* LIGAND DATABASE FILE (OPLS2005)
*
001      56    57    102    161     301
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02032    99.95269    20.70337
    3     1 S   H    _H1_     3     1.02119    37.32419   128.54720
    4     1 S   H    _H2_     4     1.02150    77.99796   -86.50082
    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     1.08612   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   _C7_    36     1.83395    97.75612   161.82511
   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   CD   _C6_    37     1.50566   108.03844   179.98022
   38    37 S   CM   _C11    38     1.47425   119.71266   -83.83280
   39    38 S   HC   _H8_    39     1.08456   117.98266   166.28537
   40    37 S   NI   _N4_    48     1.29877   116.67084    95.84936
   41    38 S   CM   _C10    40     1.33747   120.21028   -13.40784
   42    40 S   CT1  _C5_    49     1.47763   105.71288     1.25819
   43    42 S   HC   _H3_    50     1.09443   110.41137  -103.41067
   44    41 S   CO4  _C9_    41     1.49306   121.39118    -3.10249
   45    44 S   O    _O33    42     1.23111   120.09359   175.79369
   46    41 S   OH   _O34    46     1.37924   120.48640   178.14048
   47    46 S   HO   _H9_    47     0.96267   109.88172  -179.95154
   48    33 S   CT   _C4_    51     1.52192   111.66502   -72.44239
   49    48 S   HC   _H4_    52     1.09770   110.93807   157.48376
   50    48 S   HC   _H5_    53     1.09649   113.85631    37.28566
   51    42 S   CO3  _C12    54     1.51082   106.56285   136.85509
   52    51 S   O2Z  _O36    55     1.26242   115.26874   -60.11462
   53    51 S   O2Z  _O35    56     1.26286   114.80637   119.87368
   54    33 S   CT   _C8_    43     1.52019   111.52085    57.63440
   55    54 S   HC   _H6_    44     1.09683   111.15384   -48.70928
   56    54 S   HC   _H7_    45     1.09771   110.97026  -167.95116
  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  12   5   4   3
  16   2   1   1  15  10   4  10   7   8   6   7   4   2   1   8
   3   2   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    54    48    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    44    54    55    56    40    42    48    49    50  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    44    45    54    55    56    40    42    43    48    49    50    51  
   35    36  
   36  
    0  
   38    39    41    44    54    55    56    46    40    42    43    48    49    50    51  
   39    41    44    45    54    46    47    40    42    48  
   41    44    46    40  
   42    43    48    49    50    51    52    53    41    54  
   44    45    54    55    56    46    47  
   43    48    49    50    51    52    53    54  
   48    49    50    51    52    53  
   45    54    55    56    46    47    48  
   54    55    56    46  
   47    54  
    0  
   49    50    51    52    53    54    55    56  
   50    51    54  
   51    54  
   52    53  
   53  
    0  
   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   0.203600   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   3.7500   0.1050   0.356900   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760  -0.118300   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   41   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   42   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   44   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   54   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   2.4200   0.0150   0.060000   1.3810   1.2100   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    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   270.000  1.508
   33    54   268.000  1.529
   33    48   268.000  1.529
   37    38   320.000  1.464
   37    40   500.000  1.261
   38    39   340.000  1.080
   38    41   549.000  1.340
   41    44   320.000  1.462
   41    46   510.000  1.338
   44    45   570.000  1.229
   44    54   317.000  1.522
   54    55   340.000  1.090
   54    56   340.000  1.090
   46    47   553.000  0.945
   40    42   315.000  1.431
   42    43   340.000  1.090
   42    48   268.000  1.529
   42    51   317.000  1.522
   48    49   340.000  1.090
   48    50   340.000  1.090
   51    52   656.000  1.250
   51    53   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    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  114.43000
   29    33    54    75.00000  111.63000
   29    33    48    75.00000  111.63000
   33    37    38    65.00000  117.24000
   33    37    40    65.00000  122.10100
   33    54    44    63.00000  111.10000
   33    54    55    37.50000  110.70000
   33    54    56    37.50000  110.70000
   33    48    42    58.35000  112.70000
   33    48    49    37.50000  110.70000
   33    48    50    37.50000  110.70000
   37    38    39    40.00000  114.85300
   37    38    41    60.00000  120.31500
   37    40    42    75.00000  114.96100
   38    41    44    65.00000  118.96000
   38    41    46    80.00000  121.38400
   41    38    39    35.00000  120.00000
   41    44    45    80.00000  123.72100
   41    44    54    65.00000  118.62400
   41    46    47    70.00000  107.45700
   44    54    55    35.00000  109.50000
   44    54    56    35.00000  109.50000
   54    33    37    70.00000  111.76100
   54    44    45    80.00000  120.40000
   56    54    55    33.00000  107.80000
   46    41    44    85.00000  116.28000
