* LIGAND DATABASE FILE (OPLS2005)
*
001      61    61    112    163     324
    1     0 S   NP   _N1_     1    28.84719    95.65375   -25.17505
    2     1 S   H    _HN1     2     1.02946    75.60052     4.22948
    3     1 S   H    _H1_     3     1.02826    31.54604  -178.76869
    4     1 S   H    _H2_     4     1.02797   117.36640   -99.27213
    5     1 S   CT   _CA1     5     1.50138   124.88312   109.30907
    6     5 S   HC   _HA1     6     1.09573   105.15717    91.39555
    7     5 S   CO3  _C1_     7     1.53767   112.42651   -28.81795
    8     7 S   O2Z  _O11     8     1.26381   114.99979   -43.03374
    9     7 S   O2Z  _O12     9     1.26229   114.94661   135.90703
   10     5 S   CT   _CB1    10     1.53050   107.39772  -150.63360
   11    10 S   HC   HB11    11     1.09844   109.34598   -49.14108
   12    10 S   HC   HB12    12     1.09810   110.47578    67.45357
   13    10 S   CT   _CG1    13     1.53028   112.64288  -170.05256
   14    13 S   HC   HG11    14     1.09566   110.76098   -67.35672
   15    13 S   HC   HG12    15     1.09667   109.68583    51.90157
   16    13 S   C    _CD1    16     1.51812   111.89624   172.41726
   17    16 S   O    _OE1    17     1.22768   123.13990    13.76174
   18    16 S   N    _N2_    18     1.38617   111.90219  -166.27960
   19    18 S   H    _HN2    19     1.01592   119.07434     0.60587
   20    18 S   CT1  _CA2    20     1.46255   123.40484   176.79277
   21    20 S   HC   _HA2    21     1.09741   109.22976     9.19808
   22    20 S   C    _C2_    22     1.53734   109.09535  -106.38674
   23    22 S   O    _O2_    23     1.23100   122.18017  -150.28399
   24    20 S   CT   _CB2    32     1.53508   111.55263   131.14868
   25    24 S   HC   HB21    33     1.09385   109.31808    57.51334
   26    24 S   HC   HB22    34     1.09364   109.68193   176.15254
   27    22 S   N    _N3_    24     1.38298   113.99765    37.26701
   28    27 S   H    _HN3    25     1.01527   119.63390    -3.24775
   29    24 S   S    _SG2    35     1.82953   111.07642   -64.02319
   30    27 S   CT   _CA3    26     1.45274   123.28633   177.21828
   31    30 S   HC   HA31    27     1.09547   107.52391   -64.75257
   32    30 S   HC   HA32    28     1.09556   107.98616    51.70374
   33    29 S   CT   _C9_    36     1.87661   101.92375   173.69914
   34    30 S   CO3  _C3_    29     1.52976   114.04930   173.72599
   35    34 S   O2Z  _O31    30     1.26384   116.10005     0.50435
   36    34 S   O2Z  _O32    31     1.26428   114.41010  -179.45356
   37    33 S   CT   _C8_    37     1.55389   105.52688  -175.82191
   38    37 S   HC   _H9_    38     1.09927   110.34084    56.53542
   39    37 S   HC   _H10    39     1.09867   110.41591   -60.49089
   40    33 S   CT   _C12    58     1.54865   106.45870    68.47681
   41    40 S   HC   _H11    59     1.09473   112.15608   -64.92758
   42    40 S   HC   _H12    60     1.09505   111.75338   176.24761
   43    40 S   HC   _H13    61     1.09646   111.69973    56.48823
   44    37 S   CT   _C7_    40     1.53375   113.53335   178.06467
   45    44 S   HC   _H7_    41     1.09392   106.91262  -175.55305
   46    44 S   HC   _H8_    42     1.09613   110.24236    69.49386
   47    44 S   CM   _C6_    43     1.50475   112.40068   -52.25712
   48    47 S   CO4  _C11    44     1.50701   113.28912    47.83472
   49    48 S   O    _O33    45     1.23238   120.45413   130.51008
   50    47 S   CM   _C5_    49     1.35251   126.65220  -132.12334
   51    33 S   CT   _C10    46     1.56928   114.06838   -52.72359
   52    51 S   OM   _O34    47     1.32456   112.70956   -53.57565
   53    51 S   HC   _H3_    48     1.10063   106.26720    79.23951
   54    50 S   CT   _C4_    50     1.50876   123.34821    -4.61469
   55    54 S   HC   _H4_    51     1.09468   110.16153   104.99773
   56    54 S   HC   _H5_    52     1.09600   110.03344  -135.72024
   57    54 S   HC   _H6_    53     1.09219   113.60552   -16.98628
   58    50 S   CT   _C13    54     1.51058   124.34654   174.64061
