* LIGAND DATABASE FILE (OPLS2005)
*
001      56    55     92    138     271
    1     0 S   NP   _N1_     1    28.90130    95.97979   -23.43163
    2     1 S   H    _HN1     2     1.02826    36.25636   167.30322
    3     1 S   H    _H1_     3     1.02789   105.99392   -94.12047
    4     1 S   H    _H2_     4     1.02946    73.75686    10.79950
    5     1 S   CT   _CA1     5     1.50150   137.19592   113.53160
    6     5 S   HC   _HA1     6     1.09575   105.17523    90.14628
    7     5 S   CO3  _C1_     7     1.53791   112.16063   -30.04344
    8     7 S   O2Z  _O11     8     1.26384   115.00024   -47.86826
    9     7 S   O2Z  _O12     9     1.26203   114.95403   130.81627
   10     5 S   CT   _CB1    10     1.53053   107.34636  -151.96205
   11    10 S   HC   HB11    11     1.09842   109.43230   -48.87865
   12    10 S   HC   HB12    12     1.09804   110.51886    67.75245
   13    10 S   CT   _CG1    13     1.52978   112.53800  -169.72326
   14    13 S   HC   HG11    14     1.09580   110.76350   -65.46946
   15    13 S   HC   HG12    15     1.09659   109.65373    53.76333
   16    13 S   C    _CD1    16     1.51842   111.96422   174.18871
   17    16 S   O    _OE1    17     1.22755   123.20941    11.39537
   18    16 S   N    _N2_    18     1.38541   111.78983  -168.79728
   19    18 S   H    _HN2    19     1.01635   118.82145     2.01431
   20    18 S   CT1  _CA2    20     1.46251   123.54867   177.50880
   21    20 S   HC   _HA2    21     1.09732   109.45838     2.66580
   22    20 S   C    _C2_    22     1.53554   108.42589  -112.70797
   23    22 S   O    _O2_    23     1.23057   122.36742  -147.25097
   24    20 S   CT   _CB2    32     1.53209   111.28064   124.86977
   25    24 S   HC   HB21    33     1.09422   109.62780    53.77554
   26    24 S   HC   HB22    34     1.09502   110.84661   172.43514
   27    22 S   N    _N3_    24     1.38378   113.64996    40.45653
   28    27 S   H    _HN3    25     1.01583   119.56974    -4.13872
   29    24 S   S    _SG2    35     1.82833   111.46145   -68.31933
   30    27 S   CT   _CA3    26     1.45279   123.18607   177.01259
   31    30 S   HC   HA31    27     1.09554   107.64637   -60.62599
   32    30 S   HC   HA32    28     1.09556   107.81365    55.77350
   33    29 S   CT   _C12    36     1.83079    99.42535   156.31213
   34    33 S   HC   _H3_    37     1.09383   107.86335    38.25207
   35    30 S   CO3  _C3_    29     1.52958   114.12936   177.62760
   36    35 S   O2Z  _O31    30     1.26373   116.09587    -1.33545
   37    35 S   O2Z  _O32    31     1.26436   114.41158   178.65492
   38    33 S   CM   _C7_    38     1.49894   109.94652   159.53308
   39    38 S   HC   _H20    39     1.09052   118.11808    36.93720
   40    33 S   CO4  _C10    43     1.52333   108.23461   -82.23519
   41    40 S   O    _O13    44     1.23042   123.45107   -60.51768
   42    38 S   CMA  _C9_    40     1.51623   122.22087  -146.76380
   43    42 S   OM   _O10    41     1.26194   119.45769   175.47658
   44    42 S   OM   _O33    42     1.26208   122.11319    -4.89469
   45    40 S   CM   _C5_    45     1.49001   116.10858   119.33015
   46    45 S   HC   _H18    46     1.08570   115.84874    49.64308
   47    45 S   CM   _C4_    47     1.34137   123.96154  -127.25239
   48    47 S   HC   _H17    48     1.08650   116.20470   178.28046
   49    47 S   CM   _C6_    49     1.44786   126.66531     1.26501
   50    49 S   HC   _H19    50     1.08801   116.01438     0.30067
   51    49 S   CM   _C8_    51     1.33996   127.72880   177.75851
   52    51 S   CO3  _C11    52     1.55230   126.69883     2.66998
   53    52 S   O2Z  _O34    53     1.26707   113.84399  -145.06275
   54    52 S   O2Z  _O14    54     1.26180   116.71403    37.36646
   55    51 S   OH   _O15    55     1.39003   118.57208  -175.70801
   56    55 S   HO   _H22    56     0.97527   106.43058   173.84072
  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
  11   6   2   1   1   7   4   7   3   2   1   1   6   3   6   3
   7   3   5   4   2   1   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    40    41    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    44    40    41    45    46    47  
   38    39    42    40    41    45  
   36    37  
   37  
    0  
   39    42    43    44    40    41    45  
   42    43    44    40  
   41    45    46    47    48    49    42  
   45    46    47  
   43    44  
   44  
    0  
   46    47    48    49    50    51  
   47    48    49  
   48    49    50    51    52    55  
   49    50    51  
   50    51    52    53    54    55    56  
   51    52    55  
   52    53    54    55    56  
   53    54    55    56  
   54    55  
   55  
