* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    110    169     326
    1     0 S   NP   _N1_     1    28.70363    95.03767   -22.51811
    2     1 S   H    _HN1     2     1.02948    84.37765    15.52119
    3     1 S   H    _H1_     3     1.02834    30.64159   153.76390
    4     1 S   H    _H2_     4     1.02787    96.76876   -92.32727
    5     1 S   CT   _CA1     5     1.50085   139.80074   130.84917
    6     5 S   HC   _HA1     6     1.09570   105.25499    71.55350
    7     5 S   CO3  _C1_     7     1.53816   112.34912   -48.80420
    8     7 S   O2Z  _O11     8     1.26376   115.02767   -45.91868
    9     7 S   O2Z  _O12     9     1.26231   114.93690   133.32775
   10     5 S   CT   _CB1    10     1.53091   107.45275  -170.43306
   11    10 S   HC   HB11    11     1.09829   109.51699   -49.72616
   12    10 S   HC   HB12    12     1.09815   110.40121    66.90166
   13    10 S   CT   _CG1    13     1.52989   112.53114  -170.68949
   14    13 S   HC   HG11    14     1.09591   110.59289   -62.48439
   15    13 S   HC   HG12    15     1.09660   109.86273    56.74028
   16    13 S   C    _CD1    16     1.51781   112.26027   177.29962
   17    16 S   O    _OE1    17     1.22729   123.29143     3.61086
   18    16 S   N    _N2_    18     1.38620   111.63169  -176.75514
   19    18 S   H    _HN2    19     1.01596   119.01061     2.08779
   20    18 S   CT1  _CA2    20     1.46217   123.39732   179.47325
   21    20 S   HC   _HA2    21     1.09736   109.35266    -2.32995
   22    20 S   C    _C2_    22     1.53453   108.66998  -117.85385
   23    22 S   O    _O2_    23     1.23041   122.30908  -148.80968
   24    20 S   CT   _CB2    32     1.53333   111.38570   119.55835
   25    24 S   HC   HB21    33     1.09493   109.89909    56.86930
   26    24 S   HC   HB22    34     1.09516   110.36225   175.77905
   27    22 S   N    _N3_    24     1.38349   113.60447    38.74809
   28    27 S   H    _HN3    25     1.01612   119.52559    -3.63001
   29    24 S   S    _SG2    35     1.82878   111.31701   -64.67884
   30    27 S   CT   _CA3    26     1.45286   123.17844   176.97554
   31    30 S   HC   HA31    27     1.09551   107.52808   -63.96523
   32    30 S   HC   HA32    28     1.09557   107.95596    52.45848
   33    29 S   CT   _C12    36     1.85352    99.59680   173.54296
   34    33 S   HC   _H6_    37     1.09661   105.15118    39.35702
   35    30 S   CO3  _C3_    29     1.52947   114.10205   174.43993
   36    35 S   O2Z  _O31    30     1.26371   116.05822    -0.70304
   37    35 S   O2Z  _O32    31     1.26428   114.41574   179.35837
   38    33 S   CT   _C11    38     1.54626   109.97741   -80.23926
   39    38 S   HC   _H5_    39     1.09805   109.64630    33.86718
   40    38 S   CM   _C10    40     1.51165   113.61573   -86.50683
   41    40 S   HC   _H10    41     1.08819   117.09200   167.95161
   42    38 S   CO3  _C13    60     1.54697   114.14797   151.52304
   43    42 S   O2Z  _O37    61     1.26201   116.51835    18.74483
   44    42 S   O2Z  _O36    62     1.26622   114.59954  -160.59005
   45    40 S   CM   _C9_    42     1.34040   124.31522   -10.78781
   46    45 S   HC   _H9_    43     1.08694   118.81374   178.98664
   47    45 S   CT   _C8_    44     1.49898   123.67968    -1.98051
   48    47 S   HC   _H4_    45     1.09602   109.04384  -134.37379
   49    33 S   CT   _C7_    46     1.55381   111.52773   155.77187
   50    49 S   HC   _H3_    47     1.09890   106.13821  -173.81249
   51    47 S   NP   _N4_    56     1.49144   111.25535   110.78590
   52    51 S   H    _H11    57     1.03411   110.12899   174.56275
   53    51 S   H    _H12    58     1.02709   112.14628    55.30006
   54    51 S   H    _H13    59     1.02884   111.56293   -66.41587
   55    49 S   OS   _O35    48     1.43985   109.26123   -56.47229
   56    55 S   CM   _C5_    49     1.38302   113.77691  -149.28054
   57    56 S   CM   _C4_    50     1.33935   122.02310    73.82936
   58    57 S   HC   _H7_    51     1.08531   120.77633    -1.90978
   59    57 S   HC   _H8_    52     1.08454   122.11533   177.80251
   60    56 S   CO3  _C6_    53     1.54956   116.17398  -110.61360
   61    60 S   O2Z  _O34    54     1.26336   116.49449  -174.76187
   62    60 S   O2Z  _O33    55     1.26782   114.66512     5.88243
  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  10   5   4   3
  16   8   2   1   1  12   7  10   4   4   1   1  10   4   9   7
   9   3   4   2   1   1   7   6   5   2   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    49    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    47    49    50    55    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    47    48    49    50    55    56    51    42    43    44  
