* LIGAND DATABASE FILE (OPLS2005)
*
001      56    57    101    161     299
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02089   106.62806   -15.87797
    3     1 S   H    _H1_     3     1.02130    56.98795    85.99929
    4     1 S   H    _H2_     4     1.02160    55.14443  -117.37102
    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     1.08519   110.61667    58.74867
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   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   _C6_    36     1.84817    97.30416  -158.15266
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C11    37     1.50228   107.33817   -60.00752
   38    37 S   HC   _H8_    38     1.08867   118.05550    74.41857
   39    33 S   NT   _N4_    50     1.47681   109.53701    64.49948
   40    39 S   H    _H6_    51     1.01975   107.78320    -9.66813
   41    37 S   CM   _C10    39     1.34108   122.94279  -102.55165
   42    41 S   CO4  _C9_    40     1.49250   120.13582    -2.79897
   43    42 S   O    _O33    41     1.22603   121.57343   170.55768
   44    41 S   OH   _O34    55     1.37674   121.32113   176.62356
   45    44 S   HO   _H9_    56     0.96378   110.00707  -180.00000
   46    42 S   CM   _C8_    42     1.48371   117.55669   -12.84200
   47    46 S   HC   _H7_    43     1.08301   118.39328  -161.56725
   48    33 S   CM   _C7_    44     1.49864   108.59603   178.44619
   49    48 S   CT   _C4_    45     1.48994   107.93488   -89.63801
   50    49 S   HC   _H4_    46     1.09481   111.17613    84.46173
   51    49 S   HC   _H5_    47     1.09490   112.70410  -153.11350
   52    49 S   CT1  _C5_    48     1.52299    99.63728   -35.10190
   53    52 S   HC   _H3_    49     1.09631   111.56648   -89.63939
   54    52 S   CO3  _C12    52     1.51199   111.49846   147.47177
   55    54 S   O2Z  _O36    53     1.26238   115.30382   -55.98476
   56    54 S   O2Z  _O35    54     1.26330   114.78830   123.97135
  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
  16   2   1   1  12   5  12   5   7   7   4   2   1   6   2   6
   7   4   3   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    48    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    46    48    49    52    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    46    47    48    49    50    51    52    53    39    40    54    44  
   35    36  
   36  
    0  
   38    41    42    43    46    48    49    52    39    40    44    45  
   41    42    48    39    44  
   40    54    55    56    41    46    48    49    50    51    52    53  
   54    48    49    52    53  
   42    43    46    47    48    44    45  
   43    46    47    48    49    44    45  
   46    47    48    44  
   45    46  
    0  
   47    48    49    50    51    52  
   48    49  
   49    50    51    52    53    54  
   50    51    52    53    54    55    56  
   51    52    53    54  
   52    53    54  
   53    54    55    56  
   54    55    56  
   55    56  
   56  
    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   0.367500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.3000   0.1700  -0.702500   1.8650   1.6500   0.051222218  -2.220205820
   40   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   41   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   42   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    48   317.000  1.510
   33    39   382.000  1.448
   37    38   340.000  1.080
   37    41   549.000  1.340
   41    42   320.000  1.462
   41    44   510.000  1.338
   42    43   570.000  1.229
   42    46   320.000  1.462
