* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    115    175     339
    1     0 S   NP   _N1_     1    28.83879    96.20283   -21.95320
    2     1 S   H    _HN1     2     1.02950    75.36847    13.61027
    3     1 S   H    _H1_     3     1.02828    40.62272   154.00437
    4     1 S   H    _H2_     4     1.02784    94.93741   -94.10185
    5     1 S   CT   _CA1     5     1.50108   147.46377   118.71908
    6     5 S   HC   _HA1     6     1.09572   105.20543    82.94917
    7     5 S   CO3  _C1_     7     1.53795   112.46107   -37.29944
    8     7 S   O2Z  _O11     8     1.26371   115.00961   -42.57479
    9     7 S   O2Z  _O12     9     1.26241   114.94838   136.59415
   10     5 S   CT   _CB1    10     1.53083   107.42432  -159.05843
   11    10 S   HC   HB11    11     1.09831   109.39318   -49.75519
   12    10 S   HC   HB12    12     1.09813   110.43587    66.85933
   13    10 S   CT   _CG1    13     1.52980   112.59389  -170.74305
   14    13 S   HC   HG11    14     1.09586   110.60040   -65.05066
   15    13 S   HC   HG12    15     1.09669   109.81857    54.17709
   16    13 S   C    _CD1    16     1.51794   112.27542   174.63699
   17    16 S   O    _OE1    17     1.22724   123.31174     5.35617
   18    16 S   N    _N2_    18     1.38644   111.62453  -174.75764
   19    18 S   H    _HN2    19     1.01582   118.92903     1.88138
   20    18 S   CT1  _CA2    20     1.46212   123.41731   178.05187
   21    20 S   HC   _HA2    21     1.09737   109.40585     1.20528
   22    20 S   C    _C2_    22     1.53535   108.54190  -114.28342
   23    22 S   O    _O2_    23     1.23054   122.29492  -147.78220
   24    20 S   CT   _CB2    32     1.53506   111.50789   123.26756
   25    24 S   HC   HB21    33     1.09421   109.42369    56.28215
   26    24 S   HC   HB22    34     1.09365   109.66623   175.13611
   27    22 S   N    _N3_    24     1.38333   113.66918    39.66022
   28    27 S   H    _HN3    25     1.01594   119.57494    -3.35456
   29    24 S   S    _SG2    35     1.83056   111.00476   -65.10747
   30    27 S   CT   _CA3    26     1.45287   123.19895   177.11100
   31    30 S   HC   HA31    27     1.09549   107.51126   -64.48068
   32    30 S   HC   HA32    28     1.09557   107.97959    51.95187
   33    29 S   CT   _C5_    36     1.86201   102.38302   172.41742
   34    30 S   CO3  _C3_    29     1.52956   114.09044   173.94673
   35    34 S   O2Z  _O31    30     1.26374   116.06784    -0.72685
   36    34 S   O2Z  _O32    31     1.26428   114.41238   179.33324
   37    33 S   CT   _C6_    37     1.53662   110.72932   -53.01225
   38    37 S   HC   _H7_    38     1.09402   113.07154    86.98382
   39    37 S   HC   _H8_    39     1.09508   113.10966   -38.86419
   40    33 S   CT   _C4_    59     1.54305   106.63277    66.58152
   41    40 S   HC   _H4_    60     1.09582   112.04272    56.07892
   42    40 S   HC   _H5_    61     1.09527   112.02186   -64.78160
   43    40 S   HC   _H6_    62     1.09136   112.17073   176.90782
   44    37 S   CO4  _C7_    40     1.50503   103.02276  -154.76433
   45    44 S   O    _O33    41     1.22585   122.56797  -161.53845
   46    44 S   CT   _C8_    42     1.52028   113.19505    20.75693
   47    46 S   HC   _H3_    43     1.09693   106.52329   116.38351
   48    33 S   CT   _C9_    44     1.58724   112.66297  -168.09636
   49    46 S   CT   _C12    53     1.53014   111.10635  -124.57661
   50    49 S   HC   _H15    54     1.09591   110.35943   170.05100
   51    49 S   HC   _H16    55     1.09355   111.38398    50.77948
   52    48 S   CT   _C10    45     1.55817   112.72235    40.25898
   53    52 S   HC   _H9_    46     1.09500   112.17566   -69.92777
   54    52 S   HC   _H10    47     1.09711   110.61715   171.70689
   55    52 S   HC   _H11    48     1.09501   112.09655    52.07266
   56    48 S   CT   _C11    49     1.53985   112.90235   -80.15873
   57    56 S   HC   _H12    50     1.09564   111.10987    60.65327
   58    56 S   HC   _H13    51     1.09397   112.66681   -59.83527
   59    56 S   HC   _H14    52     1.09620   110.91280   179.93147
   60    49 S   CO3  _C13    56     1.53531   113.96119   -72.09559
   61    60 S   O2Z  _O35    57     1.26245   115.86408   -44.17231
   62    60 S   O2Z  _O34    58     1.26416   114.58816   137.36643
  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  13   5   4   3
  21   2   1   1  14   6   5   8   3   2   1  10   4  16   7  12