   38    39    40    47    49    50    55    42  
   36    37  
   37  
    0  
   39    40    41    45    46    47    49    50    55    42    43    44  
   40    41    45    49    42    43    44  
   41    45    46    47    48    49    51    42    43    44  
   45    46    47    42  
   43    44    45    49  
   44  
    0  
   46    47    48    49    50    55    51    52    53    54  
   47    48    49    51  
   48    49    50    55    56    51    52    53    54  
   49    50    55    51    52    53    54  
   50    55    56    57    60    51    52    53    54  
   55    56    51  
   52    53    54    55  
   53    54  
   54  
    0  
   56    57    58    59    60    61    62  
   57    58    59    60    61    62  
   58    59    60    61    62  
   59    60  
   60  
   61    62  
   62  
    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   1.6450   1.4500   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  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.025600   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   49   3.5000   0.0660   0.394400   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.6450   1.4500   0.008598240   0.268726247
   51   3.2500   0.1700  -0.300000   2.2900   2.0360   0.003973653   1.685851020
   52   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   53   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   54   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   55   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   56   3.5500   0.0760  -0.225300   2.0020   1.7750   0.023028004  -0.852763146
   57   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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    49   268.000  1.529
   38    39   340.000  1.090
   38    40   317.000  1.510
   38    42   317.000  1.522
   40    41   340.000  1.080
   40    45   549.000  1.340
   45    46   340.000  1.080
   45    47   317.000  1.510
   47    48   340.000  1.090
   47    49   268.000  1.529
   47    51   367.000  1.471
   49    50   340.000  1.090
   49    55   320.000  1.410
   55    56   440.000  1.360
   56    57   549.000  1.340
   56    60   230.000  1.545
   57    58   340.000  1.080
   57    59   340.000  1.080
   60    61   656.000  1.250
   60    62   656.000  1.250
   51    52   434.000  1.010
   51    53   434.000  1.010
   51    54   434.000  1.010
   42    43   656.000  1.250
   42    44   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    49    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    70.00000  112.02700
   33    38    42    70.00000  109.69300
   33    49    47    58.35000  112.70000
   33    49    50    37.50000  110.70000
   33    49    55    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    35.00000  117.00000
   38    40    45    70.00000  124.00000
   38    42    43    70.00000  117.00000
   38    42    44    70.00000  117.00000
   40    38    39    35.00000  109.50000
   40    45    46    35.00000  120.00000
   40    45    47    70.00000  124.00000
   45    40    41    35.00000  120.00000
   45    47    48    35.00000  109.50000
   45    47    49    70.00000  112.02700
   45    47    51    75.00000  110.06800
   47    45    46    35.00000  117.00000
   47    49    50    37.50000  110.70000
   47    49    55    50.00000  109.50000
   47    51    52    35.00000  109.50000
   47    51    53    35.00000  109.50000
   47    51    54    35.00000  109.50000
   49    33    34    37.50000  110.70000
   49    33    38    58.35000  112.70000
   49    47    48    37.50000  110.70000
   49    55    56    90.00000  111.18400
   55    49    50    35.00000  109.50000
   55    56    57    80.00000  120.01400
   55    56    60    80.00000  119.00000
   56    57    58    35.00000  120.00000
   56    57    59    35.00000  120.00000
   56    60    61    85.00000  113.83300
   56    60    62    85.00000  113.83300
   59    57    58    35.00000  117.00000
   60    56    57    55.00000  124.75400
   62    60    61    80.00000  126.00000
   51    47    48    35.00000  109.50000
   51    47    49    80.00000  111.20000
   53    51    52    35.00000  109.50000
   54    51    52    35.00000  109.50000
   54    51    53    35.00000  109.50000
   42    38    39    35.00000  109.50000
   42    38    40    65.00000  111.94000
   44    42    43    80.00000  126.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  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    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   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   0.15000  1.0 3.0
   29    33    38    40   0.56750  1.0 1.0
   29    33    38    40  -0.07550 -1.0 2.0
   29    33    38    40   0.20000  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    49    47   0.44750  1.0 1.0
