* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    136    213     399
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02066    65.80422  -102.37555
    3     1 S   H    _H1_     3     1.02093   105.30778     1.53761
    4     1 S   H    _H2_     4     1.02109    46.80411   102.98098
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08639   110.43529    58.94977
   26    24 S   HC   HB22    34     1.08669   109.83319   178.93210
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C16    36     1.81934   100.27883   -78.16451
   34    33 S   HC   _H5_    37     1.09547   107.83834    40.92586
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CM   _C14    38     1.48508   110.98638   159.96830
   39    33 S   OH   _O35    70     1.42242   112.28973   -76.96563
   40    39 S   HO   _H18    71     0.97284   106.78875    56.12799
   41    38 S   CM   _C15    39     1.33329   128.99555  -118.45660
   42    41 S   OS   _O33    40     1.38913   115.70934  -179.95154
   43    41 S   OH   _O34    68     1.36874   124.10218    -0.93209
   44    43 S   HO   _H17    69     0.96641   110.47171   180.00000
   45    42 S   CT   _C11    41     1.43903   104.56450    -7.00513
   46    45 S   HC   _H3_    42     1.09584   109.14336  -111.26169
   47    45 S   CM   _C10    43     1.50015   111.43613   124.68159
   48    47 S   CM   _C9_    44     1.34075   111.19340  -112.61074
   49    48 S   CT   _C8_    45     1.49075   125.01276  -178.37779
   50    49 S   HC   _H13    46     1.09642   110.23993   134.89247
   51    49 S   HC   _H14    47     1.09593   108.73050  -107.85913
   52    48 S   CT   _C13    63     1.49430   113.15832     1.34944
   53    52 S   HC   _H15    64     1.09521   110.77203   115.24823
   54    52 S   HC   _H16    65     1.09509   110.64956  -124.50326
   55    49 S   CT   _C7_    48     1.53020   112.09201    13.51316
   56    55 S   HC   _H11    49     1.09695   109.64161    80.63035
   57    55 S   HC   _H12    50     1.09645   109.40503  -162.99215
   58    38 S   CT   _C12    66     1.48751   122.19159    61.09137
   59    58 S   HC   _H4_    67     1.09613   111.51458   -56.03786
   60    55 S   CT   _C6_    51     1.53094   111.69134   -41.22105
   61    60 S   HC   _H9_    52     1.09640   109.28698  -178.68255
   62    60 S   HC   _H10    53     1.09921   108.01100   -63.46111
   63    47 S   CT   _C5_    54     1.51443   124.79227    69.29568
   64    63 S   CT   _C4_    55     1.54127   108.89059    72.44339
   65    64 S   HC   _H6_    56     1.08430   109.07981   179.98022
   66    64 S   HC   _H7_    57     1.08345   109.11807    60.00519
   67    64 S   HC   _H8_    58     1.08384   109.07732   -60.05846
   68    63 S   CT   _C17    59     1.53950   112.14216   -47.63329
   69    68 S   HC   _H19    60     1.08459   109.21765   179.98022
   70    68 S   HC   _H20    61     1.08430   109.16580    59.99804
   71    68 S   HC   _H21    62     1.08530   109.20354   -59.95429
  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   7   5   4   3
  11   5   2   1   1  15   3   1   9  10   3   1  13   6  22  15
  13   6   5   6   3   2   8   5   4   2   1  11   4   3   8   7
   3   2   1   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    58    39    40  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    52    58    59    43    39    40  
   38    41    58    39    40  
   36    37  
   37  
    0  
   41    42    45    46    47    48    52    53    54    58    59    43    44    39    40  
