* LIGAND DATABASE FILE (OPLS2005)
*
001      58    58    106    158     313
    1     0 S   NP   _N1_     1    28.73840    95.80868   -23.25695
    2     1 S   H    _HN1     2     1.02784   103.84984   -93.05708
    3     1 S   H    _H1_     3     1.02950    75.84386    12.74836
    4     1 S   H    _H2_     4     1.02828    34.99017   165.43683
    5     1 S   CT   _CA1     5     1.50107   138.21453   117.66357
    6     5 S   HC   _HA1     6     1.09572   105.20862    86.22919
    7     5 S   CO3  _C1_     7     1.53794   112.45396   -34.02552
    8     7 S   O2Z  _O11     8     1.26371   115.00938   -42.84065
    9     7 S   O2Z  _O12     9     1.26240   114.94853   136.33114
   10     5 S   CT   _CB1    10     1.53084   107.42542  -155.78180
   11    10 S   HC   HB11    11     1.09831   109.39385   -49.80927
   12    10 S   HC   HB12    12     1.09813   110.43697    66.80321
   13    10 S   CT   _CG1    13     1.52984   112.59277  -170.79585
   14    13 S   HC   HG11    14     1.09584   110.60444   -65.01668
   15    13 S   HC   HG12    15     1.09669   109.81085    54.20722
   16    13 S   C    _CD1    16     1.51798   112.27205   174.66737
   17    16 S   O    _OE1    17     1.22726   123.30302     5.50289
   18    16 S   N    _N2_    18     1.38652   111.63436  -174.58456
   19    18 S   H    _HN2    19     1.01580   118.93191     1.88668
   20    18 S   CT1  _CA2    20     1.46206   123.41956   177.84042
   21    20 S   HC   _HA2    21     1.09735   109.36401     1.99351
   22    20 S   C    _C2_    22     1.53546   108.58916  -113.49070
   23    22 S   O    _O2_    23     1.23055   122.31171  -147.92094
   24    20 S   CT   _CB2    32     1.53294   111.55107   124.00173
   25    24 S   HC   HB21    33     1.09598   110.15261    56.07233
   26    24 S   HC   HB22    34     1.09502   110.16062   175.18566
   27    22 S   N    _N3_    24     1.38338   113.68805    39.53015
   28    27 S   H    _HN3    25     1.01587   119.57929    -3.33184
   29    24 S   S    _SG2    35     1.82701   111.60606   -64.85026
   30    27 S   CT   _CA3    26     1.45285   123.19772   177.10991
   31    30 S   HC   HA31    27     1.09549   107.50950   -64.55912
   32    30 S   HC   HA32    28     1.09557   107.98484    51.87601
   33    29 S   CT   _C9_    36     1.82824    98.94339   174.78744
   34    33 S   HC   _H5_    37     1.09638   107.28657   -59.62604
   35    30 S   CO3  _C3_    29     1.52955   114.08901   173.87318
   36    35 S   O2Z  _O31    30     1.26375   116.07005    -0.71382
   37    35 S   O2Z  _O32    31     1.26429   114.41086   179.34778
   38    33 S   CT   _C8_    38     1.53396   108.85070  -179.15907
   39    38 S   HC   _H9_    39     1.09849   109.85808   -58.86635
   40    38 S   HC   _H10    40     1.09762   109.69320    59.92186
   41    38 S   CT   _C7_    41     1.53928   110.74610  -178.66572
   42    41 S   CT   _C6_    42     1.54417   109.31413    52.06963
   43    42 S   HC   _H4_    43     1.09821   108.82291    67.82731
   44    41 S   CT   _C10    53     1.53091   110.66691   175.98785
   45    44 S   HC   _H11    54     1.09522   111.36779   172.68045
   46    44 S   HC   _H12    55     1.09624   110.71526    54.96913
   47    44 S   HC   _H13    56     1.09467   111.57568   -65.61425
   48    41 S   OH   _O34    57     1.43282   108.33718   -66.24859
   49    48 S   HO   _H14    58     0.97266   108.11014   -62.85358
   50    42 S   CT   _C5_    44     1.53671   110.82275   -51.69376
   51    50 S   HC   _H3_    45     1.09775   110.81824   -64.88983
   52    42 S   OH   _O35    51     1.42496   111.32454  -173.43296
   53    52 S   HO   _H15    52     0.97149   107.95887   -65.70339
   54    33 S   OS   _O33    46     1.42763   110.85166    59.72645
   55    50 S   CT   _C4_    47     1.52590   111.76296   175.21644
   56    55 S   HC   _H6_    48     1.09564   110.93445   -59.68292
   57    55 S   HC   _H7_    49     1.09561   110.25423  -177.52061
   58    55 S   HC   _H8_    50     1.09391   111.74293    61.85549
  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
  12   6   2   1   1  14   6   5  14  16   8   7   3   2   1   3
