* LIGAND DATABASE FILE (OPLS2005)
*
001      57    59    110    184     326
    1     0 S   NP   _N1_     1    28.74587    95.21171   -24.20908
    2     1 S   H    _HN1     2     1.02950    77.62038    16.07319
    3     1 S   H    _H1_     3     1.02829    30.61867  -179.95577
    4     1 S   H    _H2_     4     1.02785   110.42589   -89.13917
    5     1 S   CT   _CA1     5     1.50115   130.68675   122.45835
    6     5 S   HC   _HA1     6     1.09573   105.19751    86.61692
    7     5 S   CO3  _C1_     7     1.53789   112.43946   -33.61782
    8     7 S   O2Z  _O11     8     1.26373   115.00499   -42.94566
    9     7 S   O2Z  _O12     9     1.26238   114.94363   136.16814
   10     5 S   CT   _CB1    10     1.53079   107.42335  -155.40512
   11    10 S   HC   HB11    11     1.09832   109.37700   -49.74242
   12    10 S   HC   HB12    12     1.09813   110.44625    66.86398
   13    10 S   CT   _CG1    13     1.52991   112.60519  -170.72288
   14    13 S   HC   HG11    14     1.09585   110.62428   -65.47094
   15    13 S   HC   HG12    15     1.09670   109.79811    53.75951
   16    13 S   C    _CD1    16     1.51802   112.22662   174.21297
   17    16 S   O    _OE1    17     1.22730   123.29887     6.64145
   18    16 S   N    _N2_    18     1.38643   111.67408  -173.52576
   19    18 S   H    _HN2    19     1.01592   118.94158     1.62136
   20    18 S   CT1  _CA2    20     1.46191   123.37942   177.54664
   21    20 S   HC   _HA2    21     1.09734   109.39747     0.99544
   22    20 S   C    _C2_    22     1.53515   108.61468  -114.49988
   23    22 S   O    _O2_    23     1.23053   122.27769  -148.29582
   24    20 S   CT   _CB2    32     1.53232   111.53656   123.06002
   25    24 S   HC   HB21    33     1.09624   110.02340    56.35975
   26    24 S   HC   HB22    34     1.09538   110.22029   174.88760
   27    22 S   N    _N3_    24     1.38321   113.68318    39.17124
   28    27 S   H    _HN3    25     1.01593   119.58370    -3.39038
   29    24 S   S    _SG2    35     1.82453   111.57110   -65.14894
   30    27 S   CT   _CA3    26     1.45280   123.19244   177.10484
   31    30 S   HC   HA31    27     1.09549   107.52092   -64.37590
   32    30 S   HC   HA32    28     1.09558   107.97282    52.05791
   33    29 S   CM   _C6_    36     1.71277    99.96939   176.19687
   34    30 S   CO3  _C3_    29     1.52952   114.08463   174.05673
   35    34 S   O2Z  _O31    30     1.26374   116.07083    -0.34662
   36    34 S   O2Z  _O32    31     1.26428   114.41054   179.70725
   37    33 S   CM   _C7_    37     1.34340   127.25300   -83.50098
   38    37 S   Cl   CL13    38     1.69713   128.34489    -0.26614
   39    33 S   CT   _C11    51     1.52800   126.29757    99.49124
   40    39 S   Cl   CL14    52     1.75497   116.45172   -22.46240
   41    37 S   CT   _C12    39     1.51813   107.90060  -177.60396
   42    41 S   Cl   CL15    40     1.75283   116.58599  -160.06224
   43    41 S   CT   _C13    53     1.56071    99.10805   -35.83593
   44    43 S   Cl   CL16    54     1.80345   114.57132   -64.83181
   45    43 S   Cl   CL17    55     1.79447   114.66690   171.89204
   46    41 S   CT   _C8_    41     1.56479   108.17174    70.09978
   47    46 S   HC   _H20    42     1.09699   111.90532   174.13265
   48    46 S   CM   _C4_    43     1.49448   118.16900    45.73876
   49    48 S   HC   _H18    44     1.08106   123.69776    66.14165