   7   4   3   7   3   2   1   3   2   1   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    48    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    44    46    48    52    56    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    44    45    46    47    48    52    53    54    55    56    57    58    59    49    40    41    42    43  
   35    36  
   36  
    0  
   38    39    44    45    46    47    48    52    56    49    40    41    42    43  
   39    44    45    46    48    40  
   44    45    46    48    40  
   41    42    43    44    46    48    52    56  
   42    43    48  
   43    48  
   48  
   45    46    47    48    52    56    49    50    51    60  
   46    47    48    49  
   47    48    52    53    54    55    56    57    58    59    49    50    51    60    61    62  
   48    52    56    49    50    51    60  
   52    53    54    55    56    57    58    59    49    50    51    60  
   50    51    60    61    62    52    56  
   51    60    61    62  
   60    61    62  
   53    54    55    56    57    58    59  
   54    55    56  
   55    56  
   56  
   57    58    59  
   58    59  
   59  
    0  
   61    62  
   62  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   49   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.7500   0.1050   0.700000   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
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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   268.000  1.529
   33    48   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    44   317.000  1.522
   44    45   570.000  1.229
   44    46   317.000  1.522
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    49   268.000  1.529
   48    52   268.000  1.529
   48    56   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    60   317.000  1.522
   60    61   656.000  1.250
   60    62   656.000  1.250
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  111.63000
   29    33    48    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    44    63.00000  111.10000
   33    48    46    58.35000  112.70000
   33    48    52    58.35000  112.70000
   33    48    56    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    80.00000  120.40000
   37    44    46    70.00000  116.00000
   39    37    38    33.00000  107.80000
   44    37    38    35.00000  109.50000
   44    37    39    35.00000  109.50000
   44    46    47    35.00000  109.50000
   44    46    48    63.00000  111.10000
   44    46    49    63.00000  111.10000
   46    44    45    80.00000  120.40000
   46    48    52    58.35000  112.70000
   46    48    56    58.35000  112.70000
   46    49    50    37.50000  110.70000
   46    49    51    37.50000  110.70000
   46    49    60    70.00000  109.69300
   48    33    37    58.35000  112.70000
   48    46    47    37.50000  110.70000
   48    52    53    37.50000  110.70000
   48    52    54    37.50000  110.70000
   48    52    55    37.50000  110.70000
   48    56    57    37.50000  110.70000
   48    56    58    37.50000  110.70000
   48    56    59    37.50000  110.70000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
   56    48    52    58.35000  112.70000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   49    46    47    37.50000  110.70000
   49    46    48    58.35000  112.70000
   49    60    61    70.00000  117.00000
   49    60    62    70.00000  117.00000
   51    49    50    33.00000  107.80000
   60    49    50    35.00000  109.50000
   60    49    51    35.00000  109.50000
   62    60    61    80.00000  126.00000
   40    33    37    58.35000  112.70000
   40    33    48    58.35000  112.70000
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    44   0.56750  1.0 1.0
   29    33    37    44  -0.07550 -1.0 2.0
   29    33    37    44   0.20000  1.0 3.0
   29    33    48    46   0.44750  1.0 1.0
   29    33    48    46  -0.17800 -1.0 2.0
   29    33    48    46   0.20200  1.0 3.0
   29    33    48    52   0.44750  1.0 1.0
   29    33    48    52  -0.17800 -1.0 2.0
   29    33    48    52   0.20200  1.0 3.0
   29    33    48    56   0.44750  1.0 1.0
   29    33    48    56  -0.17800 -1.0 2.0
   29    33    48    56   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    43   0.15000  1.0 3.0
   33    37    44    45   0.30150 -1.0 2.0
   33    37   -44    46   0.60050  1.0 1.0
   33    37   -44    46   0.05600 -1.0 2.0
   33    37   -44    46   0.26150  1.0 3.0
   33    48    52    53   0.15000  1.0 3.0
   33    48    52    54   0.15000  1.0 3.0
   33    48    52    55   0.15000  1.0 3.0
