* LIGAND DATABASE FILE (OPLS2005)
*
001      57    57     99    153     294
    1     0 S   NP   _N1_     1    28.76318    96.26812   -23.73588
    2     1 S   H    _HN1     2     1.02790   108.23612   -98.59274
    3     1 S   H    _H1_     3     1.02948    73.09996     5.67858
    4     1 S   H    _H2_     4     1.02828    36.00067   165.87204
    5     1 S   CT   _CA1     5     1.50112   135.18069   107.89986
    6     5 S   HC   _HA1     6     1.09573   105.18718    91.48503
    7     5 S   CO3  _C1_     7     1.53780   112.43054   -28.75254
    8     7 S   O2Z  _O11     8     1.26373   115.01356   -43.47709
    9     7 S   O2Z  _O12     9     1.26235   114.94137   135.59313
   10     5 S   CT   _CB1    10     1.53069   107.41374  -150.54800
   11    10 S   HC   HB11    11     1.09837   109.36453   -49.59312
   12    10 S   HC   HB12    12     1.09811   110.46267    67.00864
   13    10 S   CT   _CG1    13     1.53005   112.61435  -170.54260
   14    13 S   HC   HG11    14     1.09577   110.67769   -66.07377
   15    13 S   HC   HG12    15     1.09670   109.74758    53.16652
   16    13 S   C    _CD1    16     1.51809   112.11306   173.63887
   17    16 S   O    _OE1    17     1.22748   123.22070     9.17136
   18    16 S   N    _N2_    18     1.38626   111.73628  -170.84067
   19    18 S   H    _HN2    19     1.01591   119.06203     1.30791
   20    18 S   CT1  _CA2    20     1.46267   123.46468   177.52995
   21    20 S   HC   _HA2    21     1.09741   109.19488     7.18583
   22    20 S   C    _C2_    22     1.53693   109.28059  -108.32593
   23    22 S   O    _O2_    23     1.23087   122.18639  -152.62166
   24    20 S   CT   _CB2    32     1.53323   111.33968   129.01289
   25    24 S   HC   HB21    33     1.09535   109.80709    56.05362
   26    24 S   HC   HB22    34     1.09510   110.43451   175.12484
   27    22 S   N    _N3_    24     1.38310   113.98150    35.01971
   28    27 S   H    _HN3    25     1.01536   119.55415    -3.74031
   29    24 S   S    _SG2    35     1.82911   111.27978   -65.23634
   30    27 S   CT   _CA3    26     1.45274   123.28848   177.04402
   31    30 S   HC   HA31    27     1.09548   107.54385   -63.94065
   32    30 S   HC   HA32    28     1.09555   107.96330    52.51353
   33    29 S   CT   _C10    36     1.84037    99.32300   176.56607
   34    33 S   HC   _H5_    37     1.09464   105.49294    47.09497
   35    30 S   CO3  _C3_    29     1.52972   114.03895   174.47941
   36    35 S   O2Z  _O31    30     1.26383   116.06734    -0.58917
   37    35 S   O2Z  _O32    31     1.26425   114.41959   179.47251
   38    33 S   CM   _C8_    38     1.52196   109.51821   164.00703
   39    33 S   CM   _C11    53     1.50462   109.68101   -72.02866
   40    39 S   HC   _H9_    54     1.09066   117.68767   -50.04131
   41    38 S   CM   _C9_    39     1.34783   123.50806    67.93458
   42    41 S   HC   _H8_    40     1.08578   121.13326    -0.59873
   43    39 S   CMA  _C12    55     1.51506   122.94947   130.02025
   44    43 S   OM   _O33    56     1.26219   119.34409  -171.47127
   45    43 S   OM   _O34    57     1.26179   122.25144     8.81592
   46    41 S   CM   _C4_    41     1.43974   122.45963  -179.00083
   47    46 S   HC   _H6_    42     1.08475   117.74400   172.49530
   48    46 S   CM   _C5_    43     1.33811   121.56199    -8.94266
   49    48 S   HC   _H7_    44     1.08588   119.46689  -178.53046
   50    48 S   CT   _C6_    45     1.50197   122.41974     1.15792
   51    50 S   HC   _H3_    46     1.09655   108.48402   135.00731
   52    38 S   CT   _C7_    47     1.51916   115.89673  -112.93979
   53    52 S   HC   _H4_    48     1.09757   108.56561   -44.75398
   54    50 S   OH   _O36    51     1.42962   108.02064  -109.40852