   50    48 S   CM   _C5_    45     1.33698   112.16172  -114.55348
   51    50 S   HC   _H19    46     1.08134   123.71040  -179.43007
   52    50 S   CT   _C9_    47     1.49458   113.32417     0.43790
   53    52 S   HC   _H21    48     1.09212   111.88678   124.48638
   54    46 S   CT   _C10    49     1.57261   102.77870   -67.72887
   55    54 S   HC   _H22    50     1.09847   109.54061  -115.24914
   56    52 S   OH   _O33    56     1.42120   108.12238  -116.42460
   57    56 S   HO   _H23    57     0.97247   107.38511   178.57646
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   8   5   4   3
  13   2   1   1  12   5  15   8  12   7   8   3   2  10   6   8
   4   7   4   5   4   3   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    54    39    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    46    52    54    55    39    40    43    44    45  
   35    36  
   36  
    0  
   38    41    42    46    47    48    54    39    40    43    44    45  
   41    42    46    39    43  
   40    43    44    45    56    41    42    46    47    48    50    52    53    54    55  
   43    44    45    41    46    52    54    55  
   42    46    47    48    49    50    52    54    55    43    44    45  
   46    47    48    54    43    44    45  
   44    45    46    47    48    52    54    55  
   45    46    54  
   46    54  
   47    48    49    50    51    52    53    54    55    56  
   48    49    50    52    54    55  
   49    50    51    52    53    54    55    56  
   50    51    52    54  
   51    52    53    54    55    56    57  
   52    53    54    56  
   53    54    55    56    57  
   54    55    56    57  
   55    56    57  
   56  
   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  -0.175000   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   3.5500   0.0760   0.007500   2.0020   1.7750   0.023028004  -0.852763146
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   39   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   41   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   43   3.5000   0.0660   0.271600   1.9750   1.7500   0.005000000  -0.741685710
   44   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   45   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   240.000  1.763
   33    37   549.000  1.340
   33    39   317.000  1.510
   37    38   300.000  1.725
   37    41   317.000  1.510
   41    42   245.000  1.781
   41    46   268.000  1.529
   41    43   268.000  1.529
   46    47   340.000  1.090
   46    48   317.000  1.510
   46    54   268.000  1.529
   48    49   340.000  1.080
   48    50   549.000  1.340
   50    51   340.000  1.080
   50    52   317.000  1.510
   52    53   340.000  1.090
   52    54   268.000  1.529
   52    56   320.000  1.410
   54    55   340.000  1.090
   54    39   268.000  1.529
   39    40   245.000  1.781
   39    43   268.000  1.529
   43    44   245.000  1.781
   43    45   245.000  1.781
   56    57   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    65.00000  122.11800
   29    33    39    65.00000  117.37300
   33    37    38    75.00000  121.50000
   33    37    41    70.00000  124.00000
   33    39    54    70.00000  112.02700
   33    39    40    75.00000  111.90500
   33    39    43    70.00000  112.02700
   37    41    42    75.00000  111.90500
   37    41    46    70.00000  112.02700
   37    41    43    70.00000  112.02700
   41    37    38    75.00000  111.02000
