* LIGAND DATABASE FILE (OPLS2005)
*
001      67    67    119    181     354
    1     0 S   NP   _N1_     1    28.48149    97.83017   -20.87583
    2     1 S   H    _HN1     2     1.02777   101.38112  -132.34273
    3     1 S   H    _H1_     3     1.02947    68.24709   -27.01494
    4     1 S   H    _H2_     4     1.02834    43.98285   123.65468
    5     1 S   CT   _CA1     5     1.50182   144.22694    68.12672
    6     5 S   HC   _HA1     6     1.09580   105.17874    97.38729
    7     5 S   CO3  _C1_     7     1.53828   111.86821   -22.63211
    8     7 S   O2Z  _O11     8     1.26374   115.03972   -53.09637
    9     7 S   O2Z  _O12     9     1.26209   114.91687   125.31502
   10     5 S   CT   _CB1    10     1.53062   107.30681  -144.92205
   11    10 S   HC   HB11    11     1.09839   109.45565   -49.57027
   12    10 S   HC   HB12    12     1.09804   110.49555    67.00737
   13    10 S   CT   _CG1    13     1.53009   112.56657  -170.45492
   14    13 S   HC   HG11    14     1.09588   110.61077   -63.67150
   15    13 S   HC   HG12    15     1.09656   109.82430    55.54113
   16    13 S   C    _CD1    16     1.51861   111.99407   176.06577
   17    16 S   O    _OE1    17     1.22812   123.21657     7.71251
   18    16 S   N    _N2_    18     1.38424   111.97219  -172.59766
   19    18 S   H    _HN2    19     1.02026   119.13649     0.13122
   20    18 S   CT1  _CA2    20     1.45840   122.81204  -179.55413
   21    20 S   HC   _HA2    21     1.09741   108.38283    34.12337
   22    20 S   C    _C2_    22     1.52994   107.47230   -83.21905
   23    22 S   O    _O2_    23     1.22980   123.17873   -27.79818
   24    20 S   CT   _CB2    32     1.53223   112.26106   157.00695
   25    24 S   HC   HB21    33     1.09335   109.61493    59.59993
   26    24 S   HC   HB22    34     1.09535   110.43343   177.82543
   27    22 S   N    _N3_    24     1.38566   112.55743   154.70371
   28    27 S   H    _HN3    25     1.01651   120.34412    -1.61713
   29    24 S   S    _SG2    35     1.82531   111.07711   -62.28213
   30    27 S   CT   _CA3    26     1.45350   122.37145   178.80417
   31    30 S   HC   HA31    27     1.09569   107.62656   -59.40202
   32    30 S   HC   HA32    28     1.09569   107.75350    56.87826
   33    29 S   CT   _C10    36     1.85093   100.00408   167.07058
   34    33 S   HC   _H5_    37     1.09609   107.21312    29.17808
   35    30 S   CO3  _C3_    29     1.52870   114.45538   178.75306
   36    35 S   O2Z  _O31    30     1.26321   116.12634    -1.45455
   37    35 S   O2Z  _O32    31     1.26459   114.39298   178.58307
   38    33 S   CT   _C9_    38     1.54132   107.66275   148.30359
   39    38 S   HC   _H4_    39     1.09959   109.43221    52.66742
   40    38 S   CT   _C8_    40     1.53899   112.21523   172.50203
   41    40 S   HC   _H10    41     1.09801   110.18863    69.23233
   42    40 S   HC   _H11    42     1.09824   109.05781  -174.05891
   43    38 S   CO3  _C13    65     1.54392   114.42453   -69.30344
   44    43 S   O2Z  _O42    66     1.26303   116.23997   -35.87637
   45    43 S   O2Z  _O41    67     1.26527   114.55847   144.61442
   46    40 S   CT   _C7_    43     1.53542   112.61980   -53.05364
   47    46 S   HC   _H3_    44     1.09807   106.84325   174.04089
   48    46 S   CT   _C12    45     1.53434   110.29574    54.59088
   49    48 S   HC   _H7_    46     1.09546   110.88204  -177.77718
   50    46 S   OS   _O35    57     1.43585   107.89773   -66.15618
   51    33 S   CT   _C11    47     1.54409   109.99274   -90.28267
   52    51 S   HC   _H6_    48     1.09810   109.68629   -52.21176
   53    48 S   OH   _O36    55     1.43138   109.09324    64.99913
   54    53 S   HO   _H12    56     0.97232   107.28694    62.41520
   55    50 S   CM   _C5_    58     1.38250   112.96474  -153.29677
   56    51 S   OS   _O37    49     1.42879   110.19583    68.06430
   57    55 S   CM   _C4_    59     1.33745   120.60997  -117.76019
   58    57 S   HC   _H8_    60     1.08533   120.57654     3.02653
