* LIGAND DATABASE FILE (OPLS2005)
*
001      67    68    121    186     353
    1     0 S   NP   _N1_     1    28.85516    95.36468   -20.57878
    2     1 S   H    _HN1     2     1.02773    85.28247   -93.13883
    3     1 S   H    _H1_     3     1.02960    86.53075    15.60502
    4     1 S   H    _H2_     4     1.02832    37.90434   139.38199
    5     1 S   CT   _CA1     5     1.50143   148.63136   140.39718
    6     5 S   HC   _HA1     6     1.09570   105.22965    58.56759
    7     5 S   CO3  _C1_     7     1.53849   112.28034   -61.66606
    8     7 S   O2Z  _O11     8     1.26375   114.97590   -43.65910
    9     7 S   O2Z  _O12     9     1.26232   114.95639   135.29389
   10     5 S   CT   _CB1    10     1.53086   107.39599   176.54861
   11    10 S   HC   HB11    11     1.09823   109.51182   -49.26658
   12    10 S   HC   HB12    12     1.09823   110.34280    67.35475
   13    10 S   CT   _CG1    13     1.52984   112.62150  -170.30489
   14    13 S   HC   HG11    14     1.09587   110.34602   -61.50080
   15    13 S   HC   HG12    15     1.09639   110.06322    57.69755
   16    13 S   C    _CD1    16     1.51832   112.27167   178.16677
   17    16 S   O    _OE1    17     1.22725   123.27343    -3.85747
   18    16 S   N    _N2_    18     1.38552   111.60737   176.09615
   19    18 S   H    _HN2    19     1.01622   118.94196     1.10252
   20    18 S   CT1  _CA2    20     1.46251   123.61007  -175.79467
   21    20 S   HC   _HA2    21     1.09723   109.38432    -2.87317
   22    20 S   C    _C2_    22     1.53372   108.85475  -118.89659
   23    22 S   O    _O2_    23     1.23040   122.14770  -146.60814
   24    20 S   CT   _CB2    32     1.53535   110.97089   118.76530
   25    24 S   HC   HB21    33     1.09417   109.31692    60.45400
   26    24 S   HC   HB22    34     1.09517   110.55217   178.48923
   27    22 S   N    _N3_    24     1.38484   113.54915    40.84115
   28    27 S   H    _HN3    25     1.01504   118.90633    -0.72551
   29    24 S   S    _SG2    35     1.83143   110.97044   -62.29891
   30    27 S   CT   _CA3    26     1.45441   123.47089   175.24898
   31    30 S   HC   HA31    27     1.09522   109.28176    23.94987
   32    30 S   HC   HA32    28     1.09499   107.12021   140.92522
   33    29 S   CT   _C8_    36     1.88603   101.87894   142.08488
   34    30 S   CO3  _C3_    29     1.52905   113.04167   -99.57412
   35    34 S   O2Z  _O31    30     1.26408   115.35809   -46.75560
   36    34 S   O2Z  _O32    31     1.26353   115.02823   134.19641
   37    33 S   CO4  _C17    37     1.54133   108.17248   -60.13776
   38    37 S   O    _O34    38     1.22882   124.14430   -20.69287
   39    33 S   CT   _C9_    51     1.56979   110.34634    58.83686
   40    39 S   OM   _O35    52     1.32333   110.71182    67.35037
   41    39 S   HC   _H3_    53     1.10137   107.49595   -63.91743
   42    33 S   CT   _C7_    54     1.57063   107.65875  -176.45812
   43    42 S   HC   _H8_    55     1.09428   109.74055  -171.18064
   44    42 S   HC   _H9_    56     1.09881   110.02835   -56.69224
   45    37 S   CA   _C16    39     1.48205   117.31348   162.79543
   46    42 S   CM   _C6_    57     1.51285   115.55406    64.10649
   47    46 S   HC   _H7_    58     1.08946   114.20631   -72.03380
   48    45 S   CA   _C15    40     1.40194   118.93692   164.99963
   49    48 S   HA   _H13    41     1.08733   121.12353     1.36042
   50    46 S   CM   _C5_    59     1.34713   128.29265   108.61839
   51    48 S   CA   _C14    42     1.39471   120.21491  -177.69607
   52    51 S   HA   _H12    43     1.08633   119.96778   179.68163
   53    50 S   CT   _C4_    60     1.50654   120.20446  -179.73905
   54    53 S   HC   _H4_    61     1.09500   110.19282   119.86836
   55    53 S   HC   _H5_    62     1.09490   110.24430  -120.33559