   33    48    56    57   0.15000  1.0 3.0
   33    48    56    58   0.15000  1.0 3.0
   33    48    56    59   0.15000  1.0 3.0
   37    33   -48    46   0.56750  1.0 1.0
   37    33   -48    46  -0.07550 -1.0 2.0
   37    33   -48    46   0.20000  1.0 3.0
   37    33    48    52   0.56750  1.0 1.0
   37    33    48    52  -0.07550 -1.0 2.0
   37    33    48    52   0.20000  1.0 3.0
   37    33    48    56   0.56750  1.0 1.0
   37    33    48    56  -0.07550 -1.0 2.0
   37    33    48    56   0.20000  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    43   0.15000  1.0 3.0
   37    44    46    47   0.00000  1.0 1.0
   37    44   -46    48   0.60050  1.0 1.0
   37    44   -46    48   0.05600 -1.0 2.0
   37    44   -46    48   0.26150  1.0 3.0
   37    44    46    49   0.60050  1.0 1.0
   37    44    46    49   0.05600 -1.0 2.0
   37    44    46    49   0.26150  1.0 3.0
   38    37    44    45   0.00000  1.0 1.0
   38    37    44    46   0.00000  1.0 1.0
   39    37    44    45   0.00000  1.0 1.0
   39    37    44    46   0.00000  1.0 1.0
   44    46   -48    33  -0.95700  1.0 1.0
   44    46   -48    33  -0.18200 -1.0 2.0
   44    46   -48    33   0.29450  1.0 3.0
   44    46    48    52  -0.95700  1.0 1.0
   44    46    48    52  -0.18200 -1.0 2.0
   44    46    48    52   0.29450  1.0 3.0
   44    46    48    56  -0.95700  1.0 1.0
   44    46    48    56  -0.18200 -1.0 2.0
   44    46    48    56   0.29450  1.0 3.0
   44    46    49    50  -0.11250  1.0 3.0
   44    46    49    51  -0.11250  1.0 3.0
   44    46    49    60  -0.30950  1.0 1.0
   44    46    49    60   1.11150 -1.0 2.0
   44    46    49    60   0.40350  1.0 3.0
   45    44    46    47   0.00000  1.0 1.0
   45    44    46    48   0.30150 -1.0 2.0
   45    44    46    49   0.30150 -1.0 2.0
   46    48    52    53   0.15000  1.0 3.0
   46    48    52    54   0.15000  1.0 3.0
   46    48    52    55   0.15000  1.0 3.0
   46    48    56    57   0.15000  1.0 3.0
   46    48    56    58   0.15000  1.0 3.0
   46    48    56    59   0.15000  1.0 3.0
   46    49    60    61   0.41150 -1.0 2.0
   46    49    60    62   0.41150 -1.0 2.0
   47    46    48    33   0.15000  1.0 3.0
   47    46    48    52   0.15000  1.0 3.0
   47    46    48    56   0.15000  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    51   0.15000  1.0 3.0
   47    46    49    60  -0.11250  1.0 3.0
   48    33    37    38   0.15000  1.0 3.0
   48    33    37    39   0.15000  1.0 3.0
   48    33   -37    44  -0.95700  1.0 1.0
   48    33   -37    44  -0.18200 -1.0 2.0
   48    33   -37    44   0.29450  1.0 3.0
   48    33    40    41   0.15000  1.0 3.0
   48    33    40    42   0.15000  1.0 3.0
   48    33    40    43   0.15000  1.0 3.0
   48    46    49    50   0.15000  1.0 3.0
   48    46    49    51   0.15000  1.0 3.0
   48    46    49    60  -1.63150  1.0 1.0
   48    46    49    60  -0.43550 -1.0 2.0
   48    46    49    60   0.24500  1.0 3.0
   52    48    56    57   0.15000  1.0 3.0
   52    48    56    58   0.15000  1.0 3.0
   52    48    56    59   0.15000  1.0 3.0
   56    48    52    53   0.15000  1.0 3.0
   56    48    52    54   0.15000  1.0 3.0
   56    48    52    55   0.15000  1.0 3.0
   49    46    48    33   0.56750  1.0 1.0
   49    46    48    33  -0.07550 -1.0 2.0
   49    46    48    33   0.20000  1.0 3.0
   49    46    48    52   0.56750  1.0 1.0
   49    46    48    52  -0.07550 -1.0 2.0
   49    46    48    52   0.20000  1.0 3.0
   49    46    48    56   0.56750  1.0 1.0
   49    46    48    56  -0.07550 -1.0 2.0
   49    46    48    56   0.20000  1.0 3.0
   50    49    60    61   0.00000  1.0 1.0
   50    49    60    62   0.00000  1.0 1.0
   51    49    60    61   0.00000  1.0 1.0
   51    49    60    62   0.00000  1.0 1.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    44  -0.95700  1.0 1.0
   40    33    37    44  -0.18200 -1.0 2.0
   40    33    37    44   0.29450  1.0 3.0
   40    33    48    46   0.56750  1.0 1.0
   40    33    48    46  -0.07550 -1.0 2.0
   40    33    48    46   0.20000  1.0 3.0
   40    33    48    52   0.56750  1.0 1.0
   40    33    48    52  -0.07550 -1.0 2.0
   40    33    48    52   0.20000  1.0 3.0
   40    33    48    56   0.56750  1.0 1.0
   40    33    48    56  -0.07550 -1.0 2.0
   40    33    48    56   0.20000  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
   35    30    34    36  10.50000 -1.0 2.0
   37    46    44    45  10.50000 -1.0 2.0
   61    49    60    62  10.50000 -1.0 2.0
END
