* LIGAND DATABASE FILE (OPLS2005)
*
001      66    67    119    182     347
    1     0 S   NP   _N1_     1    28.98860    95.58152   -25.58638
    2     1 S   H    _HN1     2     1.02946    76.43961     5.93181
    3     1 S   H    _H1_     3     1.02827    30.69933  -170.30770
    4     1 S   H    _H2_     4     1.02793   120.61785   -97.61610
    5     1 S   CT   _CA1     5     1.50125   121.21313   111.79814
    6     5 S   HC   _HA1     6     1.09574   105.15341    91.49671
    7     5 S   CO3  _C1_     7     1.53767   112.51676   -28.68961
    8     7 S   O2Z  _O11     8     1.26375   115.00401   -41.33241
    9     7 S   O2Z  _O12     9     1.26239   114.94349   137.71304
   10     5 S   CT   _CB1    10     1.53064   107.41080  -150.52770
   11    10 S   HC   HB11    11     1.09840   109.30603   -49.36626
   12    10 S   HC   HB12    12     1.09810   110.47470    67.22465
   13    10 S   CT   _CG1    13     1.53021   112.65586  -170.31237
   14    13 S   HC   HG11    14     1.09568   110.72817   -67.81616
   15    13 S   HC   HG12    15     1.09671   109.69261    51.43204
   16    13 S   C    _CD1    16     1.51812   112.01351   171.90231
   17    16 S   O    _OE1    17     1.22752   123.19119    12.43322
   18    16 S   N    _N2_    18     1.38660   111.82617  -167.54823
   19    18 S   H    _HN2    19     1.01572   118.95469     1.14603
   20    18 S   CT1  _CA2    20     1.46215   123.35790   176.21457
   21    20 S   HC   _HA2    21     1.09742   109.30411     7.41042
   22    20 S   C    _C2_    22     1.53688   108.76305  -108.05034
   23    22 S   O    _O2_    23     1.23078   122.24534  -148.35359
   24    20 S   CT   _CB2    32     1.53413   111.71854   129.44909
   25    24 S   HC   HB21    33     1.09500   109.78772    56.22147
   26    24 S   HC   HB22    34     1.09417   109.71952   175.12524
   27    22 S   N    _N3_    24     1.38306   113.85855    39.10927
   28    27 S   H    _HN3    25     1.01545   119.64052    -3.03719
   29    24 S   S    _SG2    35     1.82849   111.32798   -64.57217
   30    27 S   CT   _CA3    26     1.45288   123.29407   177.26434
   31    30 S   HC   HA31    27     1.09546   107.49713   -65.28953
   32    30 S   HC   HA32    28     1.09555   108.02058    51.18053
   33    29 S   CT   _C5_    36     1.86729   101.04106  -170.03936
   34    30 S   CO3  _C3_    29     1.52981   114.02180   173.19349
   35    34 S   O2Z  _O31    30     1.26387   116.06890    -0.44057
   36    34 S   O2Z  _O32    31     1.26422   114.42331   179.61948
   37    33 S   CM   _C6_    37     1.55269   107.21080   175.06835
   38    33 S   CT   _C4_    63     1.54373   107.81158   -61.10823
   39    38 S   HC   _H3_    64     1.09746   111.39029    75.75197
   40    38 S   HC   _H4_    65     1.09427   113.95849   -45.68136
   41    38 S   HC   _H5_    66     1.09751   110.45814  -168.20692
   42    37 S   SY   _S1_    38     1.77355   116.12136   -87.06792
   43    42 S   OY   _O34    39     1.45322   111.21015  -146.77440
   44    42 S   OY   _O35    40     1.45211   108.77176    79.30192
   45    37 S   CMA  _C7_    48     1.37335   126.18331    88.88371
   46    45 S   OM   _O33    49     1.26306   127.91375    -0.98258
   47    42 S   CT   _C14    41     1.76487   103.23524   -34.48049
   48    47 S   HC   _H12    42     1.09531   107.01737   -73.17661
   49    47 S   HC   _H13    43     1.09373   107.60225   169.78315
   50    45 S   NE   _N4_    50     1.40211   121.85685  -174.71239
   51    50 S   H    _H6_    51     1.01502   114.73223    21.05186
   52    47 S   CT   _C15    44     1.50059   110.37627    47.90166
   53    52 S   HC   _H14    45     1.09411   112.90806    58.04833
   54    52 S   HC   _H15    46     1.09482   109.27319   177.04773
