* LIGAND DATABASE FILE (OPLS2005)
*
001      63    62    110    154     316
    1     0 S   NP   _N1_     1    28.88506    94.84354   -20.25464
    2     1 S   H    _HN1     2     1.02776    86.17877   -78.74562
    3     1 S   H    _H1_     3     1.02963    90.03330    29.64785
    4     1 S   H    _H2_     4     1.02834    34.19058   150.92508
    5     1 S   CT   _CA1     5     1.50143   144.82608   156.84058
    6     5 S   HC   _HA1     6     1.09576   105.18826    55.52449
    7     5 S   CO3  _C1_     7     1.53743   112.50659   -64.54022
    8     7 S   O2Z  _O11     8     1.26355   115.02164   -40.03221
    9     7 S   O2Z  _O12     9     1.26257   114.95046   139.19738
   10     5 S   CT   _CB1    10     1.53093   107.40120   173.39678
   11    10 S   HC   HB11    11     1.09822   109.19166   -50.86296
   12    10 S   HC   HB12    12     1.09804   110.41097    65.60186
   13    10 S   CT   _CG1    13     1.53005   112.80011  -172.01222
   14    13 S   HC   HG11    14     1.09593   110.41197   -65.74614
   15    13 S   HC   HG12    15     1.09653   110.00729    53.47140
   16    13 S   C    _CD1    16     1.51831   112.36981   173.69880
   17    16 S   O    _OE1    17     1.22714   123.29366    -2.77981
   18    16 S   N    _N2_    18     1.38624   111.61511   177.51951
   19    18 S   H    _HN2    19     1.01591   118.96365     0.53522
   20    18 S   CT1  _CA2    20     1.46275   123.46126  -179.59846
   21    20 S   HC   _HA2    21     1.09735   109.34156   -14.45900
   22    20 S   C    _C2_    22     1.53423   108.24581  -130.07104
   23    22 S   O    _O2_    23     1.23007   122.25903  -146.03903
   24    20 S   CT   _CB2    32     1.53364   111.37258   107.77510
   25    24 S   HC   HB21    33     1.09644   109.80219    55.18615
   26    24 S   HC   HB22    34     1.09542   110.75734   173.16571
   27    22 S   N    _N3_    24     1.38511   113.33224    41.32743
   28    27 S   H    _HN3    25     1.01532   118.90723    -0.68842
   29    24 S   S    _SG2    35     1.82638   111.64092   -67.81471
   30    27 S   CT   _CA3    26     1.45455   123.53188   175.07089
   31    30 S   HC   HA31    27     1.09515   109.34935    22.21062
   32    30 S   HC   HA32    28     1.09498   107.09762   139.24128
   33    29 S   CM   _C7_    36     1.75738    99.85145   139.20676
   34    30 S   CO3  _C3_    29     1.52918   113.02375  -101.33653
   35    34 S   O2Z  _O31    30     1.26409   115.37315   -44.97430
   36    34 S   O2Z  _O32    31     1.26348   115.00135   135.93181
   37    33 S   CM   _C6_    37     1.35969   121.72083    97.05834
   38    33 S   CT   _C10    50     1.52669   114.67456   -81.51102
   39    38 S   HC   _H23    51     1.09869   110.27916    28.80632
   40    38 S   HC   _H24    52     1.09841   108.48014   141.76869
   41    37 S   CT   _C9_    38     1.51804   124.34297    -0.96995
   42    41 S   HC   _H20    39     1.09500   110.17035   110.04828
   43    41 S   HC   _H21    40     1.09487   110.42248  -130.31739
   44    41 S   HC   _H22    41     1.09190   114.38695   -10.89892
   45    37 S   CT   _C12    42     1.52896   122.14053   178.97856
   46    45 S   HC   _H27    43     1.09268   110.92938   -18.58163
   47    38 S   CT   _C13    53     1.54299   113.98719   -95.61508
   48    47 S   Cl   CL14    54     1.79651   111.21370    76.53623
   49    47 S   HC   _H28    55     1.09319   108.80218   -37.73053
   50    45 S   CT   _C11    44     1.52587   111.42543   104.70206
   51    50 S   Br   BR15    45     1.95641   109.66139  -165.53649
   52    50 S   HC   _H25    46     1.09359   112.65153   -48.30289
   53    50 S   HC   _H26    47     1.09352   112.86549    77.54409
   54    45 S   OH   _O33    48     1.43004   108.87004  -134.07698
   55    54 S   HO   _H29    49     0.97288   107.29763  -179.41818
   56    47 S   CM   _C5_    56     1.52104   112.43563  -160.68756
   57    56 S   CM   _C4_    57     1.34307   124.04652   121.56494
   58    57 S   Cl   CL13    58     1.71283   126.28784     0.09065
   59    57 S   HC   _H16    59     1.08325   123.07358  -179.61948
   60    56 S   CT   _C8_    60     1.51004   117.21097   -57.44867
   61    60 S   HC   _H17    61     1.09276   110.91747   -58.69533
   62    60 S   HC   _H18    62     1.09568   112.10558  -178.36004
   63    60 S   HC   _H19    63     1.09427   110.76460    61.97237
  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
  16   2   1   1  16  10   5   4   7   3   2   1   7   6  10   4