   40    37    38    70.00000  121.86000
   40    42    43    45.00000  110.38000
   40    42    48    80.00000  110.18800
   40    42    51    80.00000  108.92000
   42    48    49    37.50000  110.70000
   42    48    50    37.50000  110.70000
   42    51    52    70.00000  117.00000
   42    51    53    70.00000  117.00000
   48    33    37    70.00000  111.76100
   48    33    54    58.35000  112.70000
   48    42    43    37.50000  110.70000
   50    48    49    33.00000  107.80000
   51    42    43    35.00000  109.50000
   51    42    48    63.00000  111.10000
   53    51    52    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    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    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   0.21350  1.0 3.0
   24    29    33    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.42700  1.0 1.0
   29    33    37    38  -0.70350 -1.0 2.0
   29    33    37    38  -0.43150  1.0 3.0
   29    33    37    40   0.00000  1.0 1.0
   29    33    54    44   0.56750  1.0 1.0
   29    33    54    44  -0.07550 -1.0 2.0
   29    33    54    44   0.20000  1.0 3.0
   29    33    54    55   0.15000  1.0 3.0
   29    33    54    56   0.15000  1.0 3.0
   29    33    48    42   0.44750  1.0 1.0
   29    33    48    42  -0.17800 -1.0 2.0
   29    33    48    42   0.20200  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    50   0.15000  1.0 3.0
   33    37    38    39   0.00000  1.0 1.0
   33    37    38    41   0.69550 -1.0 2.0
   33    37   -40    42   6.00000 -1.0 2.0
   37    33    54    44  -0.98800  1.0 1.0
   37    33    54    44   0.48800 -1.0 2.0
   37    33    54    44   0.76800  1.0 3.0
   37    33    54    55   0.15000  1.0 3.0
   37    33    54    56   0.15000  1.0 3.0
   37    33   -48    42   0.34400  1.0 1.0
   37    33   -48    42   0.09450 -1.0 2.0
   37    33   -48    42   0.11100  1.0 3.0
   37    33    48    49   0.15000  1.0 3.0
   37    33    48    50   0.15000  1.0 3.0
   37    38   -41    44   7.00000 -1.0 2.0
   37    38    41    46   7.00000 -1.0 2.0
   37    40    42    43  -0.15000  1.0 3.0
   37    40   -42    48  -0.12500  1.0 1.0
   37    40   -42    48  -0.12500 -1.0 2.0
   37    40   -42    48   0.25000  1.0 3.0
   37    40    42    51  -0.12500  1.0 1.0
   37    40    42    51  -0.12500 -1.0 2.0
   37    40    42    51   0.25000  1.0 3.0
   38    37    40    42   6.00000 -1.0 2.0
   38    41    44    45   1.00000 -1.0 2.0
   38    41    44    54  -0.33500  1.0 1.0
   38    41    44    54   1.06600 -1.0 2.0
   38    41    44    54  -0.14000  1.0 3.0
   38    41    46    47  -0.66100  1.0 1.0
   38    41    46    47   1.20850 -1.0 2.0
   38    41    46    47  -0.36000  1.0 3.0
   39    38    41    44   7.00000 -1.0 2.0
   39    38    41    46   7.00000 -1.0 2.0
   41    44   -54    33   0.65300  1.0 1.0
   41    44   -54    33  -0.03850 -1.0 2.0
   41    44   -54    33   0.33900  1.0 3.0
   41    44    54    55   0.00000  1.0 1.0
   41    44    54    56   0.00000  1.0 1.0
   44    41    46    47   2.00000 -1.0 2.0
   45    44    54    33   0.30150 -1.0 2.0
   45    44    54    55   0.00000  1.0 1.0
   45    44    54    56   0.00000  1.0 1.0
   54    33   -37    38   0.09850  1.0 1.0
   54    33   -37    38   0.15250 -1.0 2.0
   54    33   -37    38  -0.50650  1.0 3.0
   54    33    37    40   0.00000  1.0 1.0
   54    33    48    42   0.56750  1.0 1.0
   54    33    48    42  -0.07550 -1.0 2.0
   54    33    48    42   0.20000  1.0 3.0
   54    33    48    49   0.15000  1.0 3.0
   54    33    48    50   0.15000  1.0 3.0
   46    41    44    45  -0.11900  1.0 1.0
   46    41    44    45   0.76850 -1.0 2.0
   46    41    44    45   0.14100  1.0 3.0
   46    41    44    54   0.32450 -1.0 2.0
   46    41    44    54   0.17400  1.0 3.0
   40    37    38    39   1.00600 -1.0 2.0
   40    37    38    41   1.09650  1.0 1.0
   40    37    38    41   0.48950 -1.0 2.0
   40    37    38    41   0.49400  1.0 3.0
   40    42   -48    33   0.56750  1.0 1.0
   40    42   -48    33  -0.07550 -1.0 2.0
   40    42   -48    33   0.20000  1.0 3.0
   40    42    48    49   0.15000  1.0 3.0
   40    42    48    50   0.15000  1.0 3.0
   40    42    51    52   0.30150 -1.0 2.0
   40    42    51    53   0.30150 -1.0 2.0
   43    42    48    33   0.15000  1.0 3.0
   43    42    48    49   0.15000  1.0 3.0
   43    42    48    50   0.15000  1.0 3.0
   43    42    51    52   0.00000  1.0 1.0
   43    42    51    53   0.00000  1.0 1.0
   48    33    37    38   0.09850  1.0 1.0
   48    33    37    38   0.15250 -1.0 2.0
   48    33    37    38  -0.50650  1.0 3.0
   48    33   -37    40   0.00000  1.0 1.0
   48    33    54    44  -0.95700  1.0 1.0
   48    33    54    44  -0.18200 -1.0 2.0
   48    33    54    44   0.29450  1.0 3.0
   48    33    54    55   0.15000  1.0 3.0
   48    33    54    56   0.15000  1.0 3.0
   48    42    51    52   0.00000  1.0 1.0
   48    42    51    53   0.00000  1.0 1.0
   51    42    48    33  -0.84850  1.0 1.0
   51    42    48    33  -0.22800 -1.0 2.0
   51    42    48    33   0.29250  1.0 3.0
   51    42    48    49  -0.03800  1.0 3.0
   51    42    48    50  -0.03800  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    40  10.50000 -1.0 2.0
   37    39    38    41   1.10000 -1.0 2.0
   44    46    41    38   1.10000 -1.0 2.0
   41    54    44    45  10.50000 -1.0 2.0
   52    42    51    53  10.50000 -1.0 2.0
END
