* LIGAND DATABASE FILE (OPLS2005)
*
001      65    65    115    183     350
    1     0 S   NP   _N1_     1    28.72811    96.39179   -22.96467
    2     1 S   H    _HN1     2     1.02829    39.71475   165.56479
    3     1 S   H    _H1_     3     1.02784   101.58113   -90.31160
    4     1 S   H    _H2_     4     1.02950    72.29413    15.47497
    5     1 S   CT   _CA1     5     1.50105   142.27962   116.16125
    6     5 S   HC   _HA1     6     1.09572   105.21301    90.48722
    7     5 S   CO3  _C1_     7     1.53799   112.44979   -29.77338
    8     7 S   O2Z  _O11     8     1.26371   115.01192   -42.91208
    9     7 S   O2Z  _O12     9     1.26241   114.95023   136.27219
   10     5 S   CT   _CB1    10     1.53087   107.42573  -151.52023
   11    10 S   HC   HB11    11     1.09830   109.40646   -49.80237
   12    10 S   HC   HB12    12     1.09813   110.43039    66.81323
   13    10 S   CT   _CG1    13     1.52980   112.58710  -170.79218
   14    13 S   HC   HG11    14     1.09586   110.59101   -64.69669
   15    13 S   HC   HG12    15     1.09667   109.82646    54.52547
   16    13 S   C    _CD1    16     1.51795   112.29086   174.99038
   17    16 S   O    _OE1    17     1.22723   123.31652     4.77019
   18    16 S   N    _N2_    18     1.38651   111.61884  -175.32546
   19    18 S   H    _HN2    19     1.01582   118.92186     1.99802
   20    18 S   CT1  _CA2    20     1.46185   123.41418   178.15241
   21    20 S   HC   _HA2    21     1.09734   109.39026     1.36573
   22    20 S   C    _C2_    22     1.53524   108.60333  -114.16493
   23    22 S   O    _O2_    23     1.23059   122.27319  -147.80175
   24    20 S   CT   _CB2    32     1.53354   111.51675   123.38896
   25    24 S   HC   HB21    33     1.09580   110.00921    56.14082
   26    24 S   HC   HB22    34     1.09443   109.99651   175.24140
   27    22 S   N    _N3_    24     1.38326   113.68008    39.63669
   28    27 S   H    _HN3    25     1.01595   119.57052    -3.35083
   29    24 S   S    _SG2    35     1.82752   111.50116   -64.98494
   30    27 S   CT   _CA3    26     1.45290   123.20390   177.10437
   31    30 S   HC   HA31    27     1.09549   107.51179   -64.49564
   32    30 S   HC   HA32    28     1.09557   107.97967    51.93822
   33    29 S   CT   _C9_    36     1.84700    99.95581   167.53367
   34    33 S   HC   _H8_    37     1.09756   105.46258   -51.47662
   35    30 S   CO3  _C3_    29     1.52957   114.08707   173.93628
   36    35 S   O2Z  _O31    30     1.26374   116.06071    -0.61802
   37    35 S   O2Z  _O32    31     1.26428   114.41476   179.44257
   38    33 S   CT   _C4_    38     1.54897   113.17389    66.47443
   39    38 S   HC   _H3_    39     1.09691   108.04320   -63.21637
   40    38 S   CT   _C5_    40     1.54418   110.55311   179.16303
   41    40 S   HC   _H4_    41     1.09663   109.45020  -173.77534
   42    38 S   NTH2 _N7_    63     1.46625   113.06718    55.62811
   43    42 S   H    _H17    64     1.02008   109.27984   -52.21805
   44    42 S   H    _H18    65     1.01910   109.81278  -168.72041
   45    40 S   CT   _C6_    42     1.54243   113.71632   -50.98317
   46    45 S   HC   _H5_    43     1.09783   109.05534   167.34331
   47    40 S   OH   _O35    61     1.42988   109.46210    70.67301
   48    47 S   HO   _H16    62     0.97266   107.84121    59.48364
   49    45 S   CT   _C7_    44     1.54531   112.94262    49.52927
   50    49 S   HC   _H6_    45     1.09729   108.15175  -171.12130
   51    45 S   NG   _N4_    52     1.48507   111.01386   -74.73922
   52    51 S   H    _H11    53     1.01806   118.06814   103.22065
   53    33 S   CT   _C8_    46     1.54501   109.44168  -166.38170
   54    53 S   HC   _H7_    47     1.09801   108.68048    57.70776
   55    49 S   OH   _O34    50     1.42633   109.13269    72.71662
   56    55 S   HO   _H10    51     0.97266   107.83671   175.60640
   57    51 S   CG   _C10    54     1.38308   124.51702   -76.69613
   58    53 S   OH   _O33    48     1.42737   111.62001   -60.87758
   59    58 S   HO   _H9_    49     0.97293   107.37040   163.41841
