* LIGAND DATABASE FILE (OPLS2005)
*
001      58    58    104    158     311
    1     0 S   NP   _N1_     1    28.93512    94.91597   -23.06847
    2     1 S   H    _HN1     2     1.02949    81.53069    16.50204
    3     1 S   H    _H1_     3     1.02833    29.97979   164.98868
    4     1 S   H    _H2_     4     1.02784   102.31814   -90.54826
    5     1 S   CT   _CA1     5     1.50102   136.36391   127.31596
    6     5 S   HC   _HA1     6     1.09572   105.22767    78.26217
    7     5 S   CO3  _C1_     7     1.53800   112.37004   -42.04239
    8     7 S   O2Z  _O11     8     1.26376   115.00291   -44.70769
    9     7 S   O2Z  _O12     9     1.26234   114.93749   134.44462
   10     5 S   CT   _CB1    10     1.53089   107.45327  -163.73678
   11    10 S   HC   HB11    11     1.09830   109.45488   -49.70793
   12    10 S   HC   HB12    12     1.09816   110.42808    66.91280
   13    10 S   CT   _CG1    13     1.53000   112.56034  -170.67218
   14    13 S   HC   HG11    14     1.09586   110.60738   -63.87401
   15    13 S   HC   HG12    15     1.09665   109.83120    55.35569
   16    13 S   C    _CD1    16     1.51791   112.23973   175.86895
   17    16 S   O    _OE1    17     1.22741   123.26694     5.33039
   18    16 S   N    _N2_    18     1.38642   111.66665  -175.03114
   19    18 S   H    _HN2    19     1.01597   119.02337     1.22621
   20    18 S   CT1  _CA2    20     1.46098   123.32163   178.54882
   21    20 S   HC   _HA2    21     1.09576   109.26109    -5.01356
   22    20 S   C    _C2_    22     1.53466   108.69225  -120.02912
   23    22 S   O    _O2_    23     1.23043   122.26977  -149.29678
   24    20 S   CT   _CB2    32     1.53317   111.72879   117.44170
   25    24 S   HC   HB21    33     1.09651   109.64921    61.11481
   26    24 S   HC   HB22    34     1.09564   111.00674   178.57330
   27    22 S   N    _N3_    24     1.38336   113.58784    38.29456
   28    27 S   H    _HN3    25     1.01622   119.50801    -3.71003
   29    24 S   S    _SG2    35     1.82851   114.35485   -58.65953
   30    27 S   CT   _CA3    26     1.45281   123.18174   176.92578
   31    30 S   HC   HA31    27     1.09549   107.54913   -63.45392
   32    30 S   HC   HA32    28     1.09557   107.93373    52.96841
   33    29 S   CT   _C4_    36     1.82866    99.75796   -68.77761
   34    33 S   HC   _H8_    37     1.09499   108.05688   -55.76685
   35    33 S   HC   _H9_    38     1.09248   108.38382    62.59623
   36    30 S   CO3  _C3_    29     1.52946   114.09365   174.93140
   37    36 S   O2Z  _O31    30     1.26373   116.05042    -0.67406
   38    36 S   O2Z  _O32    31     1.26426   114.41551   179.38166
   39    33 S   CT   _C5_    39     1.53612   110.55337  -176.45597
   40    39 S   HC   _H3_    40     1.09922   108.95835   -51.34642
   41    39 S   CT   _C6_    41     1.53914   110.91944  -172.01117
   42    41 S   HC   _H4_    42     1.09786   109.29615   -55.78542
   43    41 S   CT   _C7_    43     1.53614   110.47818  -176.20899
   44    43 S   HC   _H5_    44     1.09810   109.48985   -70.65584
   45    41 S   OH   _O36    57     1.42691   110.11929    62.45657
   46    45 S   HO   _H14    58     0.97253   108.20470    59.20491
   47    43 S   CT   _C8_    45     1.53477   111.08807    50.49594
   48    47 S   HC   _H6_    46     1.09761   110.18330    72.05013
   49    43 S   NTH2 _N4_    54     1.46786   110.05709   172.57075
   50    49 S   H    _H12    55     1.01943   109.47835   177.08691
   51    49 S   H    _H13    56     1.01944   109.49075    60.15734
   52    47 S   CO   _C9_    47     1.53347   110.95375   -48.99042
   53    52 S   HC   _H7_    48     1.09726   111.02987   -68.61187
   54    47 S   OH   _O35    52     1.43001   109.62547  -170.30349
   55    54 S   HO   _H11    53     0.97220   108.14831    63.02308
   56    39 S   OS   _O33    49     1.43117   108.53839    68.05346
   57    52 S   OH   _O34    50     1.42560   108.24880   173.71615
   58    57 S   HO   _H10    51     0.97187   106.70749   160.37983
  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   7   5   4   3
  10   5   4   2   1   1  13   6  13   7  14   8   4   1  11   7
