 S   CA   _C13    38     1.52040   109.73658    73.24549
   39    33 S   CT   _C9_    52     1.56033   110.50258  -161.47568
   40    39 S   HC   _H3_    53     1.09341   108.41413   -60.13877
   41    38 S   CA   _C14    39     1.39630   122.19163    67.13934
   42    41 S   HA   _H16    40     1.08741   120.26378    -0.94149
   43    39 S   CZ   _C10    54     1.48336   111.06284    60.19091
   44    39 S   C    _C8_    57     1.53948   110.58150   179.16491
   45    44 S   O    _O33    58     1.23649   119.76993   -34.95862
   46    41 S   CA   _C15    41     1.40684   119.81282   179.31815
   47    43 S   CZ   _C11    55     1.20103   179.67434   -55.57901
   48    47 S   HC   _H15    56     1.06552   179.67979    31.35260
   49    44 S   N    _N4_    59     1.40043   117.94191   146.66553
   50    46 S   CA   _C16    42     1.41489   125.13007     0.17471
   51    50 S   OM   _O35    43     1.28030   125.08331  -179.63631
   52    46 S   NO2  _N5_    49     1.45052   115.32071  -179.55721
   53    52 S   ON   _O37    50     1.23853   116.86775    83.05064
   54    52 S   ON   _O36    51     1.23832   117.04718   -95.00806
   55    49 S   CT   _C5_    60     1.46935   125.40618     4.56257
   56    55 S   HC   _H8_    61     1.09252   110.34351    27.09594
   57    55 S   HC   _H9_    62     1.09584   108.41657   143.13258
   58    49 S   CT   _C6_    67     1.46661   118.25040  -177.44442
   59    58 S   HC   _H10    68     1.09585   109.22294    31.12794
   60    58 S   HC   _H11    69     1.09519   109.10778   147.90454
   61    50 S   CA   _C17    44     1.41395   112.20132     0.22206
   62    55 S   CT   _C4_    63     1.52069   111.96038   -95.53223
   63    62 S   HC   _H5_    64     1.09460   111.23997   -60.28172
   64    62 S   HC   _H6_    65     1.09328   111.39059    59.71276
   65    62 S   HC   _H7_    66     1.09430   110.25781   179.83214
   66    58 S   CT   _C7_    70     1.52081   111.75952   -89.63544
   67    66 S   HC   _H12    71     1.09461   111.21468   -60.52482
   68    66 S   HC   _H13    72     1.09489   111.10660    59.42524
   69    66 S   HC   _H14    73     1.09429   110.30675   179.44609
   70    38 S   CA   _C18    45     1.39769   119.99433  -113.03195
   71    70 S   HA   _H17    46     1.08765   120.32345     0.22117
   72    61 S   OH   _O34    47     1.37990   119.62040   179.87646
   73    72 S   HO   _H18    48     0.97517   105.73172    -0.03426
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  15   7   2   1   1  13  11   5  10   4   5  11   3   8   1   1
  14   9   4   3   1   1  10   6   5   7   5   4   4   3   2   1
   1   3   2   1   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    70    39    40    43    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    46    61    70    71    39    40    43    47    44    45    49  
   38    41    70    39    40    43    44  
   36    37  
   37  
    0  
   41    42    46    50    61    70    71    72    52    39    40    43    44  
   40    43    47    48    44    45    49    55    58    41    70  
   43    47    44    45    49  
   42    46    50    51    61    70    71    52    53    54  
   46    50    70    52  
   47    48    44    45    49  
   45    49    55    56    57    62    58    59    60    66    47  
   49    55    58  
   50    51    61    70    72    52    53    54  
   48  
    0  
   55    56    57    62    63    64    65    58    59    60    66    67    68    69  
   51    61    70    71    72    73    52    53    54  
   61    70    72    52  
   53    54    61  
   54  
    0  
   56    57    62    63    64    65    58    59    60    66  
   57    62    63    64    65    58  
   62    63    64    65    58  
   59    60    66    67    68    69    62  
   60    66    67    68    69  
   66    67    68    69  
   70    71    72    73  
   63    64    65  
   64    65  
   65  
    0  
   67    68    69  
   68    69  
   69  
    0  
   71    72    73  
   72  
   73  
    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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   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   3.6500   0.1500   0.010000   2.0580   1.8250   0.025318638  -1.264311570