   56    53 S   HC   _H6_    63     1.09510   112.46120    -0.19281
   57    50 S   CT   _C18    64     1.50235   125.64674    -0.49258
   58    57 S   HC   _H14    65     1.09510   110.00622   120.06289
   59    57 S   HC   _H15    66     1.09522   110.01993  -120.75892
   60    57 S   HC   _H16    67     1.09118   113.81940    -0.41401
   61    51 S   CA   _C13    44     1.39222   119.99540     0.00000
   62    61 S   HA   _H11    45     1.08635   120.02026   179.89532
   63    61 S   CA   _C12    46     1.39512   120.02196    -0.31090
   64    63 S   HA   _H10    47     1.08723   118.64587  -179.39834
   65    45 S   CA   _C11    48     1.39602   121.22207   -13.20306
   66    65 S   CO4  _C10    49     1.48462   121.16008    -3.73235
   67    66 S   O    _O33    50     1.22963   118.28466   172.50925
  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  12   5   4   3
  16   2   1   1  15   5  11   5   4   9   4   3  10  10   3   8
   4   8   6   3   7   3   2   1   3   2   1   1   5   3   4   2
   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    39    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    45    66    39    40    41    42    43    44    46  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    45    48    65    66    67    39    40    41    42    43    44    46    47    50  
   35    36  
   36  
    0  
   38    45    48    49    51    63    65    66    39    40    41    42    43    44    46  
   45    48    65    39    42  
   40    41    42    43    44    46    45    63    65    66    67  
   41    42    65    66    67  
   42    65    66    67  
   43    44    46    47    50    53    57    45    66  
   44    46    47    50  
   46    47    50  
   48    49    51    52    61    63    64    65    66    67  
   47    50    53    54    55    56    57    58    59    60  
   50    53    57  
   49    51    52    61    62    63    65    66  
   51    52    61    65  
   53    54    55    56    57    58    59    60  
   52    61    62    63    64    65  
   61    62    63  
   54    55    56    57    58    59    60  
   55    56    57  
   56    57  
   57  
   58    59    60  
   59    60  
   60  
    0  
   62    63    64    65    66  
   63    64    65  
   64    65    66    67  
   65    66  
   66    67  
   67  
    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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   66   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   67   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   317.000  1.522
   33    39   268.000  1.529
   33    42   268.000  1.529
   37    38   570.000  1.229
   37    45   310.000  1.470
   45    48   469.000  1.400
   45    65   469.000  1.400
   48    49   367.000  1.080
   48    51   469.000  1.400
   51    52   367.000  1.080
   51    61   469.000  1.400
   61    62   367.000  1.080
   61    63   469.000  1.400
   63    64   367.000  1.080
   63    65   469.000  1.400
   65    66   310.000  1.470
   66    67   570.000  1.229
   66    39   317.000  1.522
   39    40   570.000  1.307
   39    41   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    46   317.000  1.510
   46    47   340.000  1.080
   46    50   549.000  1.340
   50    53   317.000  1.510
   50    57   317.000  1.510
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   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  110.18000
   29    33    39    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    45    65.00000  115.47100
   33    39    66    63.00000  111.10000
   33    39    40    50.00000  109.50000
   33    39    41    37.50000  110.70000
   33    42    43    37.50000  110.70000
   33    42    44    37.50000  110.70000
   33    42    46    70.00000  112.02700
   37    45    48    60.00000  119.52600
   37    45    65    60.00000  119.52600