   55    50 S   CA   _C8_    52     1.41875   132.69519  -148.31748
   56    33 S   OS   _O36    47     1.44430   112.55222    50.06072
   57    55 S   CA   _C9_    53     1.40682   118.04139  -162.57988
   58    57 S   HA   _H7_    54     1.08798   120.03549    -1.16045
   59    57 S   CA   _C10    55     1.39706   121.23858   178.54896
   60    59 S   HA   _H8_    56     1.08607   119.93594   179.94405
   61    59 S   CA   _C11    57     1.39136   119.97842    -0.24469
   62    61 S   HA   _H9_    58     1.08585   120.15747  -180.00000
   63    61 S   CA   _C12    59     1.39214   119.72078    -0.00000
   64    63 S   HA   _H10    60     1.08631   119.99241   179.84051
   65    55 S   CA   _C13    61     1.40250   124.09558    15.30044
   66    65 S   HA   _H11    62     1.08650   121.01143     3.09149
  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  10   5   4   3
  16   2   1   1  17   7   3   2   1  12   6   5   8   3   6   5
   4   8   3   3   2   1   9   1   8   4   6   3   5   3   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    56    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    52    56    45    38    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    43    44    47    52    53    54    56    45    46    50    38    39    40    41  
   35    36  
   36  
    0  
   42    43    44    47    48    49    52    56    45    46    50    51    55    38    39    40    41  
   39    40    41    42    45    52    56  
   40    41    56  
   41    56  
   56  
   43    44    47    48    49    52    53    54    56    45    46    50  
   44    47    48    49    52    45  
   47    48    49    52    45  
   46    50    51    55    57    65    47    56  
   50    51    55  
   48    49    52    53    54    56  
   49    52    53    54    56  
   52    53    54    56  
   51    55    57    58    59    63    65    66  
   55    57    65  
   53    54    56  
   54    56  
   56  
   57    58    59    60    61    63    64    65    66  
    0  
   58    59    60    61    62    63    65    66  
   59    60    61    65  
   60    61    62    63    64    65  
   61    62    63  
   62    63    64    65    66  
   63    64    65  
   64    65    66  
   65    66  
   66  
    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  -0.316400   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   0.417900   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   3.5500   0.0760  -0.662700   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.2500   0.992900   2.0025   1.7750   0.025682759  -1.666211680
   43   2.9600   0.1700  -0.530000   1.6780   1.4800   0.001000000  -0.126889456
   44   2.9600   0.1700  -0.530000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   46   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   47   3.5000   0.0660  -0.297800   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.178700   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.178700   1.4250   1.2500   0.008598240   0.268726247
   50   3.2500   0.1700  -1.076200   1.8650   1.6500   0.051222218  -2.220205820
   51   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0700   0.200000   2.5000   1.7750   0.001000000  -0.843144165
   56   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   57   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    56   320.000  1.410
   33    38   268.000  1.529
   37    42   215.000  1.802
   37    45   465.000  1.376
   42    43   735.000  1.471
   42    44   735.000  1.471
   42    47   205.000  1.840
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    56   320.000  1.410
   45    46   745.000  1.250
   45    50   415.000  1.382
   50    51   434.000  1.010
   50    55   481.000  1.340
   55    57   469.000  1.400
   55    65   469.000  1.400