   4   1   1   6   4   3   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    56  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    52    56    45  
   35    39    40    41    56  
   39    40    41    56  
   37    38  
   38  
    0  
   40    41    42    43    44    47    52    53    56    57    49    45    46  
   41    42    43    52    56    45  
   42    43    44    47    48    52    56    54    49    50    51    45    46  
   43    44    47    56    49    45    46  
   44    47    48    52    53    56    57    54    55    49    50    51    45    46  
   47    48    52    54    49    50    51    45  
   46    47    49    56  
    0  
   48    52    53    56    57    58    54    55    49    50    51  
   52    53    56    57    54    55    49  
   50    51    52    54  
   51  
    0  
   53    56    57    58    54    55  
   56    57    58    54  
   55    56    57  
    0  
   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  -0.335000   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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   46   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   47   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   50   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   51   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5000   0.0660   0.264700   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.100000   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   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   57   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   58   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    56   320.000  1.410
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    45   320.000  1.410
   43    44   340.000  1.090
   43    47   268.000  1.529
   43    49   300.000  1.468
   47    48   340.000  1.090
   47    52   250.000  1.527
   47    54   320.000  1.410
   52    53   340.000  1.090
   52    56   320.000  1.380
   52    57   380.000  1.407
   57    58   553.000  0.945
   54    55   553.000  0.945
   49    50   495.000  1.019
   49    51   495.000  1.019
   45    46   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    56    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    58.35000  112.70000
   39    41    45    50.00000  109.50000
   39    56    52    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    47    58.35000  112.70000
   41    43    49    80.00000  112.76400
   41    45    46    55.00000  108.50000
   43    41    42    37.50000  110.70000
   43    47    48    37.50000  110.70000
   43    47    52    75.00000  109.43000
   43    47    54    50.00000  109.50000
   43    49    50    50.00000  110.30900
   43    49    51    50.00000  110.30900
   47    43    44    37.50000  110.70000
   47    52    53    45.00000  112.01100
   47    52    56    90.00000  108.56700
   47    52    57    90.00000  110.19100
   47    54    55    55.00000  108.50000
   52    47    48    45.00000  108.72000
   52    57    58    70.00000  107.92000
   56    39    40    35.00000  109.50000
   56    39    41    50.00000  109.50000
   56    52    53    35.00000  109.50000
   57    52    53    60.00000  108.02500
   57    52    56   110.00000  112.08000
   54    47    48    35.00000  109.50000
   54    47    52    90.00000  111.58700
   49    43    44    50.00000  110.79000
   49    43    47    80.00000  112.76400
   51    49    50    40.00000  106.77200
   45    41    42    35.00000  109.50000
   45    41    43    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    56   0.56750  1.0 1.0
   29    33    39    56  -0.07550 -1.0 2.0
   29    33    39    56   0.20000  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    43   0.56750  1.0 1.0
   33    39    41    43  -0.07550 -1.0 2.0
   33    39    41    43   0.20000  1.0 3.0
   33    39    41    45   0.86500  1.0 1.0
   33    39    41    45  -0.17500 -1.0 2.0
   33    39    41    45   0.20800  1.0 3.0
   33    39    56    52   0.06250  1.0 1.0
   33    39    56    52  -0.01100 -1.0 2.0
   33    39    56    52   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    56   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    56   0.23400  1.0 3.0
