* LIGAND DATABASE FILE (OPLS2005)
*
001      58    58    103    157     304
    1     0 S   NP   _N1_     1    28.80766    95.39201   -25.00286
    2     1 S   H    _HN1     2     1.02790   115.31190   -94.81081
    3     1 S   H    _H1_     3     1.02948    76.25262     9.25869
    4     1 S   H    _H2_     4     1.02828    31.04887  -177.51312
    5     1 S   CT   _CA1     5     1.50121   126.57225   114.66484
    6     5 S   HC   _HA1     6     1.09573   105.17768    90.00706
    7     5 S   CO3  _C1_     7     1.53775   112.43535   -30.22689
    8     7 S   O2Z  _O11     8     1.26377   115.00544   -43.04741
    9     7 S   O2Z  _O12     9     1.26232   114.94092   135.98316
   10     5 S   CT   _CB1    10     1.53061   107.40974  -152.01183
   11    10 S   HC   HB11    11     1.09839   109.36303   -49.36533
   12    10 S   HC   HB12    12     1.09811   110.46229    67.23477
   13    10 S   CT   _CG1    13     1.53014   112.62707  -170.30195
   14    13 S   HC   HG11    14     1.09573   110.70863   -66.47379
   15    13 S   HC   HG12    15     1.09669   109.72865    52.77951
   16    13 S   C    _CD1    16     1.51808   112.04098   173.26478
   17    16 S   O    _OE1    17     1.22750   123.20509    10.74655
   18    16 S   N    _N2_    18     1.38647   111.80884  -169.37947
   19    18 S   H    _HN2    19     1.01590   118.99796     1.36458
   20    18 S   CT1  _CA2    20     1.46220   123.35088   176.90471
   21    20 S   HC   _HA2    21     1.09738   109.28868     5.81076
   22    20 S   C    _C2_    22     1.53634   108.88551  -109.69321
   23    22 S   O    _O2_    23     1.23077   122.21015  -149.48561
   24    20 S   CT   _CB2    32     1.53326   111.61286   127.75433
   25    24 S   HC   HB21    33     1.09595   110.03343    56.48920
   26    24 S   HC   HB22    34     1.09430   110.11333   175.51808
   27    22 S   N    _N3_    24     1.38305   113.85251    38.03697
   28    27 S   H    _HN3    25     1.01557   119.61323    -3.33713
   29    24 S   S    _SG2    35     1.82744   111.52687   -64.26718
   30    27 S   CT   _CA3    26     1.45285   123.26700   177.16117
   31    30 S   HC   HA31    27     1.09548   107.51923   -64.60429
   32    30 S   HC   HA32    28     1.09556   107.98652    51.84947
   33    29 S   CT   _C5_    36     1.84196    99.39295   176.08889
   34    33 S   HC   _H3_    37     1.09271   107.93466   -37.56593
   35    30 S   CO3  _C3_    29     1.52974   114.04689   173.84792
   36    35 S   O2Z  _O31    30     1.26382   116.07186    -0.31898
   37    35 S   O2Z  _O32    31     1.26426   114.41606   179.73681
   38    33 S   CM   _C6_    38     1.51539   108.07615  -156.01921
   39    38 S   CM   _C7_    39     1.34468   122.46895   -95.83030
   40    39 S   HC   _H7_    40     1.08460   121.96015   179.02081
   41    38 S   CT   _C10    48     1.51997   117.66787    83.37954
   42    41 S   HC   _H8_    49     1.09966   108.10747  -147.12883
   43    41 S   HC   _H9_    50     1.09710   109.92409   -32.99672
   44    39 S   CO4  _C8_    41     1.47570   121.28310     0.27411
   45    44 S   O    _O33    42     1.22117   122.58623   174.20647
   46    41 S   CT1  _C11    51     1.53454   112.76039    92.01575
   47    46 S   HC   _H4_    52     1.09733   109.78592    47.74641
   48    44 S   CO4  _C9_    43     1.50662   117.95371    -5.97366
   49    48 S   O    _O34    44     1.22197   119.14393   166.54175
   50    46 S   CO3  _C12    53     1.54412   114.72141   -75.76852
   51    50 S   O2Z  _O36    54     1.26334   116.48609   -39.69938
   52    50 S   O2Z  _O35    55     1.26589   114.32470   140.33744
   53    46 S   NT   _N4_    56     1.47083   109.75405   166.34857
   54    53 S   H    _H10    57     1.01891   109.56195   -59.81161
   55    53 S   H    _H11    58     1.02011   109.20706  -175.72969
   56    33 S   CT   _C4_    45     1.52947   111.10298    80.41138
   57    56 S   HC   _H5_    46     1.09492   111.94914   -49.04410
   58    56 S   HC   _H6_    47     1.09753   109.87984  -167.72220
  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   9   5   4   3
