* LIGAND DATABASE FILE (OPLS2005)
*
001      56    56     98    149     288
    1     0 S   NP   _N1_     1    27.98984    96.15705   -24.28931
    2     1 S   H    _HN1     2     1.02957    82.75787   -11.94994
    3     1 S   H    _H1_     3     1.02836    25.54494   150.21011
    4     1 S   H    _H2_     4     1.02777   109.46992  -118.88993
    5     1 S   CT   _CA1     5     1.50155   128.57618    98.41116
    6     5 S   HC   _HA1     6     1.09575   105.19031    80.49736
    7     5 S   CO3  _C1_     7     1.53771   112.27416   -39.66455
    8     7 S   O2Z  _O11     8     1.26373   114.98493   -44.91734
    9     7 S   O2Z  _O12     9     1.26221   114.92262   133.96995
   10     5 S   CT   _CB1    10     1.53073   107.39769  -161.61739
   11    10 S   HC   HB11    11     1.09833   109.31247   -50.02712
   12    10 S   HC   HB12    12     1.09814   110.44561    66.51133
   13    10 S   CT   _CG1    13     1.53048   112.71458  -171.04950
   14    13 S   HC   HG11    14     1.09587   110.56904   -65.27594
   15    13 S   HC   HG12    15     1.09658   109.87044    53.96548
   16    13 S   C    _CD1    16     1.51856   112.14274   174.33358
   17    16 S   O    _OE1    17     1.22781   123.23018     4.21598
   18    16 S   N    _N2_    18     1.38556   111.88011  -175.86232
   19    18 S   H    _HN2    19     1.01580   119.19973     3.30275
   20    18 S   CT1  _CA2    20     1.45831   122.69939   177.77701
   21    20 S   HC   _HA2    21     1.09737   108.75543    27.30034
   22    20 S   C    _C2_    22     1.52958   107.05459   -89.73666
   23    22 S   O    _O2_    23     1.22980   123.07566   -27.67647
   24    20 S   CT   _CB2    32     1.53173   112.42925   150.41452
   25    24 S   HC   HB21    33     1.09602   110.23066    54.94362
   26    24 S   HC   HB22    34     1.09439   110.01417   173.81832
   27    22 S   N    _N3_    24     1.38512   112.56674   154.94963
   28    27 S   H    _HN3    25     1.01653   120.35206    -2.01003
   29    24 S   S    _SG2    35     1.82513   111.18370   -65.62408
   30    27 S   CT   _CA3    26     1.45350   122.46318   178.65303
   31    30 S   HC   HA31    27     1.09569   107.72367   -57.16097
   32    30 S   HC   HA32    28     1.09562   107.68757    59.16033
   33    29 S   CT   _C10    36     1.84717    99.39250   178.77411
   34    33 S   HC   _H4_    37     1.09674   107.24625   -35.43336
   35    30 S   CO3  _C3_    29     1.52885   114.34348  -179.08229
   36    35 S   O2Z  _O31    30     1.26334   116.07019    -2.40778
   37    35 S   O2Z  _O32    31     1.26438   114.40925   177.60175
   38    33 S   CM   _C8_    38     1.53423   108.51466  -152.25348
   39    33 S   CT   _C11    51     1.53618   109.32381    81.98049
   40    39 S   HC   _H7_    52     1.09724   110.60197   -58.38146
   41    39 S   HC   _H8_    53     1.09707   111.76913    59.91823
   42    38 S   CM   _C7_    39     1.34722   121.62823   -76.90253
   43    42 S   HC   _H6_    40     1.08399   122.12050     4.09366
   44    39 S   CO3  _C12    54     1.53123   112.03971  -176.50419
   45    44 S   O2Z  _O36    55     1.26378   114.81770  -127.17046
   46    44 S   O2Z  _O35    56     1.26282   115.59398    54.16693
   47    42 S   CO4  _C6_    41     1.47867   121.94173  -175.18773
   48    47 S   O    _O33    42     1.22769   121.01577  -176.23485
   49    47 S   CM   _C5_    43     1.48129   117.99057     5.13828
   50    49 S   CM   _C4_    44     1.33821   119.89813    -5.05067
   51    50 S   HC   _H5_    45     1.08952   118.18898   179.05664
   52    49 S   OH   _O37    49     1.37873   118.56444   175.09208
   53    52 S   HO   _H9_    50     0.97410   106.55614     0.48133
   54    38 S   CT   _C9_    46     1.53242   116.23796   107.57815
   55    54 S   OM   _O34    47     1.32196   108.09534   -73.00484
   56    54 S   HC   _H3_    48     1.10053   105.29015    57.05829
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  15   7   2   1   1  14   7   4   3   9   4   2   1   1   7   3
   7   6   4   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    54    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    47    50    54    55    56    39    40    41    44    45    46  
   38    42    54    39    40    41    44  
   36    37  
   37  
    0  
   42    43    47    48    49    50    51    54    55    56    39    40    41    44  
   40    41    44    45    46    42    54  
   41    44    45    46  
   44    45    46  
   43    47    48    49    50    54    55    56    52  
   47    48    49    54  
   45    46  
   46  
    0  
   48    49    50    51    54    52    53  
   49    50    52  
   50    51    54    55    56    52    53  
   51    54    55    56    52    53  
   54    55    56    52  
   53    54  
    0  
   55    56  
   56  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   47   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   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   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   54   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   55   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   56   2.5000   0.0500   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    42   549.000  1.340