   59    58 S   HC   _H14    55     1.09467   110.13184   105.42642
   60    58 S   HC   _H15    56     1.09601   110.02538  -135.33606
   61    58 S   HC   _H16    57     1.09276   113.65193   -16.64186
  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  13   5   4   3
  16   2   1   1  15   7   6   8   3   2   1   9   4   3  14   7
   4   9   2   1   1   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    44    48    51    52    53    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    44    45    46    47    48    49    51    52    53    40    41    42    43  
   35    36  
   36  
    0  
   38    39    44    45    46    47    48    51    52    53    50    40    41    42    43  
   39    44    45    46    47    51    40  
   44    45    46    47    51    40  
   41    42    43    44    48    51    52    53  
   42    43    51  
   43    51  
   51  
   45    46    47    48    49    51    50    54    58  
   46    47    48    50  
   47    48    50  
   48    49    51    52    53    50    54    55    56    57    58    59    60    61  
   49    51    52    53    50    54    58  
   51    52    53    50  
   54    55    56    57    58    59    60    61    51  
   52    53  
   53  
    0  
   55    56    57    58    59    60    61  
   56    57    58  
   57    58  
   58  
   59    60    61  
   60    61  
   61  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   52   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   53   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   222.000  1.810
   33    37   268.000  1.529
   33    51   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   317.000  1.510
   47    48   320.000  1.462
   47    50   549.000  1.340
   48    49   570.000  1.229
   48    51   317.000  1.522
   51    52   570.000  1.307
   51    53   340.000  1.090
   50    54   317.000  1.510
   50    58   317.000  1.510
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   340.000  1.090
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    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    37    75.00000  111.63000
   29    33    51    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    44    58.35000  112.70000
   33    51    48    63.00000  111.10000
   33    51    52    50.00000  109.50000
   33    51    53    37.50000  110.70000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    37.50000  110.70000
   37    44    46    37.50000  110.70000
   37    44    47    70.00000  112.02700
   39    37    38    33.00000  107.80000
   44    37    38    37.50000  110.70000
   44    37    39    37.50000  110.70000
   44    47    48    65.00000  116.34900
   44    47    50    70.00000  124.00000
   46    44    45    33.00000  107.80000
   47    44    45    35.00000  109.50000
   47    44    46    35.00000  109.50000
   47    48    49    80.00000  123.72100
   47    48    51    65.00000  118.62400
   47    50    54    70.00000  124.00000
   47    50    58    70.00000  124.00000
   48    51    52    90.00000  108.74100
   48    51    53    35.00000  109.50000
   51    33    37    58.35000  112.70000
   51    48    49    80.00000  120.40000
   53    51    52    45.00000  125.66300
   50    47    48    65.00000  118.96000
   50    54    55    35.00000  109.50000
   50    54    56    35.00000  109.50000
   50    54    57    35.00000  109.50000
   50    58    59    35.00000  109.50000
   50    58    60    35.00000  109.50000
   50    58    61    35.00000  109.50000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   58    50    54    65.00000  117.92700
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40    33    51    58.35000  112.70000
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    33.00000  107.80000
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    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    44   0.44750  1.0 1.0
   29    33    37    44  -0.17800 -1.0 2.0
   29    33    37    44   0.20200  1.0 3.0
   29    33    51    48   0.56750  1.0 1.0
   29    33    51    48  -0.07550 -1.0 2.0
   29    33    51    48   0.20000  1.0 3.0