   55    54 S   HO   _H11    52     0.97211   107.91415   -53.51297
   56    52 S   OH   _O35    49     1.43178   107.11053    70.75635
   57    56 S   HO   _H10    50     0.97226   107.16602  -166.91106
  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
  14   6   2   1   1  15   6   3   9   4   2   1   1   7   3   8
   4   7   5   5   3   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    52    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    46    50    52    53    56    39    40    43    44    45  
   38    41    52    39    40    43  
   36    37  
   37  
    0  
   41    42    46    47    48    50    51    52    53    56    57    54    39    40    43  
   40    43    44    45    41    52  
   43    44    45  
   42    46    47    48    49    50    52    53    56  
   46    47    48    52  
   44    45  
   45  
    0  
   47    48    49    50    51    52    54  
   48    49    50  
   49    50    51    52    53    56    54    55  
   50    51    52    54  
   51    52    53    56    57    54    55  
   52    53    56    54    55  
   53    56    57    54    55  
   56    57    54  
   55    56  
    0  
   57  
    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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   45   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   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  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.418000   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    39   317.000  1.510
   38    41   549.000  1.340
   38    52   317.000  1.510
   41    42   340.000  1.080
   41    46   380.000  1.444
   46    47   340.000  1.080
   46    48   549.000  1.340
   48    49   340.000  1.080
   48    50   317.000  1.510
   50    51   340.000  1.090
   50    52   268.000  1.529
   50    54   320.000  1.410
   52    53   340.000  1.090
   52    56   320.000  1.410
   56    57   553.000  0.945
   54    55   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    45   745.000  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  112.20000
   33    38    41    70.00000  124.00000
   33    38    52    65.00000  117.92700
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    46    70.00000  123.01800
   38    52    50    70.00000  112.02700
   38    52    53    35.00000  109.50000
   38    52    56    90.00000  110.39200
   41    46    47    35.00000  120.00000
   41    46    48    70.00000  123.01800
   46    41    42    35.00000  120.00000
   46    48    49    35.00000  120.00000
   46    48    50    70.00000  124.00000
   48    46    47    35.00000  120.00000
   48    50    51    35.00000  109.50000
   48    50    52    70.00000  112.02700
   48    50    54    90.00000  110.39200
   50    48    49    35.00000  117.00000
   50    52    53    37.50000  110.70000
   50    52    56    50.00000  109.50000
   50    54    55    55.00000  108.50000
   52    38    41    70.00000  124.00000
   52    50    51    37.50000  110.70000
   52    56    57    55.00000  108.50000
   56    52    53    35.00000  109.50000
   54    50    51    35.00000  109.50000
   54    50    52    50.00000  109.50000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  110.12100
   39    43    44    65.00000  137.10300
   39    43    45    65.00000  137.10300
   43    39    40    40.00000  120.50800
   45    43    44    65.00000  121.00000
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    41   0.42700  1.0 1.0
   29    33    38    41  -0.70350 -1.0 2.0
   29    33    38    41  -0.43150  1.0 3.0
   29    33    38    52   0.30250  1.0 1.0
   29    33    38    52  -0.14950 -1.0 2.0
   29    33    38    52   0.36900  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    46   7.00000 -1.0 2.0