   3   5   3   2   1   1   1   7   6   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    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    45    38    39    40    47  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    43    44    45    46    50    54    38    39    40    47    48    49    56  
   35    36  
   36  
    0  
   41    42    43    44    45    46    50    51    52    53    54    55    38    39    40    47  
   39    40    47    48    49    56    57    60    41    45  
   40    47    48    49    56  
   47    48    49    56  
   42    43    44    45    46    50    54  
   43    44    45  
   44    45  
   45  
   46    50    51    52    53    54    55  
   50    51    52    53    54    55  
   48    49    56    57    58    59    60    61    62    63  
   49    56    57    60  
   56    57    60  
   51    52    53    54    55  
   52    53    54  
   53    54  
   54  
   55  
    0  
   57    58    59    60    61    62    63  
   58    59    60    61    62    63  
   59    60  
   60  
   61    62    63  
   62    63  
   63  
    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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.315500   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   48   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   49   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.199400   1.9750   1.7500   0.005000000  -0.741685710
   51   3.4700   0.4700  -0.203900   2.8000   2.5000   0.001000000  -0.686339560
   52   2.5000   0.0300   0.146400   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.146400   1.4250   1.2500   0.008598240   0.268726247
   54   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   57   3.5500   0.0760   0.005000   2.0020   1.7750   0.023028004  -0.852763146
   58   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   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   240.000  1.763
   33    37   549.000  1.340
   33    38   317.000  1.510
   37    41   317.000  1.510
   37    45   317.000  1.510
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   340.000  1.090
   45    46   340.000  1.090
   45    50   268.000  1.529
   45    54   320.000  1.410
   50    51   245.000  1.990
   50    52   340.000  1.090
   50    53   340.000  1.090
   54    55   553.000  0.945
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    47   268.000  1.529
   47    48   245.000  1.781
   47    49   340.000  1.090
   47    56   317.000  1.510
   56    57   549.000  1.340
   56    60   317.000  1.510
   57    58   300.000  1.725
   57    59   340.000  1.080
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   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    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    38    65.00000  117.37300
   33    37    41    70.00000  124.00000
   33    37    45    70.00000  124.00000
   33    38    39    35.00000  109.50000
   33    38    40    35.00000  109.50000
   33    38    47    70.00000  112.02700
   37    41    42    35.00000  109.50000
   37    41    43    35.00000  109.50000
   37    41    44    35.00000  109.50000
   37    45    46    35.00000  109.50000
   37    45    50    70.00000  112.02700
   37    45    54    90.00000  110.39200
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    33.00000  107.80000
   45    37    41    65.00000  117.92700
   45    50    51    70.00000  109.17700
   45    50    52    37.50000  110.70000
   45    50    53    37.50000  110.70000
   45    54    55    55.00000  108.50000
   50    45    46    37.50000  110.70000
   52    50    51    51.00000  107.60000
   53    50    51    51.00000  107.60000
   53    50    52    33.00000  107.80000
   54    45    46    35.00000  109.50000
   54    45    50    50.00000  109.50000
   38    33    37    70.00000  124.00000
   38    47    48    69.00000  109.80000
   38    47    49    37.50000  110.70000
   38    47    56    70.00000  112.02700
   40    38    39    33.00000  107.80000
   47    38    39    37.50000  110.70000
   47    38    40    37.50000  110.70000
   47    56    57    70.00000  124.00000
   47    56    60    65.00000  117.92700
   49    47    48    51.00000  107.60000
   56    47    48    75.00000  111.90500
   56    47    49    35.00000  109.50000
   56    57    58    75.00000  121.50000
   56    57    59    35.00000  120.00000
   56    60    61    35.00000  109.50000
   56    60    62    35.00000  109.50000