   57    58   367.000  1.080
   57    59   469.000  1.400
   59    60   367.000  1.080
   59    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   367.000  1.080
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   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  112.20000
   29    33    56    85.00000  114.68000
   29    33    38    75.00000  111.63000
   33    37    42    65.00000  120.00000
   33    37    45    70.00000  124.00000
   33    56    52    60.00000  109.50000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   37    42    43   105.00000  106.90800
   37    42    44   105.00000  106.90800
   37    42    47    85.00000  102.49400
   37    45    46    65.00000  137.10300
   37    45    50    75.00000  114.40000
   42    47    48    45.00000  108.39800
   42    47    49    45.00000  108.39800
   42    47    52    75.00000  110.51500
   44    42    43   115.00000  120.17200
   47    42    43   100.00000  108.55000
   47    42    44   100.00000  108.55000
   47    52    53    37.50000  110.70000
   47    52    54    37.50000  110.70000
   47    52    56    50.00000  109.50000
   49    47    48    33.00000  107.80000
   52    47    48    37.50000  110.70000
   52    47    49    37.50000  110.70000
   54    52    53    33.00000  107.80000
   56    33    37    85.00000  110.90400
   56    52    53    35.00000  109.50000
   56    52    54    35.00000  109.50000
   45    37    42    65.00000  118.15600
   45    50    51    50.00000  121.48000
   45    50    55    75.00000  121.78000
   50    45    46   105.00000  113.92000
   50    55    57    70.00000  120.10000
   50    55    65    70.00000  120.10000
   55    50    51    35.00000  113.50000
   55    57    58    35.00000  120.00000
   55    57    59    63.00000  120.00000
   55    65    63    63.00000  120.00000
   55    65    66    35.00000  120.00000
   57    59    60    35.00000  120.00000
   57    59    61    63.00000  120.00000
   59    57    58    35.00000  120.00000
   59    61    62    35.00000  120.00000
   59    61    63    63.00000  120.00000
   61    59    60    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    35.00000  120.00000
   65    55    57    63.00000  120.00000
   65    63    64    35.00000  120.00000
   38    33    37    70.00000  112.02700
   38    33    56    50.00000  109.50000
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    56   0.13850  1.0 1.0
   24    29    33    56  -1.34450 -1.0 2.0
   24    29    33    56   0.57400  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   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    42   0.09700  1.0 1.0
   29    33    37    42   0.15600 -1.0 2.0
   29    33    37    42  -0.50800  1.0 3.0
   29    33    37    45   0.42700  1.0 1.0
   29    33    37    45  -0.70350 -1.0 2.0
   29    33    37    45  -0.43150  1.0 3.0
   29    33    56    52   0.14700  1.0 1.0
   29    33    56    52  -1.16150 -1.0 2.0
   29    33    56    52   0.48700  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.15000  1.0 3.0
   33    37    42    43   0.00000  1.0 1.0
   33    37    42    44   0.00000  1.0 1.0
   33    37    42    47   0.00000  1.0 1.0
   33    37    45    46   7.00000 -1.0 2.0
   33    37    45    50   7.00000 -1.0 2.0
   37    33    56    52  -0.77900  1.0 1.0
   37    33    56    52  -0.36900 -1.0 2.0
   37    33    56    52   0.40400  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    33    38    41   0.15000  1.0 3.0
   37    42    47    48   0.00000  1.0 1.0
   37    42    47    49   0.00000  1.0 1.0
   37    42   -47    52   0.00000  1.0 1.0
   37    45    50    51   1.00000 -1.0 2.0
   37    45    50    55  -0.54500  1.0 1.0
   37    45    50    55   1.14150 -1.0 2.0
   42    37    45    46   7.00000 -1.0 2.0