   41    46    47    37.50000  110.70000
   41    46    48    70.00000  112.02700
   41    46    54    58.35000  112.70000
   41    43    39    58.35000  112.70000
   41    43    44    69.00000  109.80000
   41    43    45    69.00000  109.80000
   46    41    42    69.00000  109.80000
   46    48    49    35.00000  117.00000
   46    48    50    70.00000  124.00000
   46    54    52    58.35000  112.70000
   46    54    55    37.50000  110.70000
   46    54    39    58.35000  112.70000
   48    46    47    35.00000  109.50000
   48    50    51    35.00000  120.00000
   48    50    52    70.00000  124.00000
   50    48    49    35.00000  120.00000
   50    52    53    35.00000  109.50000
   50    52    54    70.00000  112.02700
   50    52    56    90.00000  110.39200
   52    50    51    35.00000  117.00000
   52    54    55    37.50000  110.70000
   52    54    39    58.35000  112.70000
   52    56    57    55.00000  108.50000
   54    46    47    37.50000  110.70000
   54    46    48    70.00000  112.02700
   54    52    53    37.50000  110.70000
   54    39    40    69.00000  109.80000
   54    39    43    58.35000  112.70000
   39    33    37    70.00000  124.00000
   39    54    55    37.50000  110.70000
   39    43    44    69.00000  109.80000
   39    43    45    69.00000  109.80000
   43    41    42    69.00000  109.80000
   43    41    46    58.35000  112.70000
   43    39    40    69.00000  109.80000
   45    43    44    80.00000  110.42200
   56    52    53    35.00000  109.50000
   56    52    54    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   0.00000  1.0 1.0
   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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37   1.00000 -1.0 2.0
   24    29    33    39   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   7.00000 -1.0 2.0
   29    33    37    41   7.00000 -1.0 2.0
   29    33    39    54   0.09700  1.0 1.0
   29    33    39    54   0.15600 -1.0 2.0
   29    33    39    54  -0.50800  1.0 3.0
   29    33    39    40   0.09700  1.0 1.0
   29    33    39    40   0.15600 -1.0 2.0
   29    33    39    40  -0.50800  1.0 3.0
   29    33    39    43   0.09700  1.0 1.0
   29    33    39    43   0.15600 -1.0 2.0
   29    33    39    43  -0.50800  1.0 3.0
   33    37    41    42   0.09700  1.0 1.0
   33    37    41    42   0.15600 -1.0 2.0
   33    37    41    42  -0.50800  1.0 3.0
   33    37    41    46   0.09850  1.0 1.0
   33    37    41    46   0.15250 -1.0 2.0
   33    37    41    46  -0.50650  1.0 3.0
   33    37   -41    43   0.09850  1.0 1.0
   33    37   -41    43   0.15250 -1.0 2.0
   33    37   -41    43  -0.50650  1.0 3.0
   33    39   -43    41   0.34400  1.0 1.0
   33    39   -43    41   0.09450 -1.0 2.0
   33    39   -43    41   0.11100  1.0 3.0
   33    39    43    44   0.56750  1.0 1.0
   33    39    43    44  -0.07550 -1.0 2.0
   33    39    43    44   0.20000  1.0 3.0
   33    39    43    45   0.56750  1.0 1.0
   33    39    43    45  -0.07550 -1.0 2.0
   33    39    43    45   0.20000  1.0 3.0
   37    33    39    54   0.09850  1.0 1.0
   37    33    39    54   0.15250 -1.0 2.0
   37    33    39    54  -0.50650  1.0 3.0
   37    33    39    40   0.09700  1.0 1.0
   37    33    39    40   0.15600 -1.0 2.0
   37    33    39    40  -0.50800  1.0 3.0
   37    33   -39    43   0.09850  1.0 1.0
   37    33   -39    43   0.15250 -1.0 2.0
   37    33   -39    43  -0.50650  1.0 3.0