   40    41    58  
    0  
   42    45    46    47    52    58    59    43    44  
   45    46    47    48    63    52    58    59    43    44  
   44    45    58  
    0  
   46    47    48    49    60    63    64    68    52    53    54    58    59  
   47    48    63    52    58    59  
   48    49    50    51    55    60    61    62    63    64    65    66    67    68    69    70    71    52    53    54    58    59  
   49    50    51    55    56    57    60    63    64    68    52    53    54    58    59  
   50    51    55    56    57    60    61    62    63    52    53    54    58  
   51    55    56    57    60    52  
   55    56    57    60    52  
   53    54    58    59    55    63  
   54    58    59  
   58    59  
   56    57    60    61    62    63    64    68  
   57    60    61    62    63  
   60    61    62    63  
   59    63  
    0  
   61    62    63    64    65    66    67    68    69    70    71  
   62    63    64    68  
   63    64    68  
   64    65    66    67    68    69    70    71  
   65    66    67    68    69    70    71  
   66    67    68  
   67    68  
   68  
   69    70    71  
   70    71  
   71  
    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   0.372500   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   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   40   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   41   3.5500   0.0760   0.133800   2.0020   1.7750   0.023028004  -0.852763146
   42   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   64   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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   320.000  1.410
   38    41   549.000  1.340
   38    58   317.000  1.510
   41    42   440.000  1.360
   41    43   510.000  1.338
   42    45   320.000  1.410
   45    46   340.000  1.090
   45    47   317.000  1.510
   45    58   268.000  1.529
   47    48   549.000  1.340
   47    63   317.000  1.510
   48    49   317.000  1.510
   48    52   317.000  1.510
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   268.000  1.529
   63    64   268.000  1.529
   63    68   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    58   268.000  1.529
   58    59   340.000  1.090
   43    44   553.000  0.945
   39    40   553.000  0.945
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  112.20000
   29    33    39    85.00000  114.68000
   33    38    41    70.00000  124.00000
   33    38    58    65.00000  117.92700
   33    39    40    55.00000  108.50000
   38    33    34    35.00000  109.50000
   38    41    42    80.00000  120.01400
   38    41    43    80.00000  121.38400
   38    58    45    70.00000  112.02700
   38    58    52    70.00000  112.02700
   38    58    59    35.00000  109.50000
   41    42    45    90.00000  111.18400
   41    43    44    70.00000  107.45700
   42    45    46    35.00000  109.50000
   42    45    47    85.00000  110.90400
   42    45    58    50.00000  109.50000
   45    47    48    70.00000  124.00000
   45    47    63    65.00000  117.92700
   45    58    52    58.35000  112.70000
   45    58    59    37.50000  110.70000
   47    45    46    35.00000  109.50000
   47    48    49    70.00000  124.00000
   47    48    52    70.00000  124.00000
   47    63    60    70.00000  112.02700
   47    63    64    70.00000  112.02700
   47    63    68    70.00000  112.02700
   48    49    50    35.00000  109.50000
   48    49    51    35.00000  109.50000
