* LIGAND DATABASE FILE (OPLS2005)
*
001      63    65    111    180     325
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02111    91.93731   -65.90924
    3     1 S   H    _H1_     3     1.02059    88.58622    42.74105
    4     1 S   H    _H2_     4     1.02152    32.96336   171.62307
    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     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08641   109.88695   179.05581
   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   _C11    36     1.82428    98.03347   161.81746
   34    33 S   HC   _H3_    37     1.09681   109.50036   -37.97895
   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   _C10    38     1.50285   109.94733  -159.98755
   39    33 S   CD   _C12    55     1.50212   107.83855    79.61130
   40    38 S   CM   _C9_    39     1.34651   121.32726  -105.88963
   41    39 S   CO3  _C16    56     1.48540   119.98038   -76.54850
   42    41 S   O2Z  _O38    57     1.27519   116.21594   -30.01412
   43    41 S   O2Z  _O37    58     1.27457   116.21999   150.01201
   44    38 S   CO3  _C17    61     1.53244   114.06840    72.16723
   45    44 S   O2Z  _O40    62     1.25500   114.29728   -87.97142
   46    44 S   O2Z  _O39    63     1.25496   114.29769    91.98731
   47    40 S   C5A  _C6_    40     1.42430   125.57621   178.56824
   48    47 S   C5BC _C5_    41     1.38155   124.30867  -164.41481
   49    48 S   C5BC _C4_    42     1.41506   107.58890   179.34868
   50    49 S   HA   _H4_    43     1.08136   127.15446  -175.42213
   51    48 S   CO4  _C15    50     1.44677   121.23458    -1.41153
   52    51 S   O    _O35    51     1.22412   123.73247   173.67795
   53    49 S   C5A  _C7_    44     1.37813   106.99402     2.96597
   54    51 S   CM   _C14    52     1.50848   114.05747    -8.73050
   55    47 S   NA   _N4_    45     1.36780   127.78728    20.42525
   56    55 S   H    _H5_    46     1.00721   127.24897    -0.87492
   57    53 S   CO3  _C8_    47     1.52679   126.22892  -178.66749
   58    57 S   O2Z  _O34    48     1.26177   116.56201   180.00000
   59    57 S   O2Z  _O33    49     1.26263   116.58459    -0.04423
   60    40 S   CM   _C13    53     1.48388   119.25153     2.74780
   61    54 S   OH   _O36    59     1.38434   116.41312  -170.22022
   62    61 S   HO   _H6_    60     0.96109   109.51644    -0.03956
   63    60 S   NI   _N5_    54     1.37553   119.40801   -18.36829
  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   8   5   4   3
  13   6   2   1   1  12   8  14   4   2   1   4   1   1  12  11
  10   4   8   3   5   4   5   1   2   1   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    40    63    39    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    47    60    63    39    41    42    43    44    45    46  
   38    40    63    39    41    44  
   36    37  
   37  
    0  
   40    47    48    55    54    60    63    39    41    44    45    46  
   41    42    43    44    40    54    60    63  
   47    48    49    53    55    56    51    54    60    63    61    44    45    46  
   42    43    60    63  
   43    63  
   63  
   45    46    47    60  
   46  
    0  
   48    49    50    53    55    56    57    51    52    54    60    63  
   49    50    53    55    56    57    51    52    54    60    61  
   50    53    55    56    57    58    59    51    52    54  
   53    55    57    51  
   52    54    60    63    61    62    53    55  
   54    60    61  
   55    56    57    58    59  
   60    63    61    62  
   56    57    58    59    60  
   57  
   58    59  
   59  
    0  
   63    61    62  
   62    63  
    0  
    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   0.143600   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  -0.310300   2.0020   1.7750   0.023028004  -0.852763146
   39   3.7500   0.1050   0.353600   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   44   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   47   3.5500   0.0700  -0.008000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.146000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0700  -0.149000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.118000   1.3810   1.2100   0.030040813   0.268726247
