* LIGAND DATABASE FILE (OPLS2005)
*
001      73    73    127    191     373
    1     0 S   NP   _N1_     1    28.86867    93.02493   -21.47566
    2     1 S   H    _HN1     2     1.02832    24.37354   136.41808
    3     1 S   H    _H1_     3     1.02782    92.16729   -92.21753
    4     1 S   H    _H2_     4     1.02951    95.55671    16.45352
    5     1 S   CT   _CA1     5     1.50110   134.99376   142.83559
    6     5 S   HC   _HA1     6     1.09573   105.21461    56.31013
    7     5 S   CO3  _C1_     7     1.53768   112.44065   -63.89086
    8     7 S   O2Z  _O11     8     1.26369   115.03203   -42.78038
    9     7 S   O2Z  _O12     9     1.26241   114.97920   136.52799
   10     5 S   CT   _CB1    10     1.53113   107.43137   174.25144
   11    10 S   HC   HB11    11     1.09820   109.35129   -50.20841
   12    10 S   HC   HB12    12     1.09820   110.44095    66.40224
   13    10 S   CT   _CG1    13     1.52967   112.61315  -171.28028
   14    13 S   HC   HG11    14     1.09525   110.37027   -64.45464
   15    13 S   HC   HG12    15     1.09656   109.98802    54.72810
   16    13 S   C    _CD1    16     1.51792   112.43133   175.12930
   17    16 S   O    _OE1    17     1.22721   123.30964    -1.24867
   18    16 S   N    _N2_    18     1.38608   111.57462   178.83736
   19    18 S   H    _HN2    19     1.01617   118.95226     0.67493
   20    18 S   CT1  _CA2    20     1.46281   123.51232   179.62675
   21    20 S   HC   _HA2    21     1.09733   109.36998   -10.46529
   22    20 S   C    _C2_    22     1.53379   108.42474  -126.05066
   23    22 S   O    _O2_    23     1.23032   122.37113  -148.20526
   24    20 S   CT   _CB2    32     1.53330   111.24401   111.69115
   25    24 S   HC   HB21    33     1.09522   109.48461    54.29179
   26    24 S   HC   HB22    34     1.09493   110.91686   173.32156
   27    22 S   N    _N3_    24     1.38369   113.47065    39.35159
   28    27 S   H    _HN3    25     1.01646   119.49472    -3.66084
   29    24 S   S    _SG2    35     1.82657   111.25868   -67.03537
   30    27 S   CT   _CA3    26     1.45288   123.10570   176.93190
   31    30 S   HC   HA31    27     1.09552   107.54521   -63.44218
   32    30 S   HC   HA32    28     1.09559   107.91880    52.95372
   33    29 S   CT   _C17    36     1.85313    99.82533   163.09699
   34    33 S   HC   _H3_    37     1.09724   107.93579    -2.90421
   35    30 S   CO3  _C3_    29     1.52930   114.15838   174.94623
   36    35 S   O2Z  _O31    30     1.26363   116.06260    -0.04423
   37    35 S   O2Z  _O32    31     1.26431   114.41141  -180.00000
   38    33 S   CA   _C7_    38     1.52417   108.56121   113.84807
   39    33 S   CT   _C16    53     1.55643   109.51721  -120.67088
   40    39 S   HC   _H36    54     1.09170   108.46468   -58.68205
   41    38 S   CA   _C5_    39     1.40539   121.94414    71.73715
   42    41 S   HA   _H24    40     1.08745   120.22829    -0.49850
   43    39 S   CZ   _C4_    55     1.47907   110.55490  -177.77472
   44    43 S   NZ   _N15    56     1.16041   179.65850    89.13701
   45    39 S   C    _C11    57     1.53749   111.16145    63.67548
   46    45 S   O    _O19    58     1.23658   119.51731    40.85355
   47    41 S   CA   _C8_    41     1.39919   119.68767  -179.65793
   48    45 S   N    _N16    59     1.39858   118.15912  -140.74283
   49    47 S   CA   _C10    42     1.39177   121.58893    -0.16313
   50    47 S   NO2  _N17    50     1.44672   118.03538   179.80923
   51    50 S   ON   _O18    51     1.23785   117.40441  -123.95920
   52    50 S   ON   _O20    52     1.23827   116.97527    54.99387