  14   7   2   1   1  15  10   4  12   5   4   6   3   7   6   4
   3   5   2   1   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    56    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    48    56    57    58    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    44    48    49    56    57    58    41    42    43    46  
   38    39    48    56    57    58    41  
   36    37  
   37  
    0  
   39    40    44    45    48    56    57    58    41    42    43    46    47    50    53  
   40    44    45    48    49    56    41    42    43    46  
   44    45    48    41  
   42    43    46    47    50    51    52    53    54    55    44    56  
   43    46    47    50    53  
   46    47    50    53  
   45    48    49    56    57    58  
   48    49    56  
   47    50    51    52    53    54    55  
   50    51    52    53    54    55  
   49    56    57    58  
   56    57    58  
   51    52    53    54    55  
   52    53  
   53  
   54    55  
   55  
    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   0.107500   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  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5000   0.0660   0.063900   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   50   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   53   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
   54   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   55   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   58   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    56   268.000  1.529
   38    39   549.000  1.340
   38    41   317.000  1.510
   39    40   340.000  1.080
   39    44   320.000  1.462
   44    45   570.000  1.229
   44    48   250.000  1.523
   48    49   570.000  1.229
   48    56   317.000  1.522
   56    57   340.000  1.090
   56    58   340.000  1.090
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    46   268.000  1.529
   46    47   340.000  1.090
   46    50   317.000  1.522
   46    53   305.000  1.457
   50    51   656.000  1.250
   50    52   656.000  1.250
   53    54   434.000  1.010
   53    55   434.000  1.010
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    56    75.00000  111.63000
   33    38    39    70.00000  124.00000
   33    38    41    65.00000  117.92700
   33    56    48    63.00000  111.10000
   33    56    57    37.50000  110.70000
   33    56    58    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  120.00000
   38    39    44    65.00000  118.96000
   38    41    42    35.00000  109.50000
   38    41    43    35.00000  109.50000
   38    41    46    70.00000  112.02700
   39    44    45    80.00000  123.72100
   39    44    48    65.00000  116.00000
   44    39    40    40.00000  117.72500
   44    48    49    80.00000  119.30300
   44    48    56    65.00000  115.45000
   48    44    45    80.00000  119.30300
   48    56    57    35.00000  109.50000
   48    56    58    35.00000  109.50000
   56    33    34    37.50000  110.70000
   56    33    38    70.00000  112.02700
   56    48    49    80.00000  120.40000
   58    56    57    33.00000  107.80000
   41    38    39    70.00000  124.00000
   41    46    47    37.50000  110.70000
   41    46    50    63.00000  111.10000
   41    46    53    80.00000  111.22000
   43    41    42    33.00000  107.80000
   46    41    42    37.50000  110.70000
   46    41    43    37.50000  110.70000
   46    50    51    70.00000  117.00000
   46    50    52    70.00000  117.00000
   46    53    54    50.00000  111.55300
   46    53    55    50.00000  111.55300
   50    46    47    35.00000  109.50000
   52    50    51    80.00000  126.00000
   53    46    47    50.00000  109.55000
   53    46    50    75.00000  111.54000
   55    53    54    43.60000  106.40000
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    56   0.01700  1.0 1.0
   24    29    33    56  -0.23550 -1.0 2.0
   24    29    33    56   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   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    41   0.30250  1.0 1.0
   29    33    38    41  -0.14950 -1.0 2.0
