* LIGAND DATABASE FILE (OPLS2005)
*
001      72    73    129    203     383
    1     0 S   NP   _N1_     1    29.38046    99.70328   -22.05739
    2     1 S   H    _HN1     2     1.02945    49.09557     4.25855
    3     1 S   H    _H1_     3     1.02822    61.66002   159.82383
    4     1 S   H    _H2_     4     1.02801   104.68578   -97.49778
    5     1 S   CT   _CA1     5     1.50134   142.64071    72.29339
    6     5 S   HC   _HA1     6     1.09577   105.15542   129.39361
    7     5 S   CO3  _C1_     7     1.53770   112.36626     9.20654
    8     7 S   O2Z  _O11     8     1.26386   114.99135   -45.25871
    9     7 S   O2Z  _O12     9     1.26218   114.90960   133.52402
   10     5 S   CT   _CB1    10     1.53020   107.36534  -112.72016
   11    10 S   HC   HB11    11     1.09847   109.37692   -49.76318
   12    10 S   HC   HB12    12     1.09809   110.48722    66.84223
   13    10 S   CT   _CG1    13     1.52995   112.56879  -170.67190
   14    13 S   HC   HG11    14     1.09532   110.62089   -68.30067
   15    13 S   HC   HG12    15     1.09646   109.72230    50.93769
   16    13 S   C    _CD1    16     1.51772   111.65997   171.83668
   17    16 S   O    _OE1    17     1.22799   122.97229    20.27494
   18    16 S   N    _N2_    18     1.38567   112.15231  -160.13316
   19    18 S   H    _HN2    19     1.01712   119.01383     0.10279
   20    18 S   CT1  _CA2    20     1.46282   123.39723   177.93493
   21    20 S   HC   _HA2    21     1.09735   109.14651    11.09363
   22    20 S   C    _C2_    22     1.53659   109.47420  -104.76532
   23    22 S   O    _O2_    23     1.23116   122.04629  -150.88325
   24    20 S   CT   _CB2    32     1.53362   111.33282   132.81339
   25    24 S   HC   HB21    33     1.09317   109.30859    60.79711
   26    24 S   HC   HB22    34     1.09513   110.53597   178.83182
   27    22 S   N    _N3_    24     1.38261   114.08932    36.70176
   28    27 S   H    _HN3    25     1.01521   119.64294    -3.66768
   29    24 S   S    _SG2    35     1.82960   111.02432   -61.93307
   30    27 S   CT   _CA3    26     1.45276   123.28851   177.14528
   31    30 S   HC   HA31    27     1.09549   107.56972   -63.27954
   32    30 S   HC   HA32    28     1.09556   107.92054    53.15628
   33    29 S   CT   _C15    36     1.88606   101.39105   146.17409
   34    30 S   CO3  _C3_    29     1.52983   114.07389   175.12556
   35    34 S   O2Z  _O31    30     1.26386   116.11174     0.14804
   36    34 S   O2Z  _O32    31     1.26435   114.41002  -179.83449
   37    33 S   CM   _C11    37     1.54872   107.41603   -63.40227
   38    33 S   CT   _C18    60     1.56429   109.13560    65.30158
   39    38 S   HC   _H34    61     1.09530   109.35644   -55.98496
   40    38 S   HC   _H35    62     1.09529   107.72270  -172.61342
   41    37 S   CO4  _C10    38     1.51897   112.56504   -57.99920
   42    41 S   O    _O19    39     1.22687   122.65730   132.12511
   43    37 S   CMA  _C12    54     1.36679   133.28729   122.54826
   44    43 S   OM   _O17    55     1.26663   130.05036   175.64733
   45    38 S   CT   _C19    63     1.54929   119.25650    67.91107
   46    45 S   HC   _H36    64     1.09393   109.96433    57.63498
   47    41 S   CA   _C7_    40     1.48092   117.12372   -44.68589
   48    43 S   CT   _C16    56     1.51971   121.88823    -4.24713
   49    48 S   HC   _H29    57     1.09504   110.93014    73.32284
   50    48 S   HC   _H30    58     1.09269   111.45739   -50.36633
   51    48 S   HC   _H31    59     1.10060   113.44172  -167.65616
   52    45 S   CT   _C17    65     1.53198   110.13171   178.53420
   53    52 S   HC   _H32    66     1.09655   110.78877   -49.18291
   54    52 S   HC   _H33    67     1.09689   110.60784    70.19400
   55    45 S   OH   _O22    71     1.42261   111.29124   -61.35145
   56    55 S   HO   _H38    72     0.97218   107.95205   -58.97867
   57    47 S   CA   _C8_    41     1.40048   119.25172    14.20265
   58    52 S   CO3  _C13    68     1.53000   110.75929  -168.25266
   59    58 S   O2Z  _O18    69     1.26331   115.37400    63.64793
   60    58 S   O2Z  _O20    70     1.26345   114.93941  -117.64140
   61    57 S   CA   _C5_    42     1.40504   119.24182  -179.07064
   62    61 S   HA   _H25    43     1.08776   120.15370   179.16140
   63    33 S   CT   _C14    51     1.55579   107.80969  -177.92180
   64    63 S   HC   _H27    52     1.09794   109.94357   -51.90712
   65    63 S   HC   _H28    53     1.09956   108.92164  -168.76169
   66    61 S   CA   _C4_    44     1.39374   120.81191    -1.15318
   67    66 S   HA   _H24    45     1.08604   120.06577  -179.67374
   68    66 S   CA   _C6_    46     1.39090   119.85189     0.26095
   69    68 S   HA   _H26    47     1.08667   119.77104  -179.87646
   70    47 S   CA   _C9_    48     1.40395   121.18640  -166.36508
   71    70 S   OH   _O21    49     1.36867   123.47681     0.22555
   72    71 S   HO   _H37    50     0.97415   109.10331    -4.09089
  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
  19   2   1   1  18  16   6   5  11   4   7   4  10   6  12   3