   46    47   340.000  1.080
   46    48   549.000  1.340
   48    49   317.000  1.510
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   268.000  1.529
   52    53   340.000  1.090
   52    39   305.000  1.457
   52    54   317.000  1.522
   39    40   434.000  1.010
   54    55   656.000  1.250
   54    56   656.000  1.250
   44    45   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    48    75.00000  112.20000
   29    33    39    85.00000  109.00000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    48    46    70.00000  124.00000
   33    48    49    65.00000  117.92700
   33    39    52    51.80000  107.20000
   33    39    40    35.00000  109.50000
   37    41    42    65.00000  118.96000
   37    41    44    80.00000  121.38400
   41    37    38    35.00000  120.00000
   41    42    43    80.00000  123.72100
   41    42    46    65.00000  118.65900
   41    44    45    70.00000  107.45700
   42    46    47    40.00000  117.72500
   42    46    48    65.00000  118.96000
   46    42    43    80.00000  123.72100
   46    48    49    70.00000  124.00000
   48    33    37    70.00000  110.12100
   48    46    47    35.00000  120.00000
   48    49    50    35.00000  109.50000
   48    49    51    35.00000  109.50000
   48    49    52    70.00000  112.02700
   49    52    53    37.50000  110.70000
   49    52    39    80.00000  111.22000
   49    52    54    63.00000  111.10000
   51    49    50    33.00000  107.80000
   52    49    50    37.50000  110.70000
   52    49    51    37.50000  110.70000
   52    39    40    50.00000  111.55300
   52    54    55    70.00000  117.00000
   52    54    56    70.00000  117.00000
   39    33    37    75.00000  110.70900
   39    33    48    75.00000  110.70900
   39    52    53    50.00000  109.55000
   54    52    53    35.00000  109.50000
   54    52    39    75.00000  111.54000
   56    54    55    80.00000  126.00000
   44    41    42    85.00000  116.28000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    48  -0.62250  1.0 1.0
   24    29    33    48  -0.38450 -1.0 2.0
   24    29    33    48   0.81900  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    48    46   0.42700  1.0 1.0
   29    33    48    46  -0.70350 -1.0 2.0
   29    33    48    46  -0.43150  1.0 3.0
   29    33    48    49   0.30250  1.0 1.0
   29    33    48    49  -0.14950 -1.0 2.0
   29    33    48    49   0.36900  1.0 3.0
   29    33    39    52   0.23200  1.0 1.0
   29    33    39    52   0.02100 -1.0 2.0
   29    33    39    52   0.24950  1.0 3.0
   29    33    39    40  -0.05900  1.0 1.0
   29    33    39    40   0.08350 -1.0 2.0
   29    33    39    40   0.12500  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    44   7.00000 -1.0 2.0
   33    48    49    50   0.34800  1.0 3.0
   33    48    49    51   0.34800  1.0 3.0
   33    48   -49    52   0.46850  1.0 1.0
   33    48   -49    52   0.08550 -1.0 2.0
   33    48   -49    52   0.09800  1.0 3.0
   37    33    48    46  -0.28300  1.0 1.0
   37    33    48    46   0.26700 -1.0 2.0
   37    33    48    46  -0.63300  1.0 3.0
   37    33    48    49   0.09700  1.0 1.0
   37    33    48    49   0.15600 -1.0 2.0
   37    33    48    49  -0.50800  1.0 3.0
   37    33    39    52  -0.60800  1.0 1.0
   37    33    39    52   1.10050 -1.0 2.0
   37    33    39    52   0.47000  1.0 3.0
   37    33    39    40   0.12450  1.0 1.0
   37    33    39    40  -0.40750 -1.0 2.0
   37    33    39    40   0.30300  1.0 3.0
   37    41    42    43   1.00000 -1.0 2.0
   37    41   -42    46  -1.18350  1.0 1.0
   37    41   -42    46   1.45950 -1.0 2.0