   37    41    46    47   0.15000  1.0 3.0
   37    41    46    48   0.31000  1.0 1.0
   37    41    46    48   0.14700 -1.0 2.0
   37    41    46    48   0.07550  1.0 3.0
   37    41   -46    54   0.34400  1.0 1.0
   37    41   -46    54   0.09450 -1.0 2.0
   37    41   -46    54   0.11100  1.0 3.0
   37    41   -43    39   0.34400  1.0 1.0
   37    41   -43    39   0.09450 -1.0 2.0
   37    41   -43    39   0.11100  1.0 3.0
   37    41    43    44   0.56750  1.0 1.0
   37    41    43    44  -0.07550 -1.0 2.0
   37    41    43    44   0.20000  1.0 3.0
   37    41    43    45   0.56750  1.0 1.0
   37    41    43    45  -0.07550 -1.0 2.0
   37    41    43    45   0.20000  1.0 3.0
   38    37    41    42   0.09700  1.0 1.0
   38    37    41    42   0.15600 -1.0 2.0
   38    37    41    42  -0.50800  1.0 3.0
   38    37    41    46   0.09700  1.0 1.0
   38    37    41    46   0.15600 -1.0 2.0
   38    37    41    46  -0.50800  1.0 3.0
   38    37    41    43   0.09700  1.0 1.0
   38    37    41    43   0.15600 -1.0 2.0
   38    37    41    43  -0.50800  1.0 3.0
   41    46    48    49   0.00000  1.0 1.0
   41    46    48    50   0.09850  1.0 1.0
   41    46    48    50   0.15250 -1.0 2.0
   41    46    48    50  -0.50650  1.0 3.0
   41    46    54    52   0.56750  1.0 1.0
   41    46    54    52  -0.07550 -1.0 2.0
   41    46    54    52   0.20000  1.0 3.0
   41    46    54    55   0.15000  1.0 3.0
   41    46   -54    39   0.56750  1.0 1.0
   41    46   -54    39  -0.07550 -1.0 2.0
   41    46   -54    39   0.20000  1.0 3.0
   42    41    46    47   0.27000  1.0 3.0
   42    41    46    48   0.56750  1.0 1.0
   42    41    46    48  -0.07550 -1.0 2.0
   42    41    46    48   0.20000  1.0 3.0
   42    41    46    54   0.35600  1.0 1.0
   42    41    46    54  -0.14650 -1.0 2.0
   42    41    46    54   0.33350  1.0 3.0
   42    41    43    39   0.35600  1.0 1.0
   42    41    43    39  -0.14650 -1.0 2.0
   42    41    43    39   0.33350  1.0 3.0
   42    41    43    44   0.22500  1.0 1.0
   42    41    43    45   0.22500  1.0 1.0
   46    41   -43    39   0.56750  1.0 1.0
   46    41   -43    39  -0.07550 -1.0 2.0
   46    41   -43    39   0.20000  1.0 3.0
   46    41    43    44   0.35600  1.0 1.0
   46    41    43    44  -0.14650 -1.0 2.0
   46    41    43    44   0.33350  1.0 3.0
   46    41    43    45   0.35600  1.0 1.0
   46    41    43    45  -0.14650 -1.0 2.0
   46    41    43    45   0.33350  1.0 3.0
   46    48    50    51   7.00000 -1.0 2.0
   46    48   -50    52   7.00000 -1.0 2.0
   46    54   -39    33   0.34400  1.0 1.0
   46    54   -39    33   0.09450 -1.0 2.0
   46    54   -39    33   0.11100  1.0 3.0
   46    54    39    40   0.35600  1.0 1.0
   46    54    39    40  -0.14650 -1.0 2.0
   46    54    39    40   0.33350  1.0 3.0
   46    54   -39    43   0.56750  1.0 1.0
   46    54   -39    43  -0.07550 -1.0 2.0
   46    54   -39    43   0.20000  1.0 3.0
   47    46    48    49   0.33100  1.0 3.0
   47    46    48    50   0.00000  1.0 1.0
   47    46    54    52   0.15000  1.0 3.0
   47    46    54    55   0.15000  1.0 3.0
   47    46    54    39   0.15000  1.0 3.0
   48    46   -54    52   0.34400  1.0 1.0
   48    46   -54    52   0.09450 -1.0 2.0
   48    46   -54    52   0.11100  1.0 3.0
   48    46    54    55   0.15000  1.0 3.0
   48    46    54    39   0.34400  1.0 1.0
   48    46    54    39   0.09450 -1.0 2.0
   48    46    54    39   0.11100  1.0 3.0