   44   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   46   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.6500   0.1500  -0.210000   2.0580   1.8250   0.025318638  -1.264311570
   48   2.4200   0.0300   0.200000   1.3810   1.2100   0.008598240   0.268726247
   49   3.2500   0.1700  -0.140000   1.8100   1.6000   0.054801302  -1.445846770
   50   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   52   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   53   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   54   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   55   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   58   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   72   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   73   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   268.000  1.529
   38    41   469.000  1.400
   38    70   469.000  1.400
   41    42   367.000  1.080
   41    46   469.000  1.400
   46    50   469.000  1.400
   46    52   400.000  1.460
   50    51   450.000  1.364
   50    61   469.000  1.400
   61    70   469.000  1.400
   61    72   450.000  1.364
   70    71   367.000  1.080
   72    73   553.000  0.945
   52    53   550.000  1.225
   52    54   550.000  1.225
   39    40   340.000  1.090
   39    43   390.000  1.470
   39    44   317.000  1.522
   43    47   985.000  1.221
   47    48   410.000  1.067
   44    45   570.000  1.229
   44    49   490.000  1.335
   49    55   337.000  1.449
   49    58   337.000  1.449
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    70    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    43    58.35000  112.70000
   33    39    44    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    46    63.00000  120.00000
   38    70    61    63.00000  120.00000
   38    70    71    35.00000  120.00000
   41    46    50    63.00000  120.00000
   41    46    52    85.00000  120.00000
   46    41    42    35.00000  120.00000
   46    50    51    70.00000  120.00000
   46    50    61    63.00000  120.00000
   46    52    53    80.00000  117.50000
   46    52    54    80.00000  117.50000
   50    61    70    63.00000  120.00000
   50    61    72    70.00000  120.00000
   61    50    51    70.00000  120.00000
   61    70    71    35.00000  120.00000
   61    72    73    35.00000  113.00000
   70    38    41    63.00000  120.00000
   72    61    70    70.00000  120.00000
   52    46    50    85.00000  120.00000
   54    52    53    80.00000  125.30000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    47    30.00000  179.48800
   39    44    45    80.00000  120.40000
   39    44    49    70.00000  116.60000
   43    39    40    35.00000  108.50000
   43    47    48    20.00000  179.85100
   44    39    40    35.00000  109.50000
   44    39    43    70.00000  111.78000
   44    49    55    50.00000  121.90000
   44    49    58    50.00000  121.90000
   49    44    45    80.00000  122.90000
   49    55    56    35.00000  109.50000
   49    55    57    35.00000  109.50000
   49    55    62    70.00000  110.72300
   49    58    59    35.00000  109.50000
   49    58    60    35.00000  109.50000
   49    58    66    70.00000  110.72300
   55    62    63    37.50000  110.70000
   55    62    64    37.50000  110.70000
   55    62    65    37.50000  110.70000
   57    55    56    33.00000  107.80000
   62    55    56    37.50000  110.70000
   62    55    57    37.50000  110.70000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   58    49    55    50.00000  118.00000
   58    66    67    37.50000  110.70000
   58    66    68    37.50000  110.70000
   58    66    69    37.50000  110.70000
   60    58    59    33.00000  107.80000
   66    58    59    37.50000  110.70000
   66    58    60    37.50000  110.70000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    70  -0.16000  1.0 1.0
   29    33    38    70  -0.03200 -1.0 2.0
   29    33    38    70   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    46   3.62500 -1.0 2.0
   33    38    70    61   3.62500 -1.0 2.0
   33    38    70    71   3.62500 -1.0 2.0
   33    39    43    47   0.00000  1.0 1.0
   33    39    44    45   0.30150 -1.0 2.0