   59    57 S   HC   _H9_    61     1.08444   121.95706  -177.28697
   60    55 S   CO3  _C6_    62     1.54456   118.58768    67.42856
   61    60 S   O2Z  _O34    63     1.26505   115.85910  -150.99549
   62    60 S   O2Z  _O33    64     1.26550   115.11406    28.65288
   63    56 S   P2   _P1_    50     1.63008   119.14554  -134.46741
   64    63 S   O2Z  _O40    51     1.51141   109.18823    75.52756
   65    63 S   O2Z  _O38    52     1.51084   109.78004   -59.79470
   66    63 S   OS   _O39    53     1.63020    98.39911  -172.46951
   67    66 S   HO   _H13    54     0.97852   116.23759  -175.43391
  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
  17   8   2   1   1  14   8  13   6   5   4   1   1  12   6   9
   6   9   8   3   2   1   6   5   5   2   1   2   1   1   4   3
   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    51    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    48    51    52    56    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    46    48    49    51    52    56    63    53    43    44    45  
   38    39    40    48    51    52    56    43  
   36    37  
   37  
    0  
   39    40    41    42    46    47    48    51    52    56    50    43    44    45  
   40    41    42    46    51    43    44    45  
   41    42    46    47    48    49    51    53    50    55    43    44    45  
   42    46    47    48    50    43  
   46    47    48    50    43  
   44    45    46    51  
   45  
    0  
   47    48    49    51    52    56    53    54    50    55    57    60  
   48    49    51    53    50    55  
   49    51    52    56    63    53    54    50    55  
   51    52    56    53    54    50  
   55    57    58    59    60    61    62    51    53  
   52    56    63    64    65    66    53    54  
   56    63    53  
   54    56  
    0  
   57    58    59    60    61    62  
   63    64    65    66    67  
   58    59    60    61    62  
   59    60  
   60  
   61    62  
   62  
    0  
   64    65    66    67  
   65    66    67  
   66    67  
   67  
    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  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   51   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5500   0.0760  -0.225300   2.0020   1.7750   0.023028004  -0.852763146
   56   2.8500   0.1400  -0.610000   1.5900   1.4000   0.020110767  -0.896042159
   57   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   63   3.7400   0.2000   1.662500   2.1070   1.8700   0.005000000   0.000000000
   64   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   65   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   66   2.8500   0.1400  -0.692500   1.7660   1.5600   0.021068034  -0.322181743
   67   0.5000   0.0300   0.380000   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    51   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    43   317.000  1.522
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    46   268.000  1.529
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    50   320.000  1.410
   48    49   340.000  1.090
   48    51   268.000  1.529
   48    53   320.000  1.410
   51    52   340.000  1.090
   51    56   320.000  1.410
   56    63   230.000  1.697
   63    64   525.000  1.480
   63    65   525.000  1.480
   63    66   230.000  1.697
   66    67   553.000  0.945
   53    54   553.000  0.945
   50    55   440.000  1.360
   55    57   549.000  1.340
   55    60   230.000  1.545
   57    58   340.000  1.080
   57    59   340.000  1.080
   60    61   656.000  1.250
   60    62   656.000  1.250
   43    44   656.000  1.250
   43    45   656.000  1.250
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    51    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    43    70.00000  109.69300
   33    51    48    58.35000  112.70000
   33    51    52    37.50000  110.70000
   33    51    56    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    42    37.50000  110.70000
   38    40    46    58.35000  112.70000
   38    43    44    70.00000  117.00000