   1   8   6   3   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    54    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    50    54  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    50    51    54    55    44    48  
   38    39    40    41    50    54  
   36    37  
   37  
    0  
   39    40    41    42    43    50    54    52    44    45    46    47    48    49  
   40    41    42    54    44    48  
   41    42    54    44    48  
   42    43    50    51    54    55    52    53    44    45    46    47    48    49  
   43    50    51    54    55    56    57    58    52    53    44    45    46    47    48    49  
   50    51    54    55    52    53    44    48  
   45    46    47    48    49    50    52  
   46    47    48  
   47    48  
   48  
   49    50    52  
    0  
   51    54    55    56    57    58    52    53  
   54    55    56    57    58    52  
   53    54    55  
    0  
   55    56    57    58  
   56    57    58  
   57    58  
   58  
    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  -0.316400   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   0.318900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   54   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   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    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   268.000  1.529
   33    54   320.000  1.410
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   268.000  1.529
   41    42   268.000  1.529
   41    44   268.000  1.529
   41    48   320.000  1.410
   42    43   340.000  1.090
   42    50   268.000  1.529
   42    52   320.000  1.410
   50    51   340.000  1.090
   50    54   320.000  1.410
   50    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   52    53   553.000  0.945
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   48    49   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  111.63000
   29    33    54    85.00000  114.68000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    54    50    60.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    42    58.35000  112.70000
   38    41    44    58.35000  112.70000
   38    41    48    50.00000  109.50000
   40    38    39    33.00000  107.80000
   41    38    39    37.50000  110.70000
   41    38    40    37.50000  110.70000
   41    42    43    37.50000  110.70000
   41    42    50    58.35000  112.70000
   41    42    52    50.00000  109.50000
   41    44    45    37.50000  110.70000
   41    44    46    37.50000  110.70000
   41    44    47    37.50000  110.70000
   41    48    49    55.00000  108.50000
   42    50    51    37.50000  110.70000
   42    50    54    50.00000  109.50000
   42    50    55    58.35000  112.70000
   42    52    53    55.00000  108.50000
   50    42    43    37.50000  110.70000
   50    55    56    37.50000  110.70000
   50    55    57    37.50000  110.70000
   50    55    58    37.50000  110.70000
   54    33    34    35.00000  109.50000
   54    33    38    50.00000  109.50000
   54    50    51    35.00000  109.50000
   55    50    51    37.50000  110.70000
   55    50    54    50.00000  109.50000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   52    42    43    35.00000  109.50000
   52    42    50    50.00000  109.50000
   44    41    42    58.35000  112.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   48    41    42    50.00000  109.50000
   48    41    44    50.00000  109.50000
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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    54   0.13850  1.0 1.0
   24    29    33    54  -1.34450 -1.0 2.0
   24    29    33    54   0.57400  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   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    54    50   0.14700  1.0 1.0
   29    33    54    50  -1.16150 -1.0 2.0
   29    33    54    50   0.48700  1.0 3.0
   33    38    41    42   0.56750  1.0 1.0
   33    38    41    42  -0.07550 -1.0 2.0
   33    38    41    42   0.20000  1.0 3.0
   33    38    41    44   0.56750  1.0 1.0
   33    38    41    44  -0.07550 -1.0 2.0
   33    38    41    44   0.20000  1.0 3.0