   60    57 S   NG   _N6_    55     1.38071   119.02489   178.96864
   61    60 S   H    _H14    56     1.01609   121.25809    -0.48133
   62    60 S   H    _H15    57     1.01593   121.24977   179.91844
   63    57 S   NG   _N5_    58     1.38001   122.09830    -1.11803
   64    63 S   H    _H12    59     1.01604   120.94469  -180.00000
   65    63 S   H    _H13    60     1.01522   122.02853    -0.26541
  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  15   8  15   7   5   1   1  15   8   3   1
  10   6  10   3   5   3   2   1   6   1   1   5   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    53    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    49    53    54    58    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    49    50    53    54    58    59    55    47    42    43    44  
   38    39    40    49    53    54    58    42  
   36    37  
   37  
    0  
   39    40    41    45    46    49    53    54    58    51    47    48    42    43    44  
   40    41    45    53    47    42    43    44  
   41    45    46    49    50    53    55    51    52    57    47    48    42    43    44  
   45    46    49    51    47    48    42  
   43    44    45    47    53  
   44  
    0  
   46    49    50    53    54    58    55    56    51    52    57    60    63    47    48  
   49    50    53    55    51    52    57    47  
   48    49    51  
    0  
   50    53    54    58    59    55    56    51    52    57  
   53    54    58    55    56    51  
   52    57    60    61    62    63    64    65    53    55  
   57    60    63  
   54    58    59    55    56  
   58    59    55  
   56    58  
    0  
   60    61    62    63    64    65  
   59  
    0  
   61    62    63    64    65  
   62    63  
   63  
   64    65  
   65  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660   0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.275000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   44   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660   0.133000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660   0.275000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.2500   0.1700  -0.528167   2.1120   1.8750   0.051222218  -2.220205820
   52   0.5000   0.0300   0.345100   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   57   2.2500   0.0500   0.837600   2.1120   1.8750   0.001000000  -0.126889456
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.2500   0.1700  -0.913767   2.1120   1.8750   0.051222218  -2.220205820
   61   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   62   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.2500   0.1700  -0.913767   2.2900   2.0360   0.003973653   1.685851020
   64   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   65   0.5000   0.0300   0.460000   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    53   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    42   300.000  1.468
   40    41   340.000  1.090
   40    45   268.000  1.529
   40    47   320.000  1.410
   45    46   340.000  1.090
   45    49   268.000  1.529
   45    51   337.000  1.463
   49    50   340.000  1.090
   49    53   268.000  1.529
   49    55   320.000  1.410
   53    54   340.000  1.090
   53    58   320.000  1.410
   58    59   553.000  0.945
   55    56   553.000  0.945
   51    52   434.000  1.010
   51    57   481.000  1.340
   57    60   481.000  1.340
   57    63   481.000  1.340
   60    61   434.000  1.010
   60    62   434.000  1.010
   63    64   434.000  1.010
   63    65   434.000  1.010
   47    48   553.000  0.945
   42    43   495.000  1.019
   42    44   495.000  1.019
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    53    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    42    80.00000  112.76400
   33    53    49    58.35000  112.70000
   33    53    54    37.50000  110.70000
   33    53    58    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    45    58.35000  112.70000
   38    40    47    50.00000  109.50000
   38    42    43    50.00000  110.30900
   38    42    44    50.00000  110.30900
   40    38    39    37.50000  110.70000