   38    43    45    70.00000  117.00000
   40    38    39    37.50000  110.70000
   40    46    47    37.50000  110.70000
   40    46    48    58.35000  112.70000
   40    46    50    50.00000  109.50000
   42    40    41    33.00000  107.80000
   46    40    41    37.50000  110.70000
   46    40    42    37.50000  110.70000
   46    48    49    37.50000  110.70000
   46    48    51    58.35000  112.70000
   46    48    53    50.00000  109.50000
   46    50    55    90.00000  111.18400
   48    46    47    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    56    50.00000  109.50000
   48    53    54    55.00000  108.50000
   51    33    34    37.50000  110.70000
   51    33    38    58.35000  112.70000
   51    48    49    37.50000  110.70000
   51    56    63   100.00000  120.50000
   56    51    52    35.00000  109.50000
   56    63    64   100.00000  108.23000
   56    63    65   100.00000  108.23000
   56    63    66    45.00000  102.60000
   63    66    67    45.00000  108.50000
   65    63    64   140.00000  119.90000
   66    63    64   100.00000  108.23000
   66    63    65   100.00000  108.23000
   53    48    49    35.00000  109.50000
   53    48    51    50.00000  109.50000
   50    46    47    35.00000  109.50000
   50    46    48    50.00000  109.50000
   50    55    57    80.00000  120.01400
   50    55    60    80.00000  119.00000
   55    57    58    35.00000  120.00000
   55    57    59    35.00000  120.00000
   55    60    61    85.00000  113.83300
   55    60    62    85.00000  113.83300
   59    57    58    35.00000  117.00000
   60    55    57    55.00000  124.75400
   62    60    61    80.00000  126.00000
   43    38    39    35.00000  109.50000
   43    38    40    70.00000  109.69300
   45    43    44    80.00000  126.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  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    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   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   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    51    48   0.44750  1.0 1.0
   29    33    51    48  -0.17800 -1.0 2.0
   29    33    51    48   0.20200  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    56   0.56750  1.0 1.0
   29    33    51    56  -0.07550 -1.0 2.0
   29    33    51    56   0.20000  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    42   0.15000  1.0 3.0
   33    38    40    46   0.56750  1.0 1.0
   33    38    40    46  -0.07550 -1.0 2.0
   33    38    40    46   0.20000  1.0 3.0
   33    38    43    44   0.41150 -1.0 2.0
   33    38    43    45   0.41150 -1.0 2.0
   33    51    56    63  -2.65550  1.0 1.0
   33    51    56    63  -0.22350 -1.0 2.0
   33    51    56    63   0.24150  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    43  -0.11250  1.0 3.0
   34    33    51    48   0.15000  1.0 3.0
   34    33    51    52   0.15000  1.0 3.0
   34    33    51    56   0.23400  1.0 3.0
   38    33    51    48   0.56750  1.0 1.0
   38    33    51    48  -0.07550 -1.0 2.0
   38    33    51    48   0.20000  1.0 3.0
   38    33    51    52   0.15000  1.0 3.0
   38    33    51    56   0.62750  1.0 1.0
   38    33    51    56  -0.30950 -1.0 2.0
   38    33    51    56   0.27300  1.0 3.0
   38    40    46    47   0.15000  1.0 3.0
   38    40   -46    48   0.56750  1.0 1.0
   38    40   -46    48  -0.07550 -1.0 2.0
   38    40   -46    48   0.20000  1.0 3.0
   38    40    46    50   0.62750  1.0 1.0
   38    40    46    50  -0.30950 -1.0 2.0
   38    40    46    50   0.27300  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    42   0.15000  1.0 3.0
   39    38    40    46   0.15000  1.0 3.0
   39    38    43    44   0.00000  1.0 1.0
   39    38    43    45   0.00000  1.0 1.0
   40    38    43    44   0.41150 -1.0 2.0
   40    38    43    45   0.41150 -1.0 2.0
   40    46    48    49   0.15000  1.0 3.0
   40    46    48    51   0.56750  1.0 1.0
   40    46    48    51  -0.07550 -1.0 2.0
   40    46    48    51   0.20000  1.0 3.0