   45    37    38    75.00000  123.78400
   45    48    49    35.00000  120.00000
   45    48    51    63.00000  120.00000
   45    65    63    63.00000  120.00000
   45    65    66    60.00000  119.52600
   48    51    52    35.00000  120.00000
   48    51    61    63.00000  120.00000
   51    48    49    35.00000  120.00000
   51    61    62    35.00000  120.00000
   51    61    63    63.00000  120.00000
   61    51    52    35.00000  120.00000
   61    63    64    35.00000  120.00000
   61    63    65    63.00000  120.00000
   63    61    62    35.00000  120.00000
   63    65    66    60.00000  119.52600
   65    45    48    63.00000  120.00000
   65    63    64    35.00000  120.00000
   65    66    67    75.00000  123.78400
   65    66    39    65.00000  115.47100
   66    39    40    90.00000  108.74100
   66    39    41    35.00000  109.50000
   39    33    37    63.00000  111.10000
   39    66    67    80.00000  120.40000
   41    39    40    45.00000  125.66300
   42    33    37    63.00000  111.10000
   42    33    39    58.35000  112.70000
   42    46    47    35.00000  117.00000
   42    46    50    70.00000  124.00000
   44    42    43    33.00000  107.80000
   46    42    43    35.00000  109.50000
   46    42    44    35.00000  109.50000
   46    50    53    70.00000  124.00000
   46    50    57    70.00000  124.00000
   50    46    47    35.00000  120.00000
   50    53    54    35.00000  109.50000
   50    53    55    35.00000  109.50000
   50    53    56    35.00000  109.50000
   50    57    58    35.00000  109.50000
   50    57    59    35.00000  109.50000
   50    57    60    35.00000  109.50000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   57    50    53    65.00000  117.92700
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    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    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
   24    29    33    42   0.01700  1.0 1.0
   24    29    33    42  -0.23550 -1.0 2.0
   24    29    33    42   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   0.30150 -1.0 2.0
   29    33    37    45   0.65300  1.0 1.0
   29    33    37    45  -0.03850 -1.0 2.0
   29    33    37    45   0.33900  1.0 3.0
   29    33    39    66   0.56750  1.0 1.0
   29    33    39    66  -0.07550 -1.0 2.0
   29    33    39    66   0.20000  1.0 3.0
   29    33    39    40   0.56750  1.0 1.0
   29    33    39    40  -0.07550 -1.0 2.0
   29    33    39    40   0.20000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    42    43   0.15000  1.0 3.0
   29    33    42    44   0.15000  1.0 3.0
   29    33    42    46   0.56750  1.0 1.0
   29    33    42    46  -0.07550 -1.0 2.0
   29    33    42    46   0.20000  1.0 3.0
   33    37    45    48   2.26350  1.0 1.0
   33    37    45    48   0.76750 -1.0 2.0
   33    37    45    48   0.22500  1.0 3.0
   33    37    45    65   2.26350  1.0 1.0
   33    37    45    65   0.76750 -1.0 2.0
   33    37    45    65   0.22500  1.0 3.0
   33    42    46    47   0.00000  1.0 1.0
   33    42    46    50   0.09850  1.0 1.0
   33    42    46    50   0.15250 -1.0 2.0
   33    42    46    50  -0.50650  1.0 3.0
   37    33    39    66   0.11950  1.0 1.0
   37    33    39    66   0.20300 -1.0 2.0
   37    33    39    66  -0.70800  1.0 3.0
   37    33    39    40  -0.09450  1.0 1.0
   37    33    39    40  -1.12950 -1.0 2.0
   37    33    39    40   0.54000  1.0 3.0
   37    33    39    41  -0.11250  1.0 3.0
   37    33    42    43  -0.11250  1.0 3.0
   37    33    42    44  -0.11250  1.0 3.0
   37    33    42    46  -0.98800  1.0 1.0
   37    33    42    46   0.48800 -1.0 2.0
   37    33    42    46   0.76800  1.0 3.0
   37    45    48    49   3.62500 -1.0 2.0
   37    45    48    51   3.62500 -1.0 2.0
   37    45    65    63   3.62500 -1.0 2.0