   40    45    46    37.50000  110.70000
   40    45    49    58.35000  112.70000
   40    45    51    80.00000  111.20000
   40    47    48    55.00000  108.50000
   45    40    41    37.50000  110.70000
   45    49    50    37.50000  110.70000
   45    49    53    58.35000  112.70000
   45    49    55    50.00000  109.50000
   45    51    52    35.00000  118.40000
   45    51    57    50.00000  123.20000
   49    45    46    37.50000  110.70000
   49    53    54    37.50000  110.70000
   49    53    58    50.00000  109.50000
   49    55    56    55.00000  108.50000
   53    33    34    37.50000  110.70000
   53    33    38    58.35000  112.70000
   53    49    50    37.50000  110.70000
   53    58    59    55.00000  108.50000
   58    53    54    35.00000  109.50000
   55    49    50    35.00000  109.50000
   55    49    53    50.00000  109.50000
   51    45    46    35.00000  109.50000
   51    45    49    80.00000  111.20000
   51    57    60    70.00000  120.00000
   51    57    63    70.00000  120.00000
   57    51    52    35.00000  120.00000
   57    60    61    35.00000  120.00000
   57    60    62    35.00000  120.00000
   57    63    64    35.00000  120.00000
   57    63    65    35.00000  120.00000
   62    60    61    35.00000  120.00000
   63    57    60    70.00000  120.00000
   65    63    64    35.00000  120.00000
   47    40    41    35.00000  109.50000
   47    40    45    50.00000  109.50000
   42    38    39    50.00000  110.79000
   42    38    40    80.00000  112.76400
   44    42    43    40.00000  106.77200
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    53   0.01700  1.0 1.0
   24    29    33    53  -0.23550 -1.0 2.0
   24    29    33    53   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    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    53    49   0.44750  1.0 1.0
   29    33    53    49  -0.17800 -1.0 2.0
   29    33    53    49   0.20200  1.0 3.0
   29    33    53    54   0.15000  1.0 3.0
   29    33    53    58   0.56750  1.0 1.0
   29    33    53    58  -0.07550 -1.0 2.0
   29    33    53    58   0.20000  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    45   0.56750  1.0 1.0
   33    38    40    45  -0.07550 -1.0 2.0
   33    38    40    45   0.20000  1.0 3.0
   33    38    40    47   0.86500  1.0 1.0
   33    38    40    47  -0.17500 -1.0 2.0
   33    38    40    47   0.20800  1.0 3.0
   33    38    42    43   0.21650  1.0 1.0
   33    38    42    43   0.26250 -1.0 2.0
   33    38    42    43   0.12450  1.0 3.0
   33    38    42    44   0.21650  1.0 1.0
   33    38    42    44   0.26250 -1.0 2.0
   33    38    42    44   0.12450  1.0 3.0
   33    53    58    59  -0.11600  1.0 1.0
   33    53    58    59  -0.09450 -1.0 2.0
   33    53    58    59   0.21250  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    42   0.15000  1.0 3.0
   34    33    53    49   0.15000  1.0 3.0
   34    33    53    54   0.15000  1.0 3.0
   34    33    53    58   0.23400  1.0 3.0
   38    33    53    49   0.56750  1.0 1.0
   38    33    53    49  -0.07550 -1.0 2.0
   38    33    53    49   0.20000  1.0 3.0
   38    33    53    54   0.15000  1.0 3.0
   38    33    53    58   0.86500  1.0 1.0
   38    33    53    58  -0.17500 -1.0 2.0
   38    33    53    58   0.20800  1.0 3.0
   38    40    45    46   0.15000  1.0 3.0
   38    40   -45    49   0.56750  1.0 1.0
   38    40   -45    49  -0.07550 -1.0 2.0
   38    40   -45    49   0.20000  1.0 3.0
   38    40    45    51   0.86200  1.0 1.0
   38    40    45    51   0.12850 -1.0 2.0
   38    40    45    51   0.15950  1.0 3.0
   38    40    47    48  -0.11600  1.0 1.0
   38    40    47    48  -0.09450 -1.0 2.0
   38    40    47    48   0.21250  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    45   0.15000  1.0 3.0
   39    38    40    47   0.23400  1.0 3.0
   39    38    42    43   0.20000  1.0 3.0
   39    38    42    44   0.20000  1.0 3.0
   40    38    42    43   0.21650  1.0 1.0
   40    38    42    43   0.26250 -1.0 2.0
   40    38    42    43   0.12450  1.0 3.0
   40    38    42    44   0.21650  1.0 1.0