   29    33    49    47  -0.17800 -1.0 2.0
   29    33    49    47   0.20200  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    55   0.56750  1.0 1.0
   29    33    49    55  -0.07550 -1.0 2.0
   29    33    49    55   0.20000  1.0 3.0
   33    38    40    41   0.00000  1.0 1.0
   33    38    40    45   0.09850  1.0 1.0
   33    38    40    45   0.15250 -1.0 2.0
   33    38    40    45  -0.50650  1.0 3.0
   33    38    42    43   0.41150 -1.0 2.0
   33    38    42    44   0.41150 -1.0 2.0
   33    49    55    56  -0.46850  1.0 1.0
   33    49    55    56   0.09300 -1.0 2.0
   33    49    55    56  -0.12850  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    42  -0.11250  1.0 3.0
   34    33    49    47   0.15000  1.0 3.0
   34    33    49    50   0.15000  1.0 3.0
   34    33    49    55   0.23400  1.0 3.0
   38    33    49    47   0.56750  1.0 1.0
   38    33    49    47  -0.07550 -1.0 2.0
   38    33    49    47   0.20000  1.0 3.0
   38    33    49    50   0.15000  1.0 3.0
   38    33    49    55   0.62750  1.0 1.0
   38    33    49    55  -0.30950 -1.0 2.0
   38    33    49    55   0.27300  1.0 3.0
   38    40    45    46   7.00000 -1.0 2.0
   38    40   -45    47   7.00000 -1.0 2.0
   39    38    40    41   0.33100  1.0 3.0
   39    38    40    45   0.00000  1.0 1.0
   39    38    42    43   0.00000  1.0 1.0
   39    38    42    44   0.00000  1.0 1.0
   40    38    42    43   0.30150 -1.0 2.0
   40    38    42    44   0.30150 -1.0 2.0
   40    45    47    48   0.00000  1.0 1.0
   40    45    47    49   0.09850  1.0 1.0
   40    45    47    49   0.15250 -1.0 2.0
   40    45    47    49  -0.50650  1.0 3.0
   40    45    47    51   0.80850  1.0 1.0
   40    45    47    51  -0.47300 -1.0 2.0
   40    45    47    51  -0.52300  1.0 3.0
   41    40    45    46   7.00000 -1.0 2.0
   41    40    45    47   7.00000 -1.0 2.0
   45    47   -49    33   0.34400  1.0 1.0
   45    47   -49    33   0.09450 -1.0 2.0
   45    47   -49    33   0.11100  1.0 3.0
   45    47    49    50   0.15000  1.0 3.0
   45    47    49    55   0.61850  1.0 1.0
   45    47    49    55  -0.22750 -1.0 2.0
   45    47    49    55   0.15300  1.0 3.0
   45    47    51    52   0.17350  1.0 3.0
   45    47    51    53   0.17350  1.0 3.0
   45    47    51    54   0.17350  1.0 3.0
   46    45    47    48   0.33100  1.0 3.0
   46    45    47    49   0.00000  1.0 1.0
   46    45    47    51   0.00000  1.0 1.0
   47    49    55    56  -0.46850  1.0 1.0
   47    49    55    56   0.09300 -1.0 2.0
   47    49    55    56  -0.12850  1.0 3.0
   48    47    49    33   0.15000  1.0 3.0
   48    47    49    50   0.15000  1.0 3.0
   48    47    49    55   0.23400  1.0 3.0
   48    47    51    52   0.13050  1.0 3.0
   48    47    51    53   0.13050  1.0 3.0
   48    47    51    54   0.13050  1.0 3.0
   49    33    38    39   0.15000  1.0 3.0
   49    33   -38    40   0.34400  1.0 1.0
   49    33   -38    40   0.09450 -1.0 2.0
   49    33   -38    40   0.11100  1.0 3.0
   49    33    38    42  -1.63150  1.0 1.0
   49    33    38    42  -0.43550 -1.0 2.0
   49    33    38    42   0.24500  1.0 3.0
   49    47    51    52   0.17350  1.0 3.0
   49    47    51    53   0.17350  1.0 3.0
   49    47    51    54   0.17350  1.0 3.0
   49    55    56    57  -2.26850  1.0 1.0
   49    55    56    57   3.39050 -1.0 2.0
   49    55    56    60   0.15100 -1.0 2.0
   50    49    55    56   0.08050  1.0 3.0
   55    56    57    58   7.00000 -1.0 2.0
   55    56    57    59   7.00000 -1.0 2.0
   55    56    60    61  -0.11900  1.0 1.0
   55    56    60    61   0.76850 -1.0 2.0
   55    56    60    61   0.14100  1.0 3.0
   55    56    60    62  -0.11900  1.0 1.0
   55    56    60    62   0.76850 -1.0 2.0
   55    56    60    62   0.14100  1.0 3.0
   57    56    60    61  -0.04000 -1.0 2.0
   57    56    60    61  -0.29050  1.0 3.0
   57    56    60    62  -0.04000 -1.0 2.0
   57    56    60    62  -0.29050  1.0 3.0
   60    56    57    58   7.00000 -1.0 2.0
   60    56    57    59   7.00000 -1.0 2.0
   51    47    49    33   1.36600  1.0 1.0
   51    47    49    33  -0.11450 -1.0 2.0
   51    47    49    33   0.24250  1.0 3.0
   51    47    49    50   0.19200  1.0 3.0
   51    47    49    55   1.69300  1.0 1.0
   51    47    49    55  -0.48450 -1.0 2.0
   42    38    40    41   0.00000  1.0 1.0
   42    38    40    45  -0.51250  1.0 1.0
   42    38    40    45  -0.88800 -1.0 2.0
   42    38    40    45   0.08850  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
   38    41    40    45   1.10000 -1.0 2.0
   47    46    45    40   1.10000 -1.0 2.0
   55    60    56    57  15.00000 -1.0 2.0
   58    59    57    56  15.00000 -1.0 2.0
   61    56    60    62  10.50000 -1.0 2.0
   43    38    42    44  10.50000 -1.0 2.0
END