   53    48 S   CT   _C14    60     1.46677   118.38417   178.06852
   54    53 S   HC   _H32    61     1.09436   108.90334  -147.53586
   55    53 S   HC   _H33    62     1.09569   109.31086   -30.65570
   56    48 S   CT   _C15    67     1.46886   125.48790    -2.91591
   57    56 S   HC   _H34    68     1.09593   108.56574  -147.24116
   58    56 S   HC   _H35    69     1.09312   110.08291   -31.29462
   59    49 S   CA   _C9_    43     1.39173   118.69359     0.53119
   60    49 S   OH   _O22    48     1.36538   121.08274  -178.64737
   61    60 S   HO   _H39    49     0.97439   107.46920  -179.91844
   62    53 S   CT   _C12    63     1.52035   111.75445    90.17683
   63    62 S   HC   _H26    64     1.09489   111.08566   -59.62652
   64    62 S   HC   _H27    65     1.09464   111.20174    60.31116
   65    62 S   HC   _H28    66     1.09428   110.29825  -179.65452
   66    56 S   CT   _C13    70     1.52097   111.74692    91.48202
   67    66 S   HC   _H29    71     1.09390   111.50026   -60.30382
   68    66 S   HC   _H30    72     1.09441   111.12391    59.55808
   69    66 S   HC   _H31    73     1.09422   110.28034   179.48871
   70    38 S   CA   _C6_    44     1.40745   119.32095  -107.46755
   71    70 S   HA   _H25    45     1.08771   119.80735    -0.28939
   72    59 S   OH   _O21    46     1.36818   118.53340   179.88297
   73    72 S   HO   _H38    47     0.97278   108.69151   179.91844
  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  10   5  10   4   4   1  10   3   9  14
  10   4   1   1  10   6   5   7   5   4   6   3   1   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    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    47    59    70    71    39    40    43    44    45    46    48  
   38    41    70    39    40    43    45  
   36    37  
   37  
    0  
   41    42    47    49    59    70    71    72    50    39    40    43    45  
   40    43    44    45    46    48    53    56    41    70  
   43    44    45    46    48  
   42    47    49    59    70    71    60    50    51    52  
   47    49    70    50  
   44    45    46    48  
   45  
   46    48    53    54    55    62    56    57    58    66  
   48    53    56  
   49    59    70    72    60    61    50    51    52  
   53    54    55    62    63    64    65    56    57    58    66    67    68    69  
   59    70    71    72    73    60    61    50    51    52  
   51    52    59    60  
   52  
    0  
   54    55    62    63    64    65    56    57    58    66  
   55    62    63    64    65    56  
   62    63    64    65    56  
   57    58    66    67    68    69    62  
   58    66    67    68    69  
   66    67    68    69  
   70    71    72    73    60    61  
   61    70    72  
    0  
   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   3.3000   0.0660   0.040000   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   3.3000   0.0660   0.460000   2.0580   1.8250   0.025318638  -1.264311570
   44   3.2800   0.1700  -0.560000   2.2500   2.0000   0.024786691  -1.117108600
   45   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.2500   0.1700  -0.140000   1.8100   1.6000   0.054801302  -1.445846770
   49   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   50   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   51   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   52   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   53   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   59   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   60   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   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    47   469.000  1.400