   33    38    52    50   0.46850  1.0 1.0
   33    38    52    50   0.08550 -1.0 2.0
   33    38    52    50   0.09800  1.0 3.0
   33    38    52    53   0.34800  1.0 3.0
   33    38    52    56   0.18000  1.0 1.0
   33    38    52    56   0.16450 -1.0 2.0
   33    38    52    56   0.04450  1.0 3.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    45   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    52   0.34800  1.0 3.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43  -0.28300  1.0 1.0
   38    33    39    43   0.26700 -1.0 2.0
   38    33    39    43  -0.63300  1.0 3.0
   38    41    46    47  -0.18600  1.0 3.0
   38    41    46    48   0.28850  1.0 1.0
   38    41    46    48   2.61350 -1.0 2.0
   38    41    46    48   0.78400  1.0 3.0
   38    52    56    57  -0.07800  1.0 1.0
   38    52    56    57  -0.21500 -1.0 2.0
   38    52    56    57  -0.03150  1.0 3.0
   41    38    52    50   0.09850  1.0 1.0
   41    38    52    50   0.15250 -1.0 2.0
   41    38    52    50  -0.50650  1.0 3.0
   41    38    52    53   0.00000  1.0 1.0
   41    38    52    56   0.67800  1.0 1.0
   41    38    52    56   0.47050 -1.0 2.0
   41    38    52    56  -0.62500  1.0 3.0
   41    46    48    49   7.00000 -1.0 2.0
   41    46   -48    50   7.00000 -1.0 2.0
   42    41    46    47   0.00000  1.0 1.0
   42    41    46    48  -0.18600  1.0 3.0
   46    48    50    51   0.00000  1.0 1.0
   46    48    50    52   0.09850  1.0 1.0
   46    48    50    52   0.15250 -1.0 2.0
   46    48    50    52  -0.50650  1.0 3.0
   46    48    50    54   0.67800  1.0 1.0
   46    48    50    54   0.47050 -1.0 2.0
   46    48    50    54  -0.62500  1.0 3.0
   47    46    48    49   7.00000 -1.0 2.0
   47    46    48    50   7.00000 -1.0 2.0
   48    50   -52    38   0.31000  1.0 1.0
   48    50   -52    38   0.14700 -1.0 2.0
   48    50   -52    38   0.07550  1.0 3.0
   48    50    52    53   0.15000  1.0 3.0
   48    50    52    56   1.05650  1.0 1.0
   48    50    52    56   0.15600 -1.0 2.0
   48    50    52    56   0.53150  1.0 3.0
   48    50    54    55  -0.07800  1.0 1.0
   48    50    54    55  -0.21500 -1.0 2.0
   48    50    54    55  -0.03150  1.0 3.0
   49    48    50    51   0.33100  1.0 3.0
   49    48    50    52   0.00000  1.0 1.0
   49    48    50    54   0.00000  1.0 1.0
   50    52    56    57  -0.11600  1.0 1.0
   50    52    56    57  -0.09450 -1.0 2.0
   50    52    56    57   0.21250  1.0 3.0
   51    50    52    38   0.15000  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    56   0.23400  1.0 3.0
   51    50    54    55   0.19450  1.0 3.0
   52    38    41    42   7.00000 -1.0 2.0
   52    38   -41    46   7.00000 -1.0 2.0
   52    50    54    55  -0.11600  1.0 1.0
   52    50    54    55  -0.09450 -1.0 2.0
   52    50    54    55   0.21250  1.0 3.0
   53    52    56    57   0.19450  1.0 3.0
   54    50    52    38   1.05650  1.0 1.0
   54    50    52    38   0.15600 -1.0 2.0
   54    50    52    38   0.53150  1.0 3.0
   54    50    52    53   0.23400  1.0 3.0
   54    50    52    56   3.75450  1.0 1.0
   39    33    38    41  -0.28300  1.0 1.0
   39    33    38    41   0.26700 -1.0 2.0
   39    33    38    41  -0.63300  1.0 3.0
   39    33    38    52   0.09700  1.0 1.0
   39    33    38    52   0.15600 -1.0 2.0
   39    33    38    52  -0.50800  1.0 3.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    45   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    52    38    41   1.10000 -1.0 2.0
   46    42    41    38   1.10000 -1.0 2.0
   41    47    46    48   1.10000 -1.0 2.0
   50    49    48    46   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   44    45    43    39  15.00000 -1.0 2.0
END
