* LIGAND DATABASE FILE (OPLS2005)
*
001      64    63    115    163     333
    1     0 S   NP   _N1_     1    28.84387    94.68187   -21.90223
    2     1 S   H    _HN1     2     1.02952    84.72311    17.47502
    3     1 S   H    _H1_     3     1.02832    31.82521   152.49291
    4     1 S   H    _H2_     4     1.02781    94.65333   -90.57504
    5     1 S   CT   _CA1     5     1.50115   141.51311   133.99866
    6     5 S   HC   _HA1     6     1.09568   105.22009    69.51248
    7     5 S   CO3  _C1_     7     1.53777   112.41983   -50.77091
    8     7 S   O2Z  _O11     8     1.26376   114.99718   -42.30810
    9     7 S   O2Z  _O12     9     1.26234   114.96584   136.92079
   10     5 S   CT   _CB1    10     1.53088   107.43865  -172.44134
   11    10 S   HC   HB11    11     1.09826   109.41594   -49.18165
   12    10 S   HC   HB12    12     1.09820   110.41980    67.44563
   13    10 S   CT   _CG1    13     1.52983   112.62381  -170.18795
   14    13 S   HC   HG11    14     1.09562   110.55433   -63.85649
   15    13 S   HC   HG12    15     1.09661   109.91471    55.34948
   16    13 S   C    _CD1    16     1.51801   112.28808   175.69484
   17    16 S   O    _OE1    17     1.22723   123.31348     0.70388
   18    16 S   N    _N2_    18     1.38607   111.60755  -179.31643
   19    18 S   H    _HN2    19     1.01602   118.94866     1.18201
   20    18 S   CT1  _CA2    20     1.46270   123.45217   179.18363
   21    20 S   HC   _HA2    21     1.09736   109.36448    -8.30747
   22    20 S   C    _C2_    22     1.53407   108.37529  -123.77839
   23    22 S   O    _O2_    23     1.23023   122.40229  -148.14347
   24    20 S   CT   _CB2    32     1.53252   111.36444   113.78832
   25    24 S   HC   HB21    33     1.09653   109.90842    54.84584
   26    24 S   HC   HB22    34     1.09522   110.80558   173.73625
   27    22 S   N    _N3_    24     1.38374   113.46385    39.38618
   28    27 S   H    _HN3    25     1.01637   119.48663    -3.63976
   29    24 S   S    _SG2    35     1.82321   111.45818   -66.19414
   30    27 S   CT   _CA3    26     1.45284   123.15134   176.96746
   31    30 S   HC   HA31    27     1.09551   107.53318   -63.75154
   32    30 S   HC   HA32    28     1.09558   107.94547    52.66427
   33    29 S   CO4  _C12    36     1.76599    99.16557   163.60066
   34    33 S   O    _O33    37     1.22852   119.17146    47.40166
   35    30 S   CO3  _C3_    29     1.52940   114.11400   174.64043
   36    35 S   O2Z  _O31    30     1.26370   116.04848    -0.76974
   37    35 S   O2Z  _O32    31     1.26427   114.41623   179.28838
   38    33 S   N    _N4_    38     1.40454   116.70025  -133.26992
   39    38 S   CT   _C7_    39     1.46860   117.65124  -177.20082
   40    39 S   HC   _H10    40     1.09734   107.42443   -42.03302
   41    39 S   HC   _H11    41     1.09590   109.55949  -157.56738
   42    38 S   CT   _C8_    52     1.47605   125.43361     3.56018
   43    42 S   HC   _H12    53     1.09526   108.34517   -42.20106
   44    42 S   HC   _H13    54     1.09666   108.81796  -156.76321
   45    39 S   CT   _C5_    42     1.54105   113.17201    78.40843
   46    45 S   HC   _H6_    43     1.09700   109.29965   -54.21939
   47    42 S   CT   _C9_    55     1.54232   113.43146    80.12907
   48    47 S   HC   _H14    56     1.09593   109.82835   -52.40027
   49    45 S   CT   _C4_    44     1.52921   112.22099    65.33037
   50    49 S   HC   _H3_    45     1.09521   111.30034    57.22542
   51    49 S   HC   _H4_    46     1.09538   110.74788   177.29607
   52    49 S   HC   _H5_    47     1.09445   111.17242   -63.53908
   53    45 S   CT   _C6_    48     1.53007   109.76620  -172.28126
   54    53 S   HC   _H7_    49     1.09538   111.28286   -61.49569
   55    53 S   HC   _H8_    50     1.09519   110.83907   178.25504
   56    53 S   HC   _H9_    51     1.09515   110.80833    58.77240
   57    47 S   CT   _C10    57     1.52923   112.27288    67.08851
   58    57 S   HC   _H15    58     1.09515   111.33840    56.76202
   59    57 S   HC   _H16    59     1.09544   110.74717   176.83789
   60    57 S   HC   _H17    60     1.09432   111.13609   -64.09658
   61    47 S   CT   _C11    61     1.52994   109.71247  -170.60328
   62    61 S   HC   _H18    62     1.09527   111.32062   -60.24914