   47    49   469.000  1.400
   47    50   400.000  1.460
   49    59   469.000  1.400
   49    60   450.000  1.364
   59    70   469.000  1.400
   59    72   450.000  1.364
   70    71   367.000  1.080
   72    73   553.000  0.945
   60    61   553.000  0.945
   50    51   550.000  1.225
   50    52   550.000  1.225
   39    40   340.000  1.090
   39    43   390.000  1.470
   39    45   317.000  1.522
   43    44   650.000  1.157
   45    46   570.000  1.229
   45    48   490.000  1.335
   48    53   337.000  1.449
   48    56   337.000  1.449
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    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    45    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    47    63.00000  120.00000
   38    70    59    63.00000  120.00000
   38    70    71    35.00000  120.00000
   41    47    49    63.00000  120.00000
   41    47    50    85.00000  120.00000
   47    41    42    35.00000  120.00000
   47    49    59    63.00000  120.00000
   47    49    60    70.00000  120.00000
   47    50    51    80.00000  117.50000
   47    50    52    80.00000  117.50000
   49    59    70    63.00000  120.00000
   49    59    72    70.00000  120.00000
   49    60    61    35.00000  113.00000
   59    70    71    35.00000  120.00000
   59    72    73    35.00000  113.00000
   70    38    41    63.00000  120.00000
   72    59    70    70.00000  120.00000
   60    49    59    70.00000  120.00000
   50    47    49    85.00000  120.00000
   52    50    51    80.00000  125.30000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    44   150.00000  180.00000
   39    45    46    80.00000  120.40000
   39    45    48    70.00000  116.60000
   43    39    40    35.00000  108.50000
   45    39    40    35.00000  109.50000
   45    39    43    70.00000  111.78000
   45    48    53    50.00000  121.90000
   45    48    56    50.00000  121.90000
   48    45    46    80.00000  122.90000
   48    53    54    35.00000  109.50000
   48    53    55    35.00000  109.50000
   48    53    62    70.00000  110.72300
   48    56    57    35.00000  109.50000
   48    56    58    35.00000  109.50000
   48    56    66    70.00000  110.72300
   53    62    63    37.50000  110.70000
   53    62    64    37.50000  110.70000
   53    62    65    37.50000  110.70000
   55    53    54    33.00000  107.80000
   62    53    54    37.50000  110.70000
   62    53    55    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
   56    48    53    50.00000  118.00000
   56    66    67    37.50000  110.70000
   56    66    68    37.50000  110.70000
   56    66    69    37.50000  110.70000
   58    56    57    33.00000  107.80000
   66    56    57    37.50000  110.70000
   66    56    58    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    45   0.56750  1.0 1.0
   29    33    39    45  -0.07550 -1.0 2.0
   29    33    39    45   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    47   3.62500 -1.0 2.0
   33    38    70    59   3.62500 -1.0 2.0
   33    38    70    71   3.62500 -1.0 2.0
   33    39    43    44   0.00000  1.0 1.0
   33    39    45    46   0.30150 -1.0 2.0
   33    39    45    48   1.39750  1.0 1.0
   33    39    45    48  -0.07950 -1.0 2.0
   33    39    45    48  -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    45  -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    45   0.56750  1.0 1.0
   38    33    39    45  -0.07550 -1.0 2.0
   38    33    39    45   0.20000  1.0 3.0
   38    41    47    49   3.62500 -1.0 2.0
   38    41    47    50   3.62500 -1.0 2.0