   33    38    41    48   0.86500  1.0 1.0
   33    38    41    48  -0.17500 -1.0 2.0
   33    38    41    48   0.20800  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    54    50   0.37050  1.0 3.0
   38    33    54    50   0.06250  1.0 1.0
   38    33    54    50  -0.01100 -1.0 2.0
   38    33    54    50   0.28050  1.0 3.0
   38    41    42    43   0.15000  1.0 3.0
   38    41   -42    50   0.56750  1.0 1.0
   38    41   -42    50  -0.07550 -1.0 2.0
   38    41   -42    50   0.20000  1.0 3.0
   38    41    42    52   0.86500  1.0 1.0
   38    41    42    52  -0.17500 -1.0 2.0
   38    41    42    52   0.20800  1.0 3.0
   38    41    44    45   0.15000  1.0 3.0
   38    41    44    46   0.15000  1.0 3.0
   38    41    44    47   0.15000  1.0 3.0
   38    41    48    49  -0.11600  1.0 1.0
   38    41    48    49  -0.09450 -1.0 2.0
   38    41    48    49   0.21250  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    44   0.15000  1.0 3.0
   39    38    41    48   0.23400  1.0 3.0
   40    38    41    42   0.15000  1.0 3.0
   40    38    41    44   0.15000  1.0 3.0
   40    38    41    48   0.23400  1.0 3.0
   41    42    50    51   0.15000  1.0 3.0
   41    42    50    54   0.62750  1.0 1.0
   41    42    50    54  -0.30950 -1.0 2.0
   41    42    50    54   0.27300  1.0 3.0
   41    42    50    55   0.56750  1.0 1.0
   41    42    50    55  -0.07550 -1.0 2.0
   41    42    50    55   0.20000  1.0 3.0
   41    42    52    53  -0.11600  1.0 1.0
   41    42    52    53  -0.09450 -1.0 2.0
   41    42    52    53   0.21250  1.0 3.0
   42    41    44    45   0.15000  1.0 3.0
   42    41    44    46   0.15000  1.0 3.0
   42    41    44    47   0.15000  1.0 3.0
   42    41    48    49  -0.11600  1.0 1.0
   42    41    48    49  -0.09450 -1.0 2.0
   42    41    48    49   0.21250  1.0 3.0
   42    50   -54    33   0.06250  1.0 1.0
   42    50   -54    33  -0.01100 -1.0 2.0
   42    50   -54    33   0.28050  1.0 3.0
   42    50    55    56   0.15000  1.0 3.0
   42    50    55    57   0.15000  1.0 3.0
   42    50    55    58   0.15000  1.0 3.0
   43    42    50    51   0.15000  1.0 3.0
   43    42    50    54   0.23400  1.0 3.0
   43    42    50    55   0.15000  1.0 3.0
   43    42    52    53   0.19450  1.0 3.0
   50    42    52    53  -0.11600  1.0 1.0
   50    42    52    53  -0.09450 -1.0 2.0
   50    42    52    53   0.21250  1.0 3.0
   51    50    54    33   0.37050  1.0 3.0
   51    50    55    56   0.15000  1.0 3.0
   51    50    55    57   0.15000  1.0 3.0
   51    50    55    58   0.15000  1.0 3.0
   54    33    38    39   0.23400  1.0 3.0
   54    33    38    40   0.23400  1.0 3.0
   54    33   -38    41   0.62750  1.0 1.0
   54    33   -38    41  -0.30950 -1.0 2.0
   54    33   -38    41   0.27300  1.0 3.0
   54    50    55    56   0.23400  1.0 3.0
   54    50    55    57   0.23400  1.0 3.0
   54    50    55    58   0.23400  1.0 3.0
   55    50    54    33   0.06250  1.0 1.0
   55    50    54    33  -0.01100 -1.0 2.0
   55    50    54    33   0.28050  1.0 3.0
   52    42    50    51   0.23400  1.0 3.0
   52    42    50    54   3.69350  1.0 1.0
   52    42    50    54  -1.82950 -1.0 2.0
   52    42    50    55   0.86500  1.0 1.0
   52    42    50    55  -0.17500 -1.0 2.0
   52    42    50    55   0.20800  1.0 3.0
   44    41    42    43   0.15000  1.0 3.0
   44    41    42    50   0.56750  1.0 1.0
   44    41    42    50  -0.07550 -1.0 2.0
   44    41    42    50   0.20000  1.0 3.0
   44    41    42    52   0.86500  1.0 1.0
   44    41    42    52  -0.17500 -1.0 2.0
   44    41    42    52   0.20800  1.0 3.0
   44    41    48    49  -0.11600  1.0 1.0
   44    41    48    49  -0.09450 -1.0 2.0
   44    41    48    49   0.21250  1.0 3.0
   48    41    42    43   0.23400  1.0 3.0
   48    41    42    50   0.86500  1.0 1.0
   48    41    42    50  -0.17500 -1.0 2.0
   48    41    42    50   0.20800  1.0 3.0
   48    41    42    52   3.75450  1.0 1.0
   48    41    44    45   0.23400  1.0 3.0
   48    41    44    46   0.23400  1.0 3.0
   48    41    44    47   0.23400  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
   36    30    35    37  10.50000 -1.0 2.0
END