   51   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5500   0.0700  -0.123000   2.0020   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   55   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   56   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   57   3.7500   0.1050   0.715000   2.1120   1.8750   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   60   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   61   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   63   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
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   270.000  1.508
   38    40   549.000  1.340
   38    44   230.000  1.545
   40    47   375.000  1.423
   40    60   380.000  1.444
   47    48   546.000  1.367
   47    55   427.000  1.381
   48    49   469.000  1.424
   48    51   320.000  1.468
   49    50   367.000  1.080
   49    53   546.000  1.367
   53    55   427.000  1.381
   53    57   325.000  1.466
   55    56   434.000  1.010
   57    58   656.000  1.250
   57    59   656.000  1.250
   51    52   570.000  1.229
   51    54   320.000  1.462
   54    60   549.000  1.340
   54    61   510.000  1.338
   60    63   405.000  1.380
   63    39   500.000  1.261
   39    41   270.000  1.486
   41    42   656.000  1.250
   41    43   656.000  1.250
   61    62   553.000  0.945
   44    45   656.000  1.250
   44    46   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    39    75.00000  114.43000
   33    38    40    70.00000  124.00000
   33    38    44    65.00000  117.04000
   33    39    63    65.00000  122.10100
   33    39    41    60.00000  116.68000
   38    33    34    35.00000  109.50000
   38    40    47    55.00000  128.24000
   38    40    60    70.00000  123.01800
   38    44    45    85.00000  113.83300
   38    44    46    85.00000  113.83300
   40    47    48    50.00000  133.16000
   40    47    55    70.00000  120.38000
   40    60    54    70.00000  123.01800
   40    60    63    70.00000  120.83400
   47    48    49    70.00000  107.30000
   47    48    51    60.00000  121.69000
   47    55    53    70.00000  109.80000
   47    55    56    35.00000  120.00000
   48    49    50    35.00000  127.50000
   48    49    53    70.00000  107.30000
   48    51    52    80.00000  122.10000
   48    51    54    65.00000  117.02400
   49    53    55    70.00000  107.70000
   49    53    57    55.00000  130.80000
   53    49    50    35.00000  125.70000
   53    55    56    35.00000  120.00000
   53    57    58    80.00000  120.87000
   53    57    59    80.00000  120.87000
   55    47    48    70.00000  107.70000
   57    53    55    70.00000  119.02500
   59    57    58    80.00000  126.00000
   51    48    49    50.00000  131.05000
   51    54    60    65.00000  118.96000
   51    54    61    85.00000  116.28000
   54    51    52    80.00000  123.72100
   54    60    63    70.00000  120.83400
   54    61    62    70.00000  107.45700
   60    40    47    55.00000  128.24000
   60    63    39    75.00000  115.77100
   63    39    41    65.00000  123.79500
   39    33    34    45.00000  109.49600
   39    33    38    70.00000  110.51600
   39    41    42    85.00000  113.83300
   39    41    43    85.00000  113.83300
   43    41    42    80.00000  126.00000
   61    54    60    80.00000  121.38400
   44    38    40    55.00000  124.75400
   46    44    45    80.00000  126.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  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  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    38    44   0.09700  1.0 1.0
   29    33    38    44   0.15600 -1.0 2.0
   29    33    38    44  -0.50800  1.0 3.0
   29    33    39    63   0.00000  1.0 1.0
   29    33    39    41   0.00000  1.0 1.0
   33    38    40    47   7.00000 -1.0 2.0
   33    38    40    60   7.00000 -1.0 2.0
   33    38    44    45  -0.64400  1.0 1.0
   33    38    44    45   0.26850 -1.0 2.0
   33    38    44    46  -0.64400  1.0 1.0
   33    38    44    46   0.26850 -1.0 2.0
   33    39    41    42   1.00000 -1.0 2.0
   33    39    41    43   1.00000 -1.0 2.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    38    44   0.15000  1.0 3.0
   34    33    39    63   0.00000  1.0 1.0
   34    33    39    41   0.00000  1.0 1.0
   38    33    39    63   0.00000  1.0 1.0