   63    61 S   HC   _H19    63     1.09475   110.75274   179.57849
   64    61 S   HC   _H20    64     1.09522   110.80728    60.12480
  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   5   5   4   3
  10   3   2   1   1  14  16   6   5  13   5   4   9   8   9   8
   7   3   2   1   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    42    43    44    47  
   38    39    42  
   36    37  
   37  
    0  
   39    40    41    45    46    49    53    42    43    44    47    48    57    61  
   40    41    45    46    49    50    51    52    53    54    55    56    42    43    44    47  
   41    45    46    49    53    42  
   45    46    49    53    42  
   43    44    47    48    57    58    59    60    61    62    63    64    45  
   44    47    48    57    61  
   47    48    57    61  
   46    49    50    51    52    53    54    55    56  
   49    50    51    52    53    54    55    56  
   48    57    58    59    60    61    62    63    64  
   57    58    59    60    61    62    63    64  
   50    51    52    53    54    55    56  
   51    52    53  
   52    53  
   53  
   54    55    56  
   55    56  
   56  
    0  
   58    59    60    61    62    63    64  
   59    60    61  
   60    61  
   61  
   62    63    64  
   63    64  
   64  
    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  -0.219900   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   3.7500   0.1050   0.408800   1.9250   1.7000   0.001000000  -0.126889456
   34   2.9600   0.2100  -0.497000   1.5250   1.4250   0.001000000  -1.480495490
   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   3.2500   0.1700   0.000600   1.8100   1.6000   0.054801302  -1.445846770
   39   3.5000   0.0660  -0.050000   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   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   45   3.5000   0.0660  -0.060000   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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
   64   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    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   210.000  1.799
   33    34   570.000  1.229
   33    38   435.000  1.380
   38    39   337.000  1.449
   38    42   337.000  1.449
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    45   268.000  1.529
   45    46   340.000  1.090
   45    49   268.000  1.529
   45    53   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    47   268.000  1.529
   47    48   340.000  1.090
   47    57   268.000  1.529
   47    61   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   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    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    90.00000   96.72000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    80.00000  121.30200
   29    33    38    80.00000  112.20600
   33    38    39    70.00000  120.44000
   33    38    42    70.00000  120.44000
   38    33    34    85.00000  125.96000
   38    39    40    35.00000  109.50000
   38    39    41    35.00000  109.50000
   38    39    45    70.00000  110.72300
   38    42    43    35.00000  109.50000
   38    42    44    35.00000  109.50000
   38    42    47    70.00000  110.72300
   39    45    46    37.50000  110.70000
   39    45    49    58.35000  112.70000
   39    45    53    58.35000  112.70000
   41    39    40    33.00000  107.80000
   45    39    40    37.50000  110.70000
   45    39    41    37.50000  110.70000
   45    49    50    37.50000  110.70000
   45    49    51    37.50000  110.70000
   45    49    52    37.50000  110.70000
   45    53    54    37.50000  110.70000
   45    53    55    37.50000  110.70000
   45    53    56    37.50000  110.70000
   49    45    46    37.50000  110.70000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   53    45    46    37.50000  110.70000
   53    45    49    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   42    38    39    50.00000  118.00000
   42    47    48    37.50000  110.70000
   42    47    57    58.35000  112.70000
   42    47    61    58.35000  112.70000
   44    42    43    33.00000  107.80000
   47    42    43    37.50000  110.70000
   47    42    44    37.50000  110.70000
   47    57    58    37.50000  110.70000
   47    57    59    37.50000  110.70000
   47    57    60    37.50000  110.70000