   37    41    44    45  -0.66100  1.0 1.0
   37    41    44    45   1.20850 -1.0 2.0
   37    41    44    45  -0.36000  1.0 3.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    44   7.00000 -1.0 2.0
   41    42    46    47   0.93700 -1.0 2.0
   41    42    46    48  -1.18350  1.0 1.0
   41    42    46    48   1.45950 -1.0 2.0
   42    41    44    45   2.00000 -1.0 2.0
   42    46   -48    33   7.00000 -1.0 2.0
   42    46    48    49   7.00000 -1.0 2.0
   43    42    46    47   0.00000  1.0 1.0
   43    42    46    48   1.00000 -1.0 2.0
   46    48    49    50   0.00000  1.0 1.0
   46    48    49    51   0.00000  1.0 1.0
   46    48    49    52   0.09850  1.0 1.0
   46    48    49    52   0.15250 -1.0 2.0
   46    48    49    52  -0.50650  1.0 3.0
   47    46    48    33   7.00000 -1.0 2.0
   47    46    48    49   7.00000 -1.0 2.0
   48    33    37    38   0.00000  1.0 1.0
   48    33   -37    41  -0.28300  1.0 1.0
   48    33   -37    41   0.26700 -1.0 2.0
   48    33   -37    41  -0.63300  1.0 3.0
   48    33   -39    52  -0.60800  1.0 1.0
   48    33   -39    52   1.10050 -1.0 2.0
   48    33   -39    52   0.47000  1.0 3.0
   48    33    39    40   0.12450  1.0 1.0
   48    33    39    40  -0.40750 -1.0 2.0
   48    33    39    40   0.30300  1.0 3.0
   48    49    52    53   0.15000  1.0 3.0
   48    49   -52    39   0.59950  1.0 1.0
   48    49   -52    39  -0.21400 -1.0 2.0
   48    49   -52    39   0.56200  1.0 3.0
   48    49    52    54  -0.98800  1.0 1.0
   48    49    52    54   0.48800 -1.0 2.0
   48    49    52    54   0.76800  1.0 3.0
   49    52   -39    33   0.23450  1.0 1.0
   49    52   -39    33   0.02050 -1.0 2.0
   49    52   -39    33   0.25250  1.0 3.0
   49    52    39    40  -0.15950  1.0 1.0
   49    52    39    40   0.34650 -1.0 2.0
   49    52    39    40   0.05750  1.0 3.0
   49    52    54    55   0.00000  1.0 1.0
   49    52    54    56   0.00000  1.0 1.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    39   0.15000  1.0 3.0
   50    49    52    54  -0.03800  1.0 3.0
   51    49    52    53   0.15000  1.0 3.0
   51    49    52    39   0.15000  1.0 3.0
   51    49    52    54  -0.03800  1.0 3.0
   53    52    39    33   0.28000  1.0 3.0
   53    52    39    40   0.20000  1.0 3.0
   53    52    54    55   0.00000  1.0 1.0
   53    52    54    56   0.00000  1.0 1.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41   0.90200  1.0 1.0
   39    33    37    41   0.57900 -1.0 2.0
   39    33    37    41  -0.62100  1.0 3.0
   39    33    48    46   0.90200  1.0 1.0
   39    33    48    46   0.57900 -1.0 2.0
   39    33    48    46  -0.62100  1.0 3.0
   39    33   -48    49   0.52100  1.0 1.0
   39    33   -48    49  -0.20350 -1.0 2.0
   39    33   -48    49   0.29750  1.0 3.0
   39    52    54    55   0.30150 -1.0 2.0
   39    52    54    56   0.30150 -1.0 2.0
   54    52    39    33  -1.76800  1.0 1.0
   54    52    39    33   1.02600 -1.0 2.0
   54    52    39    33   0.19700  1.0 3.0
   54    52    39    40   0.21900  1.0 1.0
   54    52    39    40  -0.24900 -1.0 2.0
   54    52    39    40   0.15200  1.0 3.0
   44    41    42    43  -0.11900  1.0 1.0
   44    41    42    43   0.76850 -1.0 2.0
   44    41    42    43   0.14100  1.0 3.0
   44    41    42    46   1.50000 -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
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   42    44    41    37   1.10000 -1.0 2.0
   41    46    42    43  10.50000 -1.0 2.0
   42    47    46    48   1.10000 -1.0 2.0
   33    49    48    46   1.10000 -1.0 2.0
   55    52    54    56  10.50000 -1.0 2.0
END