   48    49    55    70.00000  112.02700
   48    52    53    35.00000  109.50000
   48    52    54    35.00000  109.50000
   48    52    58    70.00000  112.02700
   49    55    56    37.50000  110.70000
   49    55    57    37.50000  110.70000
   49    55    60    58.35000  112.70000
   51    49    50    33.00000  107.80000
   55    49    50    37.50000  110.70000
   55    49    51    37.50000  110.70000
   55    60    61    37.50000  110.70000
   55    60    62    37.50000  110.70000
   55    60    63    58.35000  112.70000
   57    55    56    33.00000  107.80000
   60    55    56    37.50000  110.70000
   60    55    57    37.50000  110.70000
   60    63    64    58.35000  112.70000
   60    63    68    58.35000  112.70000
   62    60    61    33.00000  107.80000
   63    47    48    70.00000  124.00000
   63    60    61    37.50000  110.70000
   63    60    62    37.50000  110.70000
   63    64    65    37.50000  110.70000
   63    64    66    37.50000  110.70000
   63    64    67    37.50000  110.70000
   63    68    69    37.50000  110.70000
   63    68    70    37.50000  110.70000
   63    68    71    37.50000  110.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   68    63    64    58.35000  112.70000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   52    48    49    65.00000  117.92700
   52    58    59    37.50000  110.70000
   54    52    53    33.00000  107.80000
   58    38    41    70.00000  124.00000
   58    45    46    37.50000  110.70000
   58    45    47    70.00000  112.02700
   58    52    53    37.50000  110.70000
   58    52    54    37.50000  110.70000
   43    41    42   115.00000  116.36000
   39    33    34    35.00000  109.50000
   39    33    38    90.00000  110.39200
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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  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   0.42700  1.0 1.0
   29    33    38    41  -0.70350 -1.0 2.0
   29    33    38    41  -0.43150  1.0 3.0
   29    33    38    58   0.30250  1.0 1.0
   29    33    38    58  -0.14950 -1.0 2.0
   29    33    38    58   0.36900  1.0 3.0
   29    33    39    40   0.35600  1.0 1.0
   29    33    39    40  -0.10750 -1.0 2.0
   29    33    39    40  -0.54400  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    43   7.00000 -1.0 2.0
   33    38    58    45   0.46850  1.0 1.0
   33    38    58    45   0.08550 -1.0 2.0
   33    38    58    45   0.09800  1.0 3.0
   33    38    58    52   0.46850  1.0 1.0
   33    38    58    52   0.08550 -1.0 2.0
   33    38    58    52   0.09800  1.0 3.0
   33    38    58    59   0.34800  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    58   0.34800  1.0 3.0
   34    33    39    40   0.19450  1.0 3.0
   38    33    39    40  -0.07800  1.0 1.0
   38    33    39    40  -0.21500 -1.0 2.0
   38    33    39    40  -0.03150  1.0 3.0
   38    41   -42    45  -2.26850  1.0 1.0
   38    41   -42    45   3.39050 -1.0 2.0
   38    41    43    44  -0.66100  1.0 1.0
   38    41    43    44   1.20850 -1.0 2.0
   38    41    43    44  -0.36000  1.0 3.0
   41    38   -58    45   0.09850  1.0 1.0
   41    38   -58    45   0.15250 -1.0 2.0
   41    38   -58    45  -0.50650  1.0 3.0
   41    38    58    52   0.09850  1.0 1.0
   41    38    58    52   0.15250 -1.0 2.0
   41    38    58    52  -0.50650  1.0 3.0
   41    38    58    59   0.00000  1.0 1.0
   41    42    45    46   0.08050  1.0 3.0