   47    61    62    37.50000  110.70000
   47    61    63    37.50000  110.70000
   47    61    64    37.50000  110.70000
   57    47    48    37.50000  110.70000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   61    47    48    37.50000  110.70000
   61    47    57    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    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    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  -0.11550  1.0 1.0
   24    29    33    34   1.88700 -1.0 2.0
   24    29    33    38  -0.11550  1.0 1.0
   24    29    33    38   1.88700 -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    38    39   2.45000 -1.0 2.0
   29    33    38    42   2.45000 -1.0 2.0
   33    38    39    40   0.00000  1.0 1.0
   33    38    39    41   0.00000  1.0 1.0
   33    38    39    45  -0.43950  1.0 1.0
   33    38    39    45  -0.08100 -1.0 2.0
   33    38    39    45   0.03350  1.0 3.0
   33    38    42    43   0.00000  1.0 1.0
   33    38    42    44   0.00000  1.0 1.0
   33    38    42    47  -0.43950  1.0 1.0
   33    38    42    47  -0.08100 -1.0 2.0
   33    38    42    47   0.03350  1.0 3.0
   34    33    38    39   3.04450 -1.0 2.0
   34    33    38    42   3.04450 -1.0 2.0
   38    39    45    46   0.15000  1.0 3.0
   38    39    45    49   0.43900  1.0 1.0
   38    39    45    49   0.49100 -1.0 2.0
   38    39    45    49   0.28400  1.0 3.0
   38    39    45    53   0.43900  1.0 1.0
   38    39    45    53   0.49100 -1.0 2.0
   38    39    45    53   0.28400  1.0 3.0
   38    42    47    48   0.15000  1.0 3.0
   38    42    47    57   0.43900  1.0 1.0
   38    42    47    57   0.49100 -1.0 2.0
   38    42    47    57   0.28400  1.0 3.0
   38    42    47    61   0.43900  1.0 1.0
   38    42    47    61   0.49100 -1.0 2.0
   38    42    47    61   0.28400  1.0 3.0
   39    38    42    43   0.00000  1.0 1.0
   39    38    42    44   0.00000  1.0 1.0
   39    38    42    47  -0.05900 -1.0 2.0
   39    45    49    50   0.15000  1.0 3.0
   39    45    49    51   0.15000  1.0 3.0
   39    45    49    52   0.15000  1.0 3.0
   39    45    53    54   0.15000  1.0 3.0
   39    45    53    55   0.15000  1.0 3.0
   39    45    53    56   0.15000  1.0 3.0
   40    39    45    46   0.15000  1.0 3.0
   40    39    45    49   0.15000  1.0 3.0
   40    39    45    53   0.15000  1.0 3.0
   41    39    45    46   0.15000  1.0 3.0
   41    39    45    49   0.15000  1.0 3.0
   41    39    45    53   0.15000  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    51   0.15000  1.0 3.0
   46    45    49    52   0.15000  1.0 3.0
   46    45    53    54   0.15000  1.0 3.0
   46    45    53    55   0.15000  1.0 3.0
   46    45    53    56   0.15000  1.0 3.0
   49    45    53    54   0.15000  1.0 3.0
   49    45    53    55   0.15000  1.0 3.0
   49    45    53    56   0.15000  1.0 3.0
   53    45    49    50   0.15000  1.0 3.0
   53    45    49    51   0.15000  1.0 3.0
   53    45    49    52   0.15000  1.0 3.0
   42    38    39    40   0.00000  1.0 1.0
   42    38    39    41   0.00000  1.0 1.0
   42    38    39    45  -0.05900 -1.0 2.0
   42    47    57    58   0.15000  1.0 3.0
   42    47    57    59   0.15000  1.0 3.0
   42    47    57    60   0.15000  1.0 3.0
   42    47    61    62   0.15000  1.0 3.0
   42    47    61    63   0.15000  1.0 3.0
   42    47    61    64   0.15000  1.0 3.0
   43    42    47    48   0.15000  1.0 3.0
   43    42    47    57   0.15000  1.0 3.0
   43    42    47    61   0.15000  1.0 3.0
   44    42    47    48   0.15000  1.0 3.0
   44    42    47    57   0.15000  1.0 3.0
   44    42    47    61   0.15000  1.0 3.0
   48    47    57    58   0.15000  1.0 3.0
   48    47    57    59   0.15000  1.0 3.0
   48    47    57    60   0.15000  1.0 3.0
   48    47    61    62   0.15000  1.0 3.0
   48    47    61    63   0.15000  1.0 3.0
   48    47    61    64   0.15000  1.0 3.0
   57    47    61    62   0.15000  1.0 3.0
   57    47    61    63   0.15000  1.0 3.0
   57    47    61    64   0.15000  1.0 3.0
   61    47    57    58   0.15000  1.0 3.0
   61    47    57    59   0.15000  1.0 3.0
   61    47    57    60   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
   36    30    35    37  10.50000 -1.0 2.0
   29    38    33    34  10.50000 -1.0 2.0
   42    33    38    39   1.00000 -1.0 2.0
END