   33    39    44    49   1.39750  1.0 1.0
   33    39    44    49  -0.07950 -1.0 2.0
   33    39    44    49  -0.18750  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    70   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43   0.15000  1.0 3.0
   34    33    39    44  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43   0.56750  1.0 1.0
   38    33    39    43  -0.07550 -1.0 2.0
   38    33    39    43   0.20000  1.0 3.0
   38    33    39    44   0.56750  1.0 1.0
   38    33    39    44  -0.07550 -1.0 2.0
   38    33    39    44   0.20000  1.0 3.0
   38    41    46    50   3.62500 -1.0 2.0
   38    41    46    52   3.62500 -1.0 2.0
   41    38    70    61   3.62500 -1.0 2.0
   41    38    70    71   3.62500 -1.0 2.0
   41    46    50    51   3.62500 -1.0 2.0
   41    46   -50    61   3.62500 -1.0 2.0
   41    46    52    53   0.69950 -1.0 2.0
   41    46    52    54   0.69950 -1.0 2.0
   42    41    46    50   3.62500 -1.0 2.0
   42    41    46    52   3.62500 -1.0 2.0
   46    50    61    70   3.62500 -1.0 2.0
   46    50    61    72   3.62500 -1.0 2.0
   50    46    52    53   0.69950 -1.0 2.0
   50    46    52    54   0.69950 -1.0 2.0
   50    61   -70    38   3.62500 -1.0 2.0
   50    61    70    71   3.62500 -1.0 2.0
   50    61    72    73   0.84100 -1.0 2.0
   51    50    61    70   3.62500 -1.0 2.0
   51    50    61    72   3.62500 -1.0 2.0
   70    38    41    42   3.62500 -1.0 2.0
   70    38   -41    46   3.62500 -1.0 2.0
   70    61    72    73   0.84100 -1.0 2.0
   72    61    70    38   3.62500 -1.0 2.0
   72    61    70    71   3.62500 -1.0 2.0
   52    46    50    51   3.62500 -1.0 2.0
   52    46    50    61   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    70   0.04150 -1.0 2.0
   39    43    47    48   0.00000  1.0 1.0
   39    44    49    55   1.49850  1.0 1.0
   39    44    49    55   1.53950 -1.0 2.0
   39    44    49    58   1.49850  1.0 1.0
   39    44    49    58   1.53950 -1.0 2.0
   40    39    43    47   0.00000  1.0 1.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    49   0.00000  1.0 1.0
   43    39    44    45   0.30150 -1.0 2.0
   43    39    44    49   0.00000  1.0 1.0
   44    39    43    47   0.00000  1.0 1.0
   44    49    55    56   0.00000  1.0 1.0
   44    49    55    57   0.00000  1.0 1.0
   44    49    55    62  -0.43950  1.0 1.0
   44    49    55    62  -0.08100 -1.0 2.0
   44    49    55    62   0.03350  1.0 3.0
   44    49    58    59   0.00000  1.0 1.0
   44    49    58    60   0.00000  1.0 1.0
   44    49    58    66  -0.43950  1.0 1.0
   44    49    58    66  -0.08100 -1.0 2.0
   44    49    58    66   0.03350  1.0 3.0
   45    44    49    55   3.04450 -1.0 2.0
   45    44    49    58   3.04450 -1.0 2.0
   49    55    62    63   0.15000  1.0 3.0
   49    55    62    64   0.15000  1.0 3.0
   49    55    62    65   0.15000  1.0 3.0
   49    58    66    67   0.15000  1.0 3.0
   49    58    66    68   0.15000  1.0 3.0
   49    58    66    69   0.15000  1.0 3.0
   55    49    58    59   0.00000  1.0 1.0
   55    49    58    60   0.00000  1.0 1.0
   55    49    58    66  -0.05900 -1.0 2.0
   56    55    62    63   0.15000  1.0 3.0
   56    55    62    64   0.15000  1.0 3.0
   56    55    62    65   0.15000  1.0 3.0
   57    55    62    63   0.15000  1.0 3.0
   57    55    62    64   0.15000  1.0 3.0
   57    55    62    65   0.15000  1.0 3.0
   58    49    55    56   0.00000  1.0 1.0
   58    49    55    57   0.00000  1.0 1.0
   58    49    55    62  -0.05900 -1.0 2.0
   59    58    66    67   0.15000  1.0 3.0
   59    58    66    68   0.15000  1.0 3.0
   59    58    66    69   0.15000  1.0 3.0
   60    58    66    67   0.15000  1.0 3.0
   60    58    66    68   0.15000  1.0 3.0
   60    58    66    69   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
   41    70    38    33   4.00000 -1.0 2.0
   46    42    41    38   1.10000 -1.0 2.0
   50    52    46    41   4.00000 -1.0 2.0
   61    51    50    46   4.00000 -1.0 2.0
   70    72    61    50   4.00000 -1.0 2.0
   61    71    70    38   1.10000 -1.0 2.0
   53    46    52    54  10.50000 -1.0 2.0
   39    49    44    45  10.50000 -1.0 2.0
   58    44    49    55   1.00000 -1.0 2.0
END