   48    50    52    53   0.00000  1.0 1.0
   48    50   -52    54   0.09850  1.0 1.0
   48    50   -52    54   0.15250 -1.0 2.0
   48    50   -52    54  -0.50650  1.0 3.0
   48    50    52    56   0.67800  1.0 1.0
   48    50    52    56   0.47050 -1.0 2.0
   48    50    52    56  -0.62500  1.0 3.0
   49    48    50    51   7.00000 -1.0 2.0
   49    48    50    52   7.00000 -1.0 2.0
   50    52   -54    46   0.34400  1.0 1.0
   50    52   -54    46   0.09450 -1.0 2.0
   50    52   -54    46   0.11100  1.0 3.0
   50    52    54    55   0.15000  1.0 3.0
   50    52    54    39   0.34400  1.0 1.0
   50    52    54    39   0.09450 -1.0 2.0
   50    52    54    39   0.11100  1.0 3.0
   50    52    56    57  -0.07800  1.0 1.0
   50    52    56    57  -0.21500 -1.0 2.0
   50    52    56    57  -0.03150  1.0 3.0
   51    50    52    53   0.33100  1.0 3.0
   51    50    52    54   0.00000  1.0 1.0
   51    50    52    56   0.00000  1.0 1.0
   52    54    39    33   0.34400  1.0 1.0
   52    54    39    33   0.09450 -1.0 2.0
   52    54    39    33   0.11100  1.0 3.0
   52    54    39    40   0.35600  1.0 1.0
   52    54    39    40  -0.14650 -1.0 2.0
   52    54    39    40   0.33350  1.0 3.0
   52    54    39    43   0.56750  1.0 1.0
   52    54    39    43  -0.07550 -1.0 2.0
   52    54    39    43   0.20000  1.0 3.0
   53    52    54    46   0.15000  1.0 3.0
   53    52    54    55   0.15000  1.0 3.0
   53    52    54    39   0.15000  1.0 3.0
   53    52    56    57   0.19450  1.0 3.0
   54    46    48    49   0.00000  1.0 1.0
   54    46   -48    50   0.09850  1.0 1.0
   54    46   -48    50   0.15250 -1.0 2.0
   54    46   -48    50  -0.50650  1.0 3.0
   54    52    56    57  -0.11600  1.0 1.0
   54    52    56    57  -0.09450 -1.0 2.0
   54    52    56    57   0.21250  1.0 3.0
   54    39   -43    41   0.56750  1.0 1.0
   54    39   -43    41  -0.07550 -1.0 2.0
   54    39   -43    41   0.20000  1.0 3.0
   54    39    43    44   0.35600  1.0 1.0
   54    39    43    44  -0.14650 -1.0 2.0
   54    39    43    44   0.33350  1.0 3.0
   54    39    43    45   0.35600  1.0 1.0
   54    39    43    45  -0.14650 -1.0 2.0
   54    39    43    45   0.33350  1.0 3.0
   55    54    39    33   0.15000  1.0 3.0
   55    54    39    40   0.27000  1.0 3.0
   55    54    39    43   0.15000  1.0 3.0
   39    33    37    38   7.00000 -1.0 2.0
   39    33   -37    41   7.00000 -1.0 2.0
   40    39    43    41   0.35600  1.0 1.0
   40    39    43    41  -0.14650 -1.0 2.0
   40    39    43    41   0.33350  1.0 3.0
   40    39    43    44   0.22500  1.0 1.0
   40    39    43    45   0.22500  1.0 1.0
   43    41    46    47   0.15000  1.0 3.0
   43    41    46    48   0.34400  1.0 1.0
   43    41    46    48   0.09450 -1.0 2.0
   43    41    46    48   0.11100  1.0 3.0
   43    41   -46    54   0.56750  1.0 1.0
   43    41   -46    54  -0.07550 -1.0 2.0
   43    41   -46    54   0.20000  1.0 3.0
   56    52    54    46   0.86500  1.0 1.0
   56    52    54    46  -0.17500 -1.0 2.0
   56    52    54    46   0.20800  1.0 3.0
   56    52    54    55   0.23400  1.0 3.0
   56    52    54    39   0.86500  1.0 1.0
   56    52    54    39  -0.17500 -1.0 2.0
   56    52    54    39   0.20800  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   29    39    33    37   1.10000 -1.0 2.0
   41    38    37    33   1.10000 -1.0 2.0
   46    49    48    50   1.10000 -1.0 2.0
   52    51    50    48   1.10000 -1.0 2.0
END