   29    33    51    52   0.56750  1.0 1.0
   29    33    51    52  -0.07550 -1.0 2.0
   29    33    51    52   0.20000  1.0 3.0
   29    33    51    53   0.15000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    43   0.15000  1.0 3.0
   33    37    44    45   0.15000  1.0 3.0
   33    37    44    46   0.15000  1.0 3.0
   33    37    44    47   0.34400  1.0 1.0
   33    37    44    47   0.09450 -1.0 2.0
   33    37    44    47   0.11100  1.0 3.0
   37    33    51    48  -0.95700  1.0 1.0
   37    33    51    48  -0.18200 -1.0 2.0
   37    33    51    48   0.29450  1.0 3.0
   37    33    51    52   0.62750  1.0 1.0
   37    33    51    52  -0.30950 -1.0 2.0
   37    33    51    52   0.27300  1.0 3.0
   37    33    51    53   0.15000  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    43   0.15000  1.0 3.0
   37    44   -47    48   0.09700  1.0 1.0
   37    44   -47    48   0.15600 -1.0 2.0
   37    44   -47    48  -0.50800  1.0 3.0
   37    44    47    50   0.09850  1.0 1.0
   37    44    47    50   0.15250 -1.0 2.0
   37    44    47    50  -0.50650  1.0 3.0
   38    37    44    45   0.15000  1.0 3.0
   38    37    44    46   0.15000  1.0 3.0
   38    37    44    47   0.15000  1.0 3.0
   39    37    44    45   0.15000  1.0 3.0
   39    37    44    46   0.15000  1.0 3.0
   39    37    44    47   0.15000  1.0 3.0
   44    47    48    49  -0.64400  1.0 1.0
   44    47    48    49   0.26850 -1.0 2.0
   44    47    48    51   0.25700  1.0 1.0
   44    47    48    51   0.66200 -1.0 2.0
   44    47    48    51   0.04450  1.0 3.0
   44    47    50    54   7.00000 -1.0 2.0
   44    47    50    58   7.00000 -1.0 2.0
   45    44    47    48   0.15000  1.0 3.0
   45    44    47    50   0.00000  1.0 1.0
   46    44    47    48   0.15000  1.0 3.0
   46    44    47    50   0.00000  1.0 1.0
   47    48   -51    33   0.65300  1.0 1.0
   47    48   -51    33  -0.03850 -1.0 2.0
   47    48   -51    33   0.33900  1.0 3.0
   47    48    51    52   0.65300  1.0 1.0
   47    48    51    52  -0.03850 -1.0 2.0
   47    48    51    52   0.33900  1.0 3.0
   47    48    51    53   0.00000  1.0 1.0
   47    50    54    55   0.00000  1.0 1.0
   47    50    54    56   0.00000  1.0 1.0
   47    50    54    57   0.00000  1.0 1.0
   47    50    58    59   0.00000  1.0 1.0
   47    50    58    60   0.00000  1.0 1.0
   47    50    58    61   0.00000  1.0 1.0
   48    47    50    54   7.00000 -1.0 2.0
   48    47    50    58   7.00000 -1.0 2.0
   49    48    51    33   0.30150 -1.0 2.0
   49    48    51    52   0.30150 -1.0 2.0
   49    48    51    53   0.00000  1.0 1.0
   51    33    37    38   0.15000  1.0 3.0
   51    33    37    39   0.15000  1.0 3.0
   51    33   -37    44   0.56750  1.0 1.0
   51    33   -37    44  -0.07550 -1.0 2.0
   51    33   -37    44   0.20000  1.0 3.0
   51    33    40    41   0.15000  1.0 3.0
   51    33    40    42   0.15000  1.0 3.0
   51    33    40    43   0.15000  1.0 3.0
   50    47    48    49   1.00000 -1.0 2.0
   50    47    48    51  -0.33500  1.0 1.0
   50    47    48    51   1.06600 -1.0 2.0
   50    47    48    51  -0.14000  1.0 3.0
   54    50    58    59   0.34800  1.0 3.0
   54    50    58    60   0.34800  1.0 3.0
   54    50    58    61   0.34800  1.0 3.0
   58    50    54    55   0.34800  1.0 3.0
   58    50    54    56   0.34800  1.0 3.0
   58    50    54    57   0.34800  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    44   0.56750  1.0 1.0
   40    33    37    44  -0.07550 -1.0 2.0
   40    33    37    44   0.20000  1.0 3.0
   40    33    51    48  -0.95700  1.0 1.0
   40    33    51    48  -0.18200 -1.0 2.0
   40    33    51    48   0.29450  1.0 3.0
   40    33    51    52   0.62750  1.0 1.0
   40    33    51    52  -0.30950 -1.0 2.0
   40    33    51    52   0.27300  1.0 3.0
   40    33    51    53   0.15000  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
   35    30    34    36  10.50000 -1.0 2.0
   44    48    47    50   1.10000 -1.0 2.0
   47    51    48    49  10.50000 -1.0 2.0
   54    58    50    47   1.10000 -1.0 2.0
END