   41    42    45    47  -0.48150  1.0 1.0
   41    42    45    47   0.09250 -1.0 2.0
   41    42    45    47  -0.12850  1.0 3.0
   41    42   -45    58  -0.46850  1.0 1.0
   41    42   -45    58   0.09300 -1.0 2.0
   41    42   -45    58  -0.12850  1.0 3.0
   42    41    43    44   2.00000 -1.0 2.0
   42    45    47    48   0.39000  1.0 1.0
   42    45    47    48  -0.05800 -1.0 2.0
   42    45    47    48  -0.55150  1.0 3.0
   42    45    47    63   0.09700  1.0 1.0
   42    45    47    63   0.15600 -1.0 2.0
   42    45    47    63  -0.50800  1.0 3.0
   42    45   -58    38   0.61850  1.0 1.0
   42    45   -58    38  -0.22750 -1.0 2.0
   42    45   -58    38   0.15300  1.0 3.0
   42    45    58    52   0.62750  1.0 1.0
   42    45    58    52  -0.30950 -1.0 2.0
   42    45    58    52   0.27300  1.0 3.0
   42    45    58    59   0.23400  1.0 3.0
   45    47    48    49   7.00000 -1.0 2.0
   45    47   -48    52   7.00000 -1.0 2.0
   45    47    63    60   0.46850  1.0 1.0
   45    47    63    60   0.08550 -1.0 2.0
   45    47    63    60   0.09800  1.0 3.0
   45    47    63    64   0.46850  1.0 1.0
   45    47    63    64   0.08550 -1.0 2.0
   45    47    63    64   0.09800  1.0 3.0
   45    47    63    68   0.46850  1.0 1.0
   45    47    63    68   0.08550 -1.0 2.0
   45    47    63    68   0.09800  1.0 3.0
   46    45    47    48   0.00000  1.0 1.0
   46    45    47    63   0.34800  1.0 3.0
   46    45    58    38   0.15000  1.0 3.0
   46    45    58    52   0.15000  1.0 3.0
   46    45    58    59   0.15000  1.0 3.0
   47    45    58    38   0.31000  1.0 1.0
   47    45    58    38   0.14700 -1.0 2.0
   47    45    58    38   0.07550  1.0 3.0
   47    45   -58    52   0.34400  1.0 1.0
   47    45   -58    52   0.09450 -1.0 2.0
   47    45   -58    52   0.11100  1.0 3.0
   47    45    58    59   0.15000  1.0 3.0
   47    48    49    50   0.00000  1.0 1.0
   47    48    49    51   0.00000  1.0 1.0
   47    48    49    55   0.09850  1.0 1.0
   47    48    49    55   0.15250 -1.0 2.0
   47    48    49    55  -0.50650  1.0 3.0
   47    48    52    53   0.00000  1.0 1.0
   47    48    52    54   0.00000  1.0 1.0
   47    48   -52    58   0.09850  1.0 1.0
   47    48   -52    58   0.15250 -1.0 2.0
   47    48   -52    58  -0.50650  1.0 3.0
   47    63    64    65   0.15000  1.0 3.0
   47    63    64    66   0.15000  1.0 3.0
   47    63    64    67   0.15000  1.0 3.0
   47    63    68    69   0.15000  1.0 3.0
   47    63    68    70   0.15000  1.0 3.0
   47    63    68    71   0.15000  1.0 3.0
   48    47    63    60   0.09850  1.0 1.0
   48    47    63    60   0.15250 -1.0 2.0
   48    47    63    60  -0.50650  1.0 3.0
   48    47    63    64   0.09850  1.0 1.0
   48    47    63    64   0.15250 -1.0 2.0
   48    47    63    64  -0.50650  1.0 3.0
   48    47    63    68   0.09850  1.0 1.0
   48    47    63    68   0.15250 -1.0 2.0
   48    47    63    68  -0.50650  1.0 3.0
   48    49    55    56   0.15000  1.0 3.0
   48    49    55    57   0.15000  1.0 3.0
   48    49   -55    60   0.34400  1.0 1.0
   48    49   -55    60   0.09450 -1.0 2.0
   48    49   -55    60   0.11100  1.0 3.0
   48    52    58    38   0.31000  1.0 1.0
   48    52    58    38   0.14700 -1.0 2.0
   48    52    58    38   0.07550  1.0 3.0
   48    52   -58    45   0.34400  1.0 1.0
   48    52   -58    45   0.09450 -1.0 2.0
   48    52   -58    45   0.11100  1.0 3.0
   48    52    58    59   0.15000  1.0 3.0
   49    48    52    53   0.34800  1.0 3.0