   38    33    39    41   0.00000  1.0 1.0
   38    40    47    48   0.15800  1.0 1.0
   38    40    47    48   1.85350 -1.0 2.0
   38    40    47    48  -0.48700  1.0 3.0
   38    40    47    55   0.11450  1.0 1.0
   38    40    47    55   1.85100 -1.0 2.0
   38    40    47    55  -0.49050  1.0 3.0
   38    40    60    54   0.28850  1.0 1.0
   38    40    60    54   2.61350 -1.0 2.0
   38    40    60    54   0.78400  1.0 3.0
   38    40   -60    63  -0.18600  1.0 3.0
   40    38    44    45  -0.04000 -1.0 2.0
   40    38    44    45  -0.29050  1.0 3.0
   40    38    44    46  -0.04000 -1.0 2.0
   40    38    44    46  -0.29050  1.0 3.0
   40    47    48    49   3.62500 -1.0 2.0
   40    47    48    51   3.62500 -1.0 2.0
   40    47    55    53   3.62500 -1.0 2.0
   40    47    55    56   2.00000 -1.0 2.0
   40    60    63    39   1.00000 -1.0 2.0
   47    40    60    54  -0.18600  1.0 3.0
   47    40    60    63   1.08500 -1.0 2.0
   47    48    49    50   3.62500 -1.0 2.0
   47    48   -49    53   3.62500 -1.0 2.0
   47    48    51    52   1.05000 -1.0 2.0
   47    48   -51    54  -0.11500  1.0 1.0
   47    48   -51    54   1.10450 -1.0 2.0
   47    48   -51    54  -0.48050  1.0 3.0
   48    47   -55    53   3.62500 -1.0 2.0
   48    47    55    56   2.00000 -1.0 2.0
   48    49   -53    55   3.62500 -1.0 2.0
   48    49    53    57   3.62500 -1.0 2.0
   48    51    54    60  -1.65800  1.0 1.0
   48    51    54    60   0.77650 -1.0 2.0
   48    51    54    61   1.50000 -1.0 2.0
   49    48    51    52   1.05000 -1.0 2.0
   49    48    51    54  -0.11500  1.0 1.0
   49    48    51    54   1.10450 -1.0 2.0
   49    48    51    54  -0.48050  1.0 3.0
   49    53   -55    47   3.62500 -1.0 2.0
   49    53    55    56   2.00000 -1.0 2.0
   49    53    57    58   1.05000 -1.0 2.0
   49    53    57    59   1.05000 -1.0 2.0
   50    49    53    55   3.62500 -1.0 2.0
   50    49    53    57   3.62500 -1.0 2.0
   55    47   -48    49   3.62500 -1.0 2.0
   55    47    48    51   3.62500 -1.0 2.0
   55    53    57    58   1.85000 -1.0 2.0
   55    53    57    59   1.85000 -1.0 2.0
   57    53    55    47   3.62500 -1.0 2.0
   57    53    55    56   2.00000 -1.0 2.0
   51    48    49    50   3.62500 -1.0 2.0
   51    48    49    53   3.62500 -1.0 2.0
   51    54   -60    40   7.00000 -1.0 2.0
   51    54    60    63   7.00000 -1.0 2.0
   51    54    61    62   2.00000 -1.0 2.0
   52    51    54    60   1.00000 -1.0 2.0
   52    51    54    61  -0.11900  1.0 1.0
   52    51    54    61   0.76850 -1.0 2.0
   52    51    54    61   0.14100  1.0 3.0
   54    60    63    39   1.00000 -1.0 2.0
   60    40   -47    48   0.15800  1.0 1.0
   60    40   -47    48   1.85350 -1.0 2.0
   60    40   -47    48  -0.48700  1.0 3.0
   60    40    47    55   0.11450  1.0 1.0
   60    40    47    55   1.85100 -1.0 2.0
   60    40    47    55  -0.49050  1.0 3.0
   60    54    61    62  -0.66100  1.0 1.0
   60    54    61    62   1.20850 -1.0 2.0
   60    54    61    62  -0.36000  1.0 3.0
   60    63   -39    33   6.00000 -1.0 2.0
   60    63    39    41   6.00000 -1.0 2.0
   63    39    41    42   1.00000 -1.0 2.0
   63    39    41    43   1.00000 -1.0 2.0
   39    33   -38    40  -0.28300  1.0 1.0
   39    33   -38    40   0.26700 -1.0 2.0
   39    33   -38    40  -0.63300  1.0 3.0
   39    33    38    44   0.09700  1.0 1.0
   39    33    38    44   0.15600 -1.0 2.0
   39    33    38    44  -0.50800  1.0 3.0
   61    54    60    40   7.00000 -1.0 2.0
   61    54    60    63   7.00000 -1.0 2.0
   44    38    40    47   7.00000 -1.0 2.0
   44    38    40    60   7.00000 -1.0 2.0
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    44    38    40   1.10000 -1.0 2.0
   47    60    40    38   1.10000 -1.0 2.0
   48    55    47    40   4.00000 -1.0 2.0
   49    51    48    47   4.00000 -1.0 2.0
   53    50    49    48   1.10000 -1.0 2.0
   57    55    53    49   4.00000 -1.0 2.0
   56    47    55    53   1.00000 -1.0 2.0
   58    53    57    59  10.50000 -1.0 2.0
   48    54    51    52  10.50000 -1.0 2.0
   51    61    54    60   1.10000 -1.0 2.0
   40    63    60    54   1.10000 -1.0 2.0
   33    41    39    63  10.50000 -1.0 2.0
   42    39    41    43  10.50000 -1.0 2.0
   45    38    44    46  10.50000 -1.0 2.0
END