   56    60    63    35.00000  109.50000
   59    57    58    60.00000  114.00000
   60    56    57    70.00000  124.00000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    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   0.00000  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    38   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    41   7.00000 -1.0 2.0
   29    33    37    45   7.00000 -1.0 2.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    40   0.00000  1.0 1.0
   29    33    38    47   0.09700  1.0 1.0
   29    33    38    47   0.15600 -1.0 2.0
   29    33    38    47  -0.50800  1.0 3.0
   33    37    41    42   0.00000  1.0 1.0
   33    37    41    43   0.00000  1.0 1.0
   33    37    41    44   0.00000  1.0 1.0
   33    37    45    46   0.00000  1.0 1.0
   33    37    45    50   0.09850  1.0 1.0
   33    37    45    50   0.15250 -1.0 2.0
   33    37    45    50  -0.50650  1.0 3.0
   33    37    45    54   0.67800  1.0 1.0
   33    37    45    54   0.47050 -1.0 2.0
   33    37    45    54  -0.62500  1.0 3.0
   33    38    47    48   0.56750  1.0 1.0
   33    38    47    48  -0.07550 -1.0 2.0
   33    38    47    48   0.20000  1.0 3.0
   33    38    47    49   0.15000  1.0 3.0
   33    38    47    56   0.31000  1.0 1.0
   33    38    47    56   0.14700 -1.0 2.0
   33    38    47    56   0.07550  1.0 3.0
   37    33    38    39   0.00000  1.0 1.0
   37    33    38    40   0.00000  1.0 1.0
   37    33    38    47   0.09850  1.0 1.0
   37    33    38    47   0.15250 -1.0 2.0
   37    33    38    47  -0.50650  1.0 3.0
   37    45    50    51   0.56750  1.0 1.0
   37    45    50    51  -0.07550 -1.0 2.0
   37    45    50    51   0.20000  1.0 3.0
   37    45    50    52   0.15000  1.0 3.0
   37    45    50    53   0.15000  1.0 3.0
   37    45    54    55  -0.07800  1.0 1.0
   37    45    54    55  -0.21500 -1.0 2.0
   37    45    54    55  -0.03150  1.0 3.0
   41    37    45    46   0.34800  1.0 3.0
   41    37    45    50   0.46850  1.0 1.0
   41    37    45    50   0.08550 -1.0 2.0
   41    37    45    50   0.09800  1.0 3.0
   41    37    45    54   0.18000  1.0 1.0
   41    37    45    54   0.16450 -1.0 2.0
   41    37    45    54   0.04450  1.0 3.0
   45    37    41    42   0.34800  1.0 3.0
   45    37    41    43   0.34800  1.0 3.0
   45    37    41    44   0.34800  1.0 3.0
   46    45    50    51   0.39750  1.0 3.0
   46    45    50    52   0.15000  1.0 3.0
   46    45    50    53   0.15000  1.0 3.0
   46    45    54    55   0.19450  1.0 3.0
   50    45    54    55  -0.11600  1.0 1.0
   50    45    54    55  -0.09450 -1.0 2.0
   50    45    54    55   0.21250  1.0 3.0
   54    45    50    51   0.56750  1.0 1.0
   54    45    50    51  -0.07550 -1.0 2.0
   54    45    50    51   0.20000  1.0 3.0
   54    45    50    52   0.23400  1.0 3.0
   54    45    50    53   0.23400  1.0 3.0
   38    33    37    41   7.00000 -1.0 2.0
   38    33    37    45   7.00000 -1.0 2.0
   38    47    56    57   0.09850  1.0 1.0
   38    47    56    57   0.15250 -1.0 2.0
   38    47    56    57  -0.50650  1.0 3.0
   38    47    56    60   0.46850  1.0 1.0
   38    47    56    60   0.08550 -1.0 2.0
   38    47    56    60   0.09800  1.0 3.0
   39    38    47    48   0.27000  1.0 3.0
   39    38    47    49   0.15000  1.0 3.0
   39    38    47    56   0.15000  1.0 3.0
   40    38    47    48   0.27000  1.0 3.0
   40    38    47    49   0.15000  1.0 3.0
   40    38    47    56   0.15000  1.0 3.0
   47    56    57    58   7.00000 -1.0 2.0
   47    56    57    59   7.00000 -1.0 2.0
   47    56    60    61   0.34800  1.0 3.0
   47    56    60    62   0.34800  1.0 3.0
   47    56    60    63   0.34800  1.0 3.0
   48    47    56    57   0.09700  1.0 1.0
   48    47    56    57   0.15600 -1.0 2.0
   48    47    56    57  -0.50800  1.0 3.0
   48    47    56    60   0.09700  1.0 1.0
   48    47    56    60   0.15600 -1.0 2.0
   48    47    56    60  -0.50800  1.0 3.0
   49    47    56    57   0.00000  1.0 1.0
   49    47    56    60   0.34800  1.0 3.0
   57    56    60    61   0.00000  1.0 1.0
   57    56    60    62   0.00000  1.0 1.0
   57    56    60    63   0.00000  1.0 1.0
   60    56    57    58   7.00000 -1.0 2.0
   60    56    57    59   7.00000 -1.0 2.0
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    38    33    37  15.00000 -1.0 2.0
   41    45    37    33  15.00000 -1.0 2.0
   47    60    56    57  15.00000 -1.0 2.0
   58    59    57    56  15.00000 -1.0 2.0
END