   40    38    42    44   0.26250 -1.0 2.0
   40    38    42    44   0.12450  1.0 3.0
   40    45    49    50   0.15000  1.0 3.0
   40    45    49    53   0.56750  1.0 1.0
   40    45    49    53  -0.07550 -1.0 2.0
   40    45    49    53   0.20000  1.0 3.0
   40    45    49    55   0.86500  1.0 1.0
   40    45    49    55  -0.17500 -1.0 2.0
   40    45    49    55   0.20800  1.0 3.0
   40    45    51    52  -0.09500  1.0 1.0
   40    45    51    52  -0.20850 -1.0 2.0
   40    45    51    52   0.20900  1.0 3.0
   40    45    51    57   0.25550 -1.0 2.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    49   0.15000  1.0 3.0
   41    40    45    51  -0.29100  1.0 3.0
   41    40    47    48   0.19450  1.0 3.0
   45    40    47    48  -0.11600  1.0 1.0
   45    40    47    48  -0.09450 -1.0 2.0
   45    40    47    48   0.21250  1.0 3.0
   45    49   -53    33   0.56750  1.0 1.0
   45    49   -53    33  -0.07550 -1.0 2.0
   45    49   -53    33   0.20000  1.0 3.0
   45    49    53    54   0.15000  1.0 3.0
   45    49    53    58   0.86500  1.0 1.0
   45    49    53    58  -0.17500 -1.0 2.0
   45    49    53    58   0.20800  1.0 3.0
   45    49    55    56  -0.11600  1.0 1.0
   45    49    55    56  -0.09450 -1.0 2.0
   45    49    55    56   0.21250  1.0 3.0
   45    51    57    60   3.96800 -1.0 2.0
   45    51    57    63   3.96800 -1.0 2.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    53   0.15000  1.0 3.0
   46    45    49    55   0.23400  1.0 3.0
   46    45    51    52   0.00000  1.0 1.0
   46    45    51    57   0.08850  1.0 3.0
   49    45    51    52  -0.09500  1.0 1.0
   49    45    51    52  -0.20850 -1.0 2.0
   49    45    51    52   0.20900  1.0 3.0
   49    45    51    57   0.25550 -1.0 2.0
   49    53    58    59  -0.11600  1.0 1.0
   49    53    58    59  -0.09450 -1.0 2.0
   49    53    58    59   0.21250  1.0 3.0
   50    49    53    33   0.15000  1.0 3.0
   50    49    53    54   0.15000  1.0 3.0
   50    49    53    58   0.23400  1.0 3.0
   50    49    55    56   0.19450  1.0 3.0
   53    33    38    39   0.15000  1.0 3.0
   53    33   -38    40   0.56750  1.0 1.0
   53    33   -38    40  -0.07550 -1.0 2.0
   53    33   -38    40   0.20000  1.0 3.0
   53    33    38    42   1.85550  1.0 1.0
   53    33    38    42  -0.84100 -1.0 2.0
   53    49    55    56  -0.11600  1.0 1.0
   53    49    55    56  -0.09450 -1.0 2.0
   53    49    55    56   0.21250  1.0 3.0
   54    53    58    59   0.19450  1.0 3.0
   55    49    53    33   0.86500  1.0 1.0
   55    49    53    33  -0.17500 -1.0 2.0
   55    49    53    33   0.20800  1.0 3.0
   55    49    53    54   0.23400  1.0 3.0
   55    49    53    58   3.75450  1.0 1.0
   51    45    49    50  -0.29100  1.0 3.0
   51    45    49    53   0.86200  1.0 1.0
   51    45    49    53   0.12850 -1.0 2.0
   51    45    49    53   0.15950  1.0 3.0
   51    45    49    55   4.07950  1.0 1.0
   51    45    49    55  -0.26450 -1.0 2.0
   51    45    49    55  -0.12150  1.0 3.0
   51    57    60    61   1.50000 -1.0 2.0
   51    57    60    62   1.50000 -1.0 2.0
   51    57    63    64   1.50000 -1.0 2.0
   51    57    63    65   1.50000 -1.0 2.0
   52    51    57    60   1.50000 -1.0 2.0
   52    51    57    63   1.50000 -1.0 2.0
   60    57    63    64   1.50000 -1.0 2.0
   60    57    63    65   1.50000 -1.0 2.0
   63    57    60    61   1.50000 -1.0 2.0
   63    57    60    62   1.50000 -1.0 2.0
   47    40    45    46   0.23400  1.0 3.0
   47    40    45    49   0.86500  1.0 1.0
   47    40    45    49  -0.17500 -1.0 2.0
   47    40    45    49   0.20800  1.0 3.0
   47    40    45    51   4.07950  1.0 1.0
   47    40    45    51  -0.26450 -1.0 2.0
   47    40    45    51  -0.12150  1.0 3.0
   42    38    40    41   0.15000  1.0 3.0
   42    38    40    45   1.85550  1.0 1.0
   42    38    40    45  -0.84100 -1.0 2.0
   42    38    40    47   5.28650  1.0 1.0
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
   52    57    51    45   1.00000 -1.0 2.0
   51    60    57    63  10.50000 -1.0 2.0
   62    57    60    61   1.00000 -1.0 2.0
   64    65    63    57   1.00000 -1.0 2.0
END