   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.4200   0.0150   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  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   44   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   45   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0760  -0.261500   2.0020   1.7750   0.023028004  -0.852763146
   52   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   55   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    40   317.000  1.522
   38    39   340.000  1.080
   38    42   465.000  1.376
   42    43   745.000  1.250
   42    44   745.000  1.250
   40    41   570.000  1.229
   40    45   320.000  1.462
   45    46   340.000  1.080
   45    47   549.000  1.340
   47    48   340.000  1.080
   47    49   380.000  1.444
   49    50   340.000  1.080
   49    51   549.000  1.340
   51    52   230.000  1.545
   51    55   510.000  1.338
   52    53   656.000  1.250
   52    54   656.000  1.250
   55    56   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    40    75.00000  110.18000
   33    38    39    35.00000  117.00000
   33    38    42    70.00000  124.00000
   33    40    41    80.00000  120.40000
   33    40    45    65.00000  118.62400
   38    33    34    35.00000  109.50000
   38    42    43    65.00000  137.10300
   38    42    44    65.00000  137.10300
   42    38    39    40.00000  120.50800
   44    42    43    65.00000  121.00000
   40    33    34    35.00000  109.50000
   40    33    38    70.00000  109.06800
   40    45    46    40.00000  117.72500
   40    45    47    65.00000  118.96000
   45    40    41    80.00000  123.72100
   45    47    48    35.00000  120.00000
   45    47    49    70.00000  123.01800
   47    45    46    35.00000  120.00000
   47    49    50    35.00000  120.00000
   47    49    51    70.00000  123.01800
   49    47    48    35.00000  120.00000
   49    51    52    55.00000  124.75400
   49    51    55    80.00000  121.38400
   51    49    50    35.00000  120.00000
   51    52    53    85.00000  113.83300
   51    52    54    85.00000  113.83300
   51    55    56    70.00000  107.45700
   54    52    53    80.00000  126.00000
   55    51    52    80.00000  119.00000
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    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    40    41   0.30150 -1.0 2.0
   29    33    40    45   0.65300  1.0 1.0
   29    33    40    45  -0.03850 -1.0 2.0
   29    33    40    45   0.33900  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    44   7.00000 -1.0 2.0
   33    40    45    46   0.04550  1.0 1.0
   33    40    45    46   0.83000 -1.0 2.0
   33    40    45    46  -0.04000  1.0 3.0
   33    40    45    47  -0.33500  1.0 1.0
   33    40    45    47   1.06600 -1.0 2.0
   33    40    45    47  -0.14000  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    40    41   0.00000  1.0 1.0
   34    33    40    45   0.00000  1.0 1.0
   38    33    40    41   0.30150 -1.0 2.0
   38    33    40    45   0.65300  1.0 1.0
   38    33    40    45  -0.03850 -1.0 2.0
   38    33    40    45   0.33900  1.0 3.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    44   7.00000 -1.0 2.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    42  -0.51250  1.0 1.0
   40    33    38    42  -0.88800 -1.0 2.0
   40    33    38    42   0.08850  1.0 3.0
   40    45    47    48   7.00000 -1.0 2.0
   40    45    47    49   7.00000 -1.0 2.0
   41    40    45    46   0.00000  1.0 1.0
   41    40    45    47   1.00000 -1.0 2.0
   45    47    49    50  -0.18600  1.0 3.0
   45    47    49    51   0.28850  1.0 1.0
   45    47    49    51   2.61350 -1.0 2.0
   45    47    49    51   0.78400  1.0 3.0
   46    45    47    48   7.00000 -1.0 2.0
   46    45    47    49   7.00000 -1.0 2.0
   47    49    51    52   7.00000 -1.0 2.0
   47    49    51    55   7.00000 -1.0 2.0
   48    47    49    50   0.00000  1.0 1.0
   48    47    49    51  -0.18600  1.0 3.0
   49    51    52    53  -0.04000 -1.0 2.0
   49    51    52    53  -0.29050  1.0 3.0
   49    51    52    54  -0.04000 -1.0 2.0
   49    51    52    54  -0.29050  1.0 3.0
   49    51    55    56  -0.66100  1.0 1.0
   49    51    55    56   1.20850 -1.0 2.0
   49    51    55    56  -0.36000  1.0 3.0
   50    49    51    52   7.00000 -1.0 2.0
   50    49    51    55   7.00000 -1.0 2.0
   52    51    55    56   2.00000 -1.0 2.0
   55    51    52    53   1.68800 -1.0 2.0
   55    51    52    54   1.68800 -1.0 2.0
IPHI
    9     5     7     8  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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    42  15.00000 -1.0 2.0
   43    44    42    38  15.00000 -1.0 2.0
   33    45    40    41  10.50000 -1.0 2.0
   40    46    45    47  15.00000 -1.0 2.0
   49    48    47    45  15.00000 -1.0 2.0
   47    50    49    51  15.00000 -1.0 2.0
   52    55    51    49  15.00000 -1.0 2.0
   53    51    52    54  10.50000 -1.0 2.0
END