   42    37    45    50   7.00000 -1.0 2.0
   42    47    52    53   0.15000  1.0 3.0
   42    47    52    54   0.15000  1.0 3.0
   42    47    52    56   0.56750  1.0 1.0
   42    47    52    56  -0.07550 -1.0 2.0
   42    47    52    56   0.20000  1.0 3.0
   43    42    47    48   0.26000  1.0 3.0
   43    42    47    49   0.26000  1.0 3.0
   43    42    47    52  -0.82900  1.0 1.0
   43    42    47    52   0.81700 -1.0 2.0
   43    42    47    52  -0.10400  1.0 3.0
   44    42    47    48   0.26000  1.0 3.0
   44    42    47    49   0.26000  1.0 3.0
   44    42    47    52  -0.82900  1.0 1.0
   44    42    47    52   0.81700 -1.0 2.0
   44    42    47    52  -0.10400  1.0 3.0
   47    52   -56    33   0.06250  1.0 1.0
   47    52   -56    33  -0.01100 -1.0 2.0
   47    52   -56    33   0.28050  1.0 3.0
   48    47    52    53   0.15000  1.0 3.0
   48    47    52    54   0.15000  1.0 3.0
   48    47    52    56   0.23400  1.0 3.0
   49    47    52    53   0.15000  1.0 3.0
   49    47    52    54   0.15000  1.0 3.0
   49    47    52    56   0.23400  1.0 3.0
   53    52    56    33   0.37050  1.0 3.0
   54    52    56    33   0.37050  1.0 3.0
   56    33   -37    42   0.09700  1.0 1.0
   56    33   -37    42   0.15600 -1.0 2.0
   56    33   -37    42  -0.50800  1.0 3.0
   56    33    37    45   0.39000  1.0 1.0
   56    33    37    45  -0.05800 -1.0 2.0
   56    33    37    45  -0.55150  1.0 3.0
   56    33    38    39   0.23400  1.0 3.0
   56    33    38    40   0.23400  1.0 3.0
   56    33    38    41   0.23400  1.0 3.0
   45    37    42    43  -1.00000  1.0 3.0
   45    37    42    44  -1.00000  1.0 3.0
   45    37    42    47   0.00000  1.0 1.0
   45    50    55    57   0.70250  1.0 1.0
   45    50    55    57   1.56150 -1.0 2.0
   45    50    55    65   0.70250  1.0 1.0
   45    50    55    65   1.56150 -1.0 2.0
   46    45    50    51   1.00000 -1.0 2.0
   46    45    50    55   1.00000 -1.0 2.0
   50    55    57    58   3.62500 -1.0 2.0
   50    55    57    59   3.62500 -1.0 2.0
   50    55    65    63   3.62500 -1.0 2.0
   50    55    65    66   3.62500 -1.0 2.0
   51    50    55    57   1.00000 -1.0 2.0
   51    50    55    65   1.00000 -1.0 2.0
   55    57    59    60   3.62500 -1.0 2.0
   55    57    59    61   3.62500 -1.0 2.0
   57    55    65    63   3.62500 -1.0 2.0
   57    55    65    66   3.62500 -1.0 2.0
   57    59    61    62   3.62500 -1.0 2.0
   57    59   -61    63   3.62500 -1.0 2.0
   58    57    59    60   3.62500 -1.0 2.0
   58    57    59    61   3.62500 -1.0 2.0
   59    61    63    64   3.62500 -1.0 2.0
   59    61    63    65   3.62500 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    63   3.62500 -1.0 2.0
   61    63   -65    55   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
   64    63    65    55   3.62500 -1.0 2.0
   64    63    65    66   3.62500 -1.0 2.0
   65    55    57    58   3.62500 -1.0 2.0
   65    55   -57    59   3.62500 -1.0 2.0
   38    33    37    42   0.09700  1.0 1.0
   38    33    37    42   0.15600 -1.0 2.0
   38    33    37    42  -0.50800  1.0 3.0
   38    33    37    45   0.09850  1.0 1.0
   38    33    37    45   0.15250 -1.0 2.0
   38    33    37    45  -0.50650  1.0 3.0
   38    33    56    52   0.06250  1.0 1.0
   38    33    56    52  -0.01100 -1.0 2.0
   38    33    56    52   0.28050  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    42    37    45   1.10000 -1.0 2.0
   50    46    45    37   1.10000 -1.0 2.0
   51    45    50    55   1.00000 -1.0 2.0
   57    65    55    50   4.00000 -1.0 2.0
   59    58    57    55   1.10000 -1.0 2.0
   61    60    59    57   1.10000 -1.0 2.0
   63    62    61    59   1.10000 -1.0 2.0
   65    64    63    61   1.10000 -1.0 2.0
   63    66    65    55   1.10000 -1.0 2.0
END