   37    45   -65    66   3.62500 -1.0 2.0
   38    37    45    48   1.05000 -1.0 2.0
   38    37    45    65   1.05000 -1.0 2.0
   45    48    51    52   3.62500 -1.0 2.0
   45    48    51    61   3.62500 -1.0 2.0
   45    65    66    67   1.05000 -1.0 2.0
   45    65    66    39   2.26350  1.0 1.0
   45    65    66    39   0.76750 -1.0 2.0
   45    65    66    39   0.22500  1.0 3.0
   48    45    65    63   3.62500 -1.0 2.0
   48    45    65    66   3.62500 -1.0 2.0
   48    51    61    62   3.62500 -1.0 2.0
   48    51   -61    63   3.62500 -1.0 2.0
   49    48    51    52   3.62500 -1.0 2.0
   49    48    51    61   3.62500 -1.0 2.0
   51    61    63    64   3.62500 -1.0 2.0
   51    61    63    65   3.62500 -1.0 2.0
   52    51    61    62   3.62500 -1.0 2.0
   52    51    61    63   3.62500 -1.0 2.0
   61    63   -65    45   3.62500 -1.0 2.0
   61    63    65    66   3.62500 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    65   3.62500 -1.0 2.0
   63    65    66    67   1.05000 -1.0 2.0
   63    65    66    39   2.26350  1.0 1.0
   63    65    66    39   0.76750 -1.0 2.0
   63    65    66    39   0.22500  1.0 3.0
   64    63    65    45   3.62500 -1.0 2.0
   64    63    65    66   3.62500 -1.0 2.0
   65    45    48    49   3.62500 -1.0 2.0
   65    45   -48    51   3.62500 -1.0 2.0
   65    66   -39    33   0.05850 -1.0 2.0
   65    66   -39    33   0.17250  1.0 3.0
   65    66    39    40   0.65300  1.0 1.0
   65    66    39    40  -0.03850 -1.0 2.0
   65    66    39    40   0.33900  1.0 3.0
   65    66    39    41   0.00000  1.0 1.0
   67    66    39    33   0.30150 -1.0 2.0
   67    66    39    40   0.30150 -1.0 2.0
   67    66    39    41   0.00000  1.0 1.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33   -37    45   0.05850 -1.0 2.0
   39    33   -37    45   0.17250  1.0 3.0
   39    33    42    43   0.15000  1.0 3.0
   39    33    42    44   0.15000  1.0 3.0
   39    33    42    46   0.34400  1.0 1.0
   39    33    42    46   0.09450 -1.0 2.0
   39    33    42    46   0.11100  1.0 3.0
   42    33    37    38   0.30150 -1.0 2.0
   42    33    37    45   0.05850 -1.0 2.0
   42    33    37    45   0.17250  1.0 3.0
   42    33    39    66  -0.95700  1.0 1.0
   42    33    39    66  -0.18200 -1.0 2.0
   42    33    39    66   0.29450  1.0 3.0
   42    33    39    40   0.62750  1.0 1.0
   42    33    39    40  -0.30950 -1.0 2.0
   42    33    39    40   0.27300  1.0 3.0
   42    33    39    41   0.15000  1.0 3.0
   42    46    50    53   7.00000 -1.0 2.0
   42    46    50    57   7.00000 -1.0 2.0
   43    42    46    47   0.33100  1.0 3.0
   43    42    46    50   0.00000  1.0 1.0
   44    42    46    47   0.33100  1.0 3.0
   44    42    46    50   0.00000  1.0 1.0
   46    50    53    54   0.00000  1.0 1.0
   46    50    53    55   0.00000  1.0 1.0
   46    50    53    56   0.00000  1.0 1.0
   46    50    57    58   0.00000  1.0 1.0
   46    50    57    59   0.00000  1.0 1.0
   46    50    57    60   0.00000  1.0 1.0
   47    46    50    53   7.00000 -1.0 2.0
   47    46    50    57   7.00000 -1.0 2.0
   53    50    57    58   0.34800  1.0 3.0
   53    50    57    59   0.34800  1.0 3.0
   53    50    57    60   0.34800  1.0 3.0
   57    50    53    54   0.34800  1.0 3.0
   57    50    53    55   0.34800  1.0 3.0
   57    50    53    56   0.34800  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
   33    45    37    38  10.50000 -1.0 2.0
   48    65    45    37   4.00000 -1.0 2.0
   51    49    48    45   1.10000 -1.0 2.0
   61    52    51    48   1.10000 -1.0 2.0
   63    62    61    51   1.10000 -1.0 2.0
   65    64    63    61   1.10000 -1.0 2.0
   63    66    65    45   4.00000 -1.0 2.0
   65    39    66    67  10.50000 -1.0 2.0
   42    47    46    50  15.00000 -1.0 2.0
   53    57    50    46  15.00000 -1.0 2.0
END