   40    46    48    53   0.86500  1.0 1.0
   40    46    48    53  -0.17500 -1.0 2.0
   40    46    48    53   0.20800  1.0 3.0
   40    46    50    55  -0.46850  1.0 1.0
   40    46    50    55   0.09300 -1.0 2.0
   40    46    50    55  -0.12850  1.0 3.0
   41    40    46    47   0.15000  1.0 3.0
   41    40    46    48   0.15000  1.0 3.0
   41    40    46    50   0.23400  1.0 3.0
   42    40    46    47   0.15000  1.0 3.0
   42    40    46    48   0.15000  1.0 3.0
   42    40    46    50   0.23400  1.0 3.0
   46    48   -51    33   0.56750  1.0 1.0
   46    48   -51    33  -0.07550 -1.0 2.0
   46    48   -51    33   0.20000  1.0 3.0
   46    48    51    52   0.15000  1.0 3.0
   46    48    51    56   0.62750  1.0 1.0
   46    48    51    56  -0.30950 -1.0 2.0
   46    48    51    56   0.27300  1.0 3.0
   46    48    53    54  -0.11600  1.0 1.0
   46    48    53    54  -0.09450 -1.0 2.0
   46    48    53    54   0.21250  1.0 3.0
   46    50    55    57  -2.26850  1.0 1.0
   46    50    55    57   3.39050 -1.0 2.0
   46    50    55    60   0.15100 -1.0 2.0
   47    46    48    49   0.15000  1.0 3.0
   47    46    48    51   0.15000  1.0 3.0
   47    46    48    53   0.23400  1.0 3.0
   47    46    50    55   0.08050  1.0 3.0
   48    46    50    55  -0.46850  1.0 1.0
   48    46    50    55   0.09300 -1.0 2.0
   48    46    50    55  -0.12850  1.0 3.0
   48    51    56    63  -2.65550  1.0 1.0
   48    51    56    63  -0.22350 -1.0 2.0
   48    51    56    63   0.24150  1.0 3.0
   49    48    51    33   0.15000  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    56   0.23400  1.0 3.0
   49    48    53    54   0.19450  1.0 3.0
   51    33    38    39   0.15000  1.0 3.0
   51    33   -38    40   0.56750  1.0 1.0
   51    33   -38    40  -0.07550 -1.0 2.0
   51    33   -38    40   0.20000  1.0 3.0
   51    33    38    43  -1.63150  1.0 1.0
   51    33    38    43  -0.43550 -1.0 2.0
   51    33    38    43   0.24500  1.0 3.0
   51    48    53    54  -0.11600  1.0 1.0
   51    48    53    54  -0.09450 -1.0 2.0
   51    48    53    54   0.21250  1.0 3.0
   51    56    63    64   0.00000  1.0 1.0
   51    56    63    65   0.00000  1.0 1.0
   51    56    63    66   0.05050  1.0 1.0
   51    56    63    66  -1.30700 -1.0 2.0
   51    56    63    66   0.91550  1.0 3.0
   52    51    56    63   0.03000  1.0 3.0
   56    63    66    67   0.00000  1.0 1.0
   64    63    66    67   0.00000  1.0 1.0
   65    63    66    67   0.00000  1.0 1.0
   53    48    51    33   0.86500  1.0 1.0
   53    48    51    33  -0.17500 -1.0 2.0
   53    48    51    33   0.20800  1.0 3.0
   53    48    51    52   0.23400  1.0 3.0
   53    48    51    56   3.69350  1.0 1.0
   53    48    51    56  -1.82950 -1.0 2.0
   50    46    48    49   0.23400  1.0 3.0
   50    46    48    51   0.62750  1.0 1.0
   50    46    48    51  -0.30950 -1.0 2.0
   50    46    48    51   0.27300  1.0 3.0
   50    46    48    53   3.69350  1.0 1.0
   50    46    48    53  -1.82950 -1.0 2.0
   50    55    57    58   7.00000 -1.0 2.0
   50    55    57    59   7.00000 -1.0 2.0
   50    55    60    61  -0.11900  1.0 1.0
   50    55    60    61   0.76850 -1.0 2.0
   50    55    60    61   0.14100  1.0 3.0
   50    55    60    62  -0.11900  1.0 1.0
   50    55    60    62   0.76850 -1.0 2.0
   50    55    60    62   0.14100  1.0 3.0
   57    55    60    61  -0.04000 -1.0 2.0
   57    55    60    61  -0.29050  1.0 3.0
   57    55    60    62  -0.04000 -1.0 2.0
   57    55    60    62  -0.29050  1.0 3.0
   60    55    57    58   7.00000 -1.0 2.0
   60    55    57    59   7.00000 -1.0 2.0
   43    38    40    41  -0.11250  1.0 3.0
   43    38    40    42  -0.11250  1.0 3.0
   43    38    40    46  -1.63150  1.0 1.0
   43    38    40    46  -0.43550 -1.0 2.0
   43    38    40    46   0.24500  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
   50    60    55    57  15.00000 -1.0 2.0
   58    59    57    55  15.00000 -1.0 2.0
   61    55    60    62  10.50000 -1.0 2.0
   44    38    43    45  10.50000 -1.0 2.0
END