   39    41    43    44   0.15000  1.0 3.0
   39    41    43    47   0.56750  1.0 1.0
   39    41    43    47  -0.07550 -1.0 2.0
   39    41    43    47   0.20000  1.0 3.0
   39    41    43    49   1.85550  1.0 1.0
   39    41    43    49  -0.84100 -1.0 2.0
   39    41    45    46  -0.11600  1.0 1.0
   39    41    45    46  -0.09450 -1.0 2.0
   39    41    45    46   0.21250  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    43   0.15000  1.0 3.0
   40    39    41    45   0.23400  1.0 3.0
   40    39    56    52   0.37050  1.0 3.0
   41    39    56    52   0.06250  1.0 1.0
   41    39    56    52  -0.01100 -1.0 2.0
   41    39    56    52   0.28050  1.0 3.0
   41    43    47    48   0.15000  1.0 3.0
   41    43   -47    52   3.97050  1.0 1.0
   41    43    47    54   0.86500  1.0 1.0
   41    43    47    54  -0.17500 -1.0 2.0
   41    43    47    54   0.20800  1.0 3.0
   41    43    49    50   0.21650  1.0 1.0
   41    43    49    50   0.26250 -1.0 2.0
   41    43    49    50   0.12450  1.0 3.0
   41    43    49    51   0.21650  1.0 1.0
   41    43    49    51   0.26250 -1.0 2.0
   41    43    49    51   0.12450  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    47   0.15000  1.0 3.0
   42    41    43    49   0.15000  1.0 3.0
   42    41    45    46   0.19450  1.0 3.0
   43    41    45    46  -0.11600  1.0 1.0
   43    41    45    46  -0.09450 -1.0 2.0
   43    41    45    46   0.21250  1.0 3.0
   43    47    52    53   0.15000  1.0 3.0
   43    47    52    56   0.62750  1.0 1.0
   43    47    52    56  -0.30950 -1.0 2.0
   43    47    52    56   0.27300  1.0 3.0
   43    47    52    57   0.86500  1.0 1.0
   43    47    52    57  -0.17500 -1.0 2.0
   43    47    52    57   0.20800  1.0 3.0
   43    47    54    55  -0.11600  1.0 1.0
   43    47    54    55  -0.09450 -1.0 2.0
   43    47    54    55   0.21250  1.0 3.0
   44    43    47    48   0.15000  1.0 3.0
   44    43    47    52   0.15000  1.0 3.0
   44    43    47    54   0.23400  1.0 3.0
   44    43    49    50   0.20000  1.0 3.0
   44    43    49    51   0.20000  1.0 3.0
   47    43    49    50   0.21650  1.0 1.0
   47    43    49    50   0.26250 -1.0 2.0
   47    43    49    50   0.12450  1.0 3.0
   47    43    49    51   0.21650  1.0 1.0
   47    43    49    51   0.26250 -1.0 2.0
   47    43    49    51   0.12450  1.0 3.0
   47    52   -56    39   0.06250  1.0 1.0
   47    52   -56    39  -0.01100 -1.0 2.0
   47    52   -56    39   0.28050  1.0 3.0
   47    52    57    58  -0.11600  1.0 1.0
   47    52    57    58  -0.09450 -1.0 2.0
   47    52    57    58   0.21250  1.0 3.0
   48    47    52    53   0.15000  1.0 3.0
   48    47    52    56   0.23400  1.0 3.0
   48    47    52    57   0.23400  1.0 3.0
   48    47    54    55   0.19450  1.0 3.0
   52    47    54    55  -0.11600  1.0 1.0
   52    47    54    55  -0.09450 -1.0 2.0
   52    47    54    55   0.21250  1.0 3.0
   53    52    56    39   0.37050  1.0 3.0
   53    52    57    58   0.19450  1.0 3.0
   56    39    41    42   0.23400  1.0 3.0
   56    39   -41    43   0.62750  1.0 1.0
   56    39   -41    43  -0.30950 -1.0 2.0
   56    39   -41    43   0.27300  1.0 3.0
   56    39    41    45   3.69350  1.0 1.0
   56    39    41    45  -1.82950 -1.0 2.0
   56    52    57    58  -0.50000  1.0 1.0
   56    52    57    58  -0.73950 -1.0 2.0
   56    52    57    58   0.17150  1.0 3.0
   57    52    56    39  -0.81800  1.0 1.0
   54    47    52    53   0.23400  1.0 3.0
   54    47    52    56   3.69350  1.0 1.0
   54    47    52    56  -1.82950 -1.0 2.0
   54    47    52    57   3.75450  1.0 1.0
   49    43    47    48   0.15000  1.0 3.0
   49    43    47    52   1.85550  1.0 1.0
   49    43    47    52  -0.84100 -1.0 2.0
   49    43    47    54   5.28650  1.0 1.0
   45    41    43    44   0.23400  1.0 3.0
   45    41    43    47   0.86500  1.0 1.0
   45    41    43    47  -0.17500 -1.0 2.0
   45    41    43    47   0.20800  1.0 3.0
   45    41    43    49   5.28650  1.0 1.0
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
   37    30    36    38  10.50000 -1.0 2.0
END