   49    48    52    54   0.34800  1.0 3.0
   49    48    52    58   0.46850  1.0 1.0
   49    48    52    58   0.08550 -1.0 2.0
   49    48    52    58   0.09800  1.0 3.0
   49    55    60    61   0.15000  1.0 3.0
   49    55    60    62   0.15000  1.0 3.0
   49    55    60    63   0.56750  1.0 1.0
   49    55    60    63  -0.07550 -1.0 2.0
   49    55    60    63   0.20000  1.0 3.0
   50    49    55    56   0.15000  1.0 3.0
   50    49    55    57   0.15000  1.0 3.0
   50    49    55    60   0.15000  1.0 3.0
   51    49    55    56   0.15000  1.0 3.0
   51    49    55    57   0.15000  1.0 3.0
   51    49    55    60   0.15000  1.0 3.0
   55    60   -63    47   0.34400  1.0 1.0
   55    60   -63    47   0.09450 -1.0 2.0
   55    60   -63    47   0.11100  1.0 3.0
   55    60    63    64   0.56750  1.0 1.0
   55    60    63    64  -0.07550 -1.0 2.0
   55    60    63    64   0.20000  1.0 3.0
   55    60    63    68   0.56750  1.0 1.0
   55    60    63    68  -0.07550 -1.0 2.0
   55    60    63    68   0.20000  1.0 3.0
   56    55    60    61   0.15000  1.0 3.0
   56    55    60    62   0.15000  1.0 3.0
   56    55    60    63   0.15000  1.0 3.0
   57    55    60    61   0.15000  1.0 3.0
   57    55    60    62   0.15000  1.0 3.0
   57    55    60    63   0.15000  1.0 3.0
   60    63    64    65   0.15000  1.0 3.0
   60    63    64    66   0.15000  1.0 3.0
   60    63    64    67   0.15000  1.0 3.0
   60    63    68    69   0.15000  1.0 3.0
   60    63    68    70   0.15000  1.0 3.0
   60    63    68    71   0.15000  1.0 3.0
   61    60    63    47   0.15000  1.0 3.0
   61    60    63    64   0.15000  1.0 3.0
   61    60    63    68   0.15000  1.0 3.0
   62    60    63    47   0.15000  1.0 3.0
   62    60    63    64   0.15000  1.0 3.0
   62    60    63    68   0.15000  1.0 3.0
   63    47   -48    49   7.00000 -1.0 2.0
   63    47    48    52   7.00000 -1.0 2.0
   64    63    68    69   0.15000  1.0 3.0
   64    63    68    70   0.15000  1.0 3.0
   64    63    68    71   0.15000  1.0 3.0
   68    63    64    65   0.15000  1.0 3.0
   68    63    64    66   0.15000  1.0 3.0
   68    63    64    67   0.15000  1.0 3.0
   52    48    49    50   0.34800  1.0 3.0
   52    48    49    51   0.34800  1.0 3.0
   52    48    49    55   0.46850  1.0 1.0
   52    48    49    55   0.08550 -1.0 2.0
   52    48    49    55   0.09800  1.0 3.0
   53    52    58    38   0.15000  1.0 3.0
   53    52    58    45   0.15000  1.0 3.0
   53    52    58    59   0.15000  1.0 3.0
   54    52    58    38   0.15000  1.0 3.0
   54    52    58    45   0.15000  1.0 3.0
   54    52    58    59   0.15000  1.0 3.0
   58    38   -41    42   7.00000 -1.0 2.0
   58    38    41    43   7.00000 -1.0 2.0
   58    45   -47    48   0.09850  1.0 1.0
   58    45   -47    48   0.15250 -1.0 2.0
   58    45   -47    48  -0.50650  1.0 3.0
   58    45    47    63   0.46850  1.0 1.0
   58    45    47    63   0.08550 -1.0 2.0
   58    45    47    63   0.09800  1.0 3.0
   43    41    42    45   2.00000 -1.0 2.0
   39    33    38    41   0.67800  1.0 1.0
   39    33    38    41   0.47050 -1.0 2.0
   39    33    38    41  -0.62500  1.0 3.0
   39    33    38    58   0.18000  1.0 1.0
   39    33    38    58   0.16450 -1.0 2.0
   39    33    38    58   0.04450  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
   33    58    38    41   1.10000 -1.0 2.0
   42    43    41    38   1.10000 -1.0 2.0
   45    63    47    48   1.10000 -1.0 2.0
   49    52    48    47   1.10000 -1.0 2.0
END