   41    38    70    59   3.62500 -1.0 2.0
   41    38    70    71   3.62500 -1.0 2.0
   41    47   -49    59   3.62500 -1.0 2.0
   41    47    49    60   3.62500 -1.0 2.0
   41    47    50    51   0.69950 -1.0 2.0
   41    47    50    52   0.69950 -1.0 2.0
   42    41    47    49   3.62500 -1.0 2.0
   42    41    47    50   3.62500 -1.0 2.0
   47    49    59    70   3.62500 -1.0 2.0
   47    49    59    72   3.62500 -1.0 2.0
   47    49    60    61   0.84100 -1.0 2.0
   49    47    50    51   0.69950 -1.0 2.0
   49    47    50    52   0.69950 -1.0 2.0
   49    59   -70    38   3.62500 -1.0 2.0
   49    59    70    71   3.62500 -1.0 2.0
   49    59    72    73   0.84100 -1.0 2.0
   59    49    60    61   0.84100 -1.0 2.0
   70    38    41    42   3.62500 -1.0 2.0
   70    38   -41    47   3.62500 -1.0 2.0
   70    59    72    73   0.84100 -1.0 2.0
   72    59    70    38   3.62500 -1.0 2.0
   72    59    70    71   3.62500 -1.0 2.0
   60    49    59    70   3.62500 -1.0 2.0
   60    49    59    72   3.62500 -1.0 2.0
   50    47    49    59   3.62500 -1.0 2.0
   50    47    49    60   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    45    48    53   1.49850  1.0 1.0
   39    45    48    53   1.53950 -1.0 2.0
   39    45    48    56   1.49850  1.0 1.0
   39    45    48    56   1.53950 -1.0 2.0
   40    39    43    44   0.00000  1.0 1.0
   40    39    45    46   0.00000  1.0 1.0
   40    39    45    48   0.00000  1.0 1.0
   43    39    45    46   0.30150 -1.0 2.0
   43    39    45    48   0.00000  1.0 1.0
   45    39    43    44   0.00000  1.0 1.0
   45    48    53    54   0.00000  1.0 1.0
   45    48    53    55   0.00000  1.0 1.0
   45    48    53    62  -0.43950  1.0 1.0
   45    48    53    62  -0.08100 -1.0 2.0
   45    48    53    62   0.03350  1.0 3.0
   45    48    56    57   0.00000  1.0 1.0
   45    48    56    58   0.00000  1.0 1.0
   45    48    56    66  -0.43950  1.0 1.0
   45    48    56    66  -0.08100 -1.0 2.0
   45    48    56    66   0.03350  1.0 3.0
   46    45    48    53   3.04450 -1.0 2.0
   46    45    48    56   3.04450 -1.0 2.0
   48    53    62    63   0.15000  1.0 3.0
   48    53    62    64   0.15000  1.0 3.0
   48    53    62    65   0.15000  1.0 3.0
   48    56    66    67   0.15000  1.0 3.0
   48    56    66    68   0.15000  1.0 3.0
   48    56    66    69   0.15000  1.0 3.0
   53    48    56    57   0.00000  1.0 1.0
   53    48    56    58   0.00000  1.0 1.0
   53    48    56    66  -0.05900 -1.0 2.0
   54    53    62    63   0.15000  1.0 3.0
   54    53    62    64   0.15000  1.0 3.0
   54    53    62    65   0.15000  1.0 3.0
   55    53    62    63   0.15000  1.0 3.0
   55    53    62    64   0.15000  1.0 3.0
   55    53    62    65   0.15000  1.0 3.0
   56    48    53    54   0.00000  1.0 1.0
   56    48    53    55   0.00000  1.0 1.0
   56    48    53    62  -0.05900 -1.0 2.0
   57    56    66    67   0.15000  1.0 3.0
   57    56    66    68   0.15000  1.0 3.0
   57    56    66    69   0.15000  1.0 3.0
   58    56    66    67   0.15000  1.0 3.0
   58    56    66    68   0.15000  1.0 3.0
   58    56    66    69   0.15000  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    35    36  10.50000 -1.0 2.0
   41    70    38    33   4.00000 -1.0 2.0
   47    42    41    38   1.10000 -1.0 2.0
   49    50    47    41   4.00000 -1.0 2.0
   59    60    49    47   4.00000 -1.0 2.0
   70    72    59    49   4.00000 -1.0 2.0
   59    71    70    38   1.10000 -1.0 2.0
   52    47    50    51  10.50000 -1.0 2.0
   39    48    45    46  10.50000 -1.0 2.0
   56    45    48    53   1.00000 -1.0 2.0
END