   38    54   317.000  1.510
   42    43   340.000  1.080
   42    47   320.000  1.462
   47    48   570.000  1.229
   47    49   320.000  1.462
   49    50   549.000  1.340
   49    52   510.000  1.338
   50    51   340.000  1.080
   50    54   317.000  1.510
   54    55   570.000  1.307
   54    56   340.000  1.090
   52    53   553.000  0.945
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   317.000  1.522
   44    45   656.000  1.250
   44    46   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  112.20000
   29    33    39    75.00000  111.63000
   33    38    42    70.00000  124.00000
   33    38    54    65.00000  117.92700
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    44    70.00000  109.69300
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    47    65.00000  118.96000
   38    54    50    70.00000  110.12100
   38    54    55    85.00000  110.90400
   38    54    56    35.00000  109.50000
   42    47    48    80.00000  123.72100
   42    47    49    65.00000  118.65900
   47    42    43    40.00000  117.72500
   47    49    50    65.00000  118.96000
   47    49    52    85.00000  116.28000
   49    47    48    80.00000  123.72100
   49    50    51    35.00000  120.00000
   49    50    54    70.00000  124.00000
   49    52    53    70.00000  107.45700
   50    54    55    85.00000  110.90400
   50    54    56    35.00000  109.50000
   54    38    42    70.00000  124.00000
   54    50    51    35.00000  117.00000
   56    54    55    45.00000  125.66300
   52    49    50    80.00000  121.38400
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.02700
   39    44    45    70.00000  117.00000
   39    44    46    70.00000  117.00000
   41    39    40    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    41    35.00000  109.50000
   46    44    45    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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    38    54   0.30250  1.0 1.0
   29    33    38    54  -0.14950 -1.0 2.0
   29    33    38    54   0.36900  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    47   7.00000 -1.0 2.0
   33    38    54    50   0.09700  1.0 1.0
   33    38    54    50   0.15600 -1.0 2.0
   33    38    54    50  -0.50800  1.0 3.0
   33    38    54    55   0.09700  1.0 1.0
   33    38    54    55   0.15600 -1.0 2.0
   33    38    54    55  -0.50800  1.0 3.0
   33    38    54    56   0.34800  1.0 3.0
   33    39    44    45   0.41150 -1.0 2.0
   33    39    44    46   0.41150 -1.0 2.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    54   0.34800  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    44  -0.11250  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    33    39    44  -0.98800  1.0 1.0
   38    33    39    44   0.48800 -1.0 2.0
   38    33    39    44   0.76800  1.0 3.0
   38    42    47    48   1.00000 -1.0 2.0
   38    42    47    49  -1.18350  1.0 1.0
   38    42    47    49   1.45950 -1.0 2.0
   42    38    54    50  -0.28300  1.0 1.0
   42    38    54    50   0.26700 -1.0 2.0
   42    38    54    50  -0.63300  1.0 3.0
   42    38    54    55   0.39000  1.0 1.0
   42    38    54    55  -0.05800 -1.0 2.0
   42    38    54    55  -0.55150  1.0 3.0
   42    38    54    56   0.00000  1.0 1.0
   42    47   -49    50  -1.18350  1.0 1.0
   42    47   -49    50   1.45950 -1.0 2.0
   42    47    49    52   1.50000 -1.0 2.0
   43    42    47    48   0.00000  1.0 1.0
   43    42    47    49   0.93700 -1.0 2.0
   47    49    50    51   7.00000 -1.0 2.0
   47    49    50    54   7.00000 -1.0 2.0
   47    49    52    53   2.00000 -1.0 2.0
   48    47    49    50   1.00000 -1.0 2.0
   48    47    49    52  -0.11900  1.0 1.0
   48    47    49    52   0.76850 -1.0 2.0
   48    47    49    52   0.14100  1.0 3.0
   49    50   -54    38  -0.28300  1.0 1.0
   49    50   -54    38   0.26700 -1.0 2.0
   49    50   -54    38  -0.63300  1.0 3.0
   49    50    54    55   0.39000  1.0 1.0
   49    50    54    55  -0.05800 -1.0 2.0
   49    50    54    55  -0.55150  1.0 3.0
   49    50    54    56   0.00000  1.0 1.0
   50    49    52    53  -0.66100  1.0 1.0
   50    49    52    53   1.20850 -1.0 2.0
   50    49    52    53  -0.36000  1.0 3.0
   51    50    54    38   0.00000  1.0 1.0
   51    50    54    55   0.00000  1.0 1.0
   51    50    54    56   0.33100  1.0 3.0
   54    38    42    43   7.00000 -1.0 2.0
   54    38   -42    47   7.00000 -1.0 2.0
   52    49    50    51   7.00000 -1.0 2.0
   52    49    50    54   7.00000 -1.0 2.0
   39    33    38    42   0.09850  1.0 1.0
   39    33    38    42   0.15250 -1.0 2.0
   39    33    38    42  -0.50650  1.0 3.0
   39    33    38    54   0.46850  1.0 1.0
   39    33    38    54   0.08550 -1.0 2.0
   39    33    38    54   0.09800  1.0 3.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    46   0.00000  1.0 1.0
   41    39    44    45   0.00000  1.0 1.0
   41    39    44    46   0.00000  1.0 1.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    54    38    42   1.10000 -1.0 2.0
   47    43    42    38   1.10000 -1.0 2.0
   42    49    47    48  10.50000 -1.0 2.0
   47    52    49    50   1.10000 -1.0 2.0
   54    51    50    49   1.10000 -1.0 2.0
   45    39    44    46  10.50000 -1.0 2.0
END