   29    33    38    41   0.36900  1.0 3.0
   29    33    56    48   0.56750  1.0 1.0
   29    33    56    48  -0.07550 -1.0 2.0
   29    33    56    48   0.20000  1.0 3.0
   29    33    56    57   0.15000  1.0 3.0
   29    33    56    58   0.15000  1.0 3.0
   33    38    39    40   7.00000 -1.0 2.0
   33    38    39    44   7.00000 -1.0 2.0
   33    38    41    42   0.34800  1.0 3.0
   33    38    41    43   0.34800  1.0 3.0
   33    38    41    46   0.46850  1.0 1.0
   33    38    41    46   0.08550 -1.0 2.0
   33    38    41    46   0.09800  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.34800  1.0 3.0
   34    33    56    48  -0.11250  1.0 3.0
   34    33    56    57   0.15000  1.0 3.0
   34    33    56    58   0.15000  1.0 3.0
   38    33    56    48  -0.98800  1.0 1.0
   38    33    56    48   0.48800 -1.0 2.0
   38    33    56    48   0.76800  1.0 3.0
   38    33    56    57   0.15000  1.0 3.0
   38    33    56    58   0.15000  1.0 3.0
   38    39    44    45   1.00000 -1.0 2.0
   38    39   -44    48   0.50400  1.0 1.0
   38    39   -44    48   1.60000 -1.0 2.0
   38    39   -44    48  -0.01800  1.0 3.0
   38    41    46    47   0.15000  1.0 3.0
   38    41    46    50  -0.98800  1.0 1.0
   38    41    46    50   0.48800 -1.0 2.0
   38    41    46    50   0.76800  1.0 3.0
   38    41    46    53   0.59950  1.0 1.0
   38    41    46    53  -0.21400 -1.0 2.0
   38    41    46    53   0.56200  1.0 3.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    43   0.00000  1.0 1.0
   39    38    41    46   0.09850  1.0 1.0
   39    38    41    46   0.15250 -1.0 2.0
   39    38    41    46  -0.50650  1.0 3.0
   39    44    48    49   0.03000  1.0 1.0
   39    44    48    49   0.58800 -1.0 2.0
   39    44    48    49   0.15550  1.0 3.0
   39    44    48    56   0.43900  1.0 1.0
   39    44    48    56  -0.18150 -1.0 2.0
   39    44    48    56  -0.03650  1.0 3.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    48   0.92800 -1.0 2.0
   44    48   -56    33   0.65300  1.0 1.0
   44    48   -56    33  -0.03850 -1.0 2.0
   44    48   -56    33   0.33900  1.0 3.0
   44    48    56    57   0.00000  1.0 1.0
   44    48    56    58   0.00000  1.0 1.0
   45    44    48    49   0.06100 -1.0 2.0
   45    44    48    56   0.49600 -1.0 2.0
   49    48    56    33   0.30150 -1.0 2.0
   49    48    56    57   0.00000  1.0 1.0
   49    48    56    58   0.00000  1.0 1.0
   56    33   -38    39   0.09850  1.0 1.0
   56    33   -38    39   0.15250 -1.0 2.0
   56    33   -38    39  -0.50650  1.0 3.0
   56    33    38    41   0.46850  1.0 1.0
   56    33    38    41   0.08550 -1.0 2.0
   56    33    38    41   0.09800  1.0 3.0
   41    38    39    40   7.00000 -1.0 2.0
   41    38    39    44   7.00000 -1.0 2.0
   41    46    50    51   0.00000  1.0 1.0
   41    46    50    52   0.00000  1.0 1.0
   41    46    53    54  -0.05950  1.0 1.0
   41    46    53    54   0.08850 -1.0 2.0
   41    46    53    54   0.11750  1.0 3.0
   41    46    53    55  -0.05950  1.0 1.0
   41    46    53    55   0.08850 -1.0 2.0
   41    46    53    55   0.11750  1.0 3.0
   42    41    46    47   0.15000  1.0 3.0
   42    41    46    50  -0.03800  1.0 3.0
   42    41    46    53   0.15000  1.0 3.0
   43    41    46    47   0.15000  1.0 3.0
   43    41    46    50  -0.03800  1.0 3.0
   43    41    46    53   0.15000  1.0 3.0
   47    46    50    51   0.00000  1.0 1.0
   47    46    50    52   0.00000  1.0 1.0
   47    46    53    54   0.20000  1.0 3.0
   47    46    53    55   0.20000  1.0 3.0
   50    46    53    54   0.21900  1.0 1.0
   50    46    53    54  -0.24900 -1.0 2.0
   50    46    53    54   0.15200  1.0 3.0
   50    46    53    55   0.21900  1.0 1.0
   50    46    53    55  -0.24900 -1.0 2.0
   50    46    53    55   0.15200  1.0 3.0
   53    46    50    51   0.30150 -1.0 2.0
   53    46    50    52   0.30150 -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    41    38    39   1.10000 -1.0 2.0
   44    40    39    38   1.10000 -1.0 2.0
   39    48    44    45  10.50000 -1.0 2.0
   44    56    48    49  10.50000 -1.0 2.0
   51    46    50    52  10.50000 -1.0 2.0
END