   2   1   1   7   5   4   2   1  10   2   1   1   9   4   4   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    63    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    57    63    64    65    43    38    39    40    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    47    57    61    63    64    65    43    44    48    38    39    40    45    46    52    55  
   35    36  
   36  
    0  
   41    42    47    57    70    63    64    65    43    44    48    49    50    51    38    39    40    45  
   39    40    45    46    52    53    54    58    55    56    41    43    57    63    64    65  
   40    45    46    52    55    63  
   45    46    52    55    63  
   42    47    57    61    68    70    71    63    43    44    48  
   47    57    70    43  
   44    48    49    50    51    47    63  
   48    49    50    51  
   46    52    53    54    58    59    60    55    56    63  
   52    53    54    58    55    56  
   57    61    62    66    68    69    70    71    72    63    64    65  
   49    50    51  
   50    51  
   51  
    0  
   53    54    58    59    60    55    56  
   54    58    59    60    55  
   58    59    60    55  
   56    58  
    0  
   61    62    66    67    68    70    71    63    64    65  
   59    60  
   60  
    0  
   62    66    67    68    69    70    63    64    65  
   66    67    68    63  
   64    65    66    70  
   65  
    0  
   67    68    69    70    71  
   68    69    70  
   69    70    71    72  
   70    71  
   71    72  
   72  
    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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   57   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   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   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   70   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   71   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
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    63   268.000  1.529
   33    38   268.000  1.529
   37    41   320.000  1.462
   37    43   465.000  1.376
   41    42   570.000  1.229
   41    47   310.000  1.470
   47    57   469.000  1.400
   47    70   469.000  1.400
   57    61   469.000  1.400
   57    63   317.000  1.510
   61    62   367.000  1.080
   61    66   469.000  1.400
   66    67   367.000  1.080
   66    68   469.000  1.400
   68    69   367.000  1.080
   68    70   469.000  1.400
   70    71   450.000  1.364
   71    72   553.000  0.945
   63    64   340.000  1.090
   63    65   340.000  1.090
   43    44   745.000  1.250
   43    48   270.000  1.512
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    45   268.000  1.529
   45    46   340.000  1.090
   45    52   268.000  1.529
   45    55   320.000  1.410
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    58   317.000  1.522
   58    59   656.000  1.250
   58    60   656.000  1.250
   55    56   553.000  0.945
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    63    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    41    65.00000  116.34900
   33    37    43    70.00000  124.00000
   33    63    57    70.00000  112.17500
   33    63    64    37.50000  110.70000
   33    63    65    37.50000  110.70000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    45    58.35000  112.70000
   37    41    42    80.00000  123.72100
   37    41    47    65.00000  117.02400
   37    43    44    65.00000  137.10300
   37    43    48    65.00000  122.18000
   41    47    57    60.00000  119.52600
   41    47    70    60.00000  119.52600
   47    41    42    75.00000  123.78400
   47    57    61    63.00000  120.00000
   47    57    63    70.00000  120.00000
   47    70    68    63.00000  120.00000
   47    70    71    70.00000  120.00000
   57    61    62    35.00000  120.00000
   57    61    66    63.00000  120.00000
   57    63    64    35.00000  109.50000
   57    63    65    35.00000  109.50000
   61    66    67    35.00000  120.00000
   61    66    68    63.00000  120.00000
   66    61    62    35.00000  120.00000
   66    68    69    35.00000  120.00000
   66    68    70    63.00000  120.00000
   68    66    67    35.00000  120.00000
   68    70    71    70.00000  120.00000
   70    47    57    63.00000  120.00000
   70    68    69    35.00000  120.00000
   70    71    72    35.00000  113.00000
   63    33    37    70.00000  112.02700
   63    57    61    70.00000  120.00000
   65    63    64    33.00000  107.80000
   43    37    41    60.00000  125.92000
   43    48    49    45.00000  110.52000
   43    48    50    45.00000  110.52000
   43    48    51    45.00000  110.52000
   48    43    44    85.00000  112.85300
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    63    58.35000  112.70000
   38    45    46    37.50000  110.70000
   38    45    52    58.35000  112.70000
   38    45    55    50.00000  109.50000
   40    38    39    33.00000  107.80000
   45    38    39    37.50000  110.70000
   45    38    40    37.50000  110.70000
   45    52    53    37.50000  110.70000
   45    52    54    37.50000  110.70000
   45    52    58    70.00000  109.69300
   45    55    56    55.00000  108.50000
   52    45    46    37.50000  110.70000
   52    58    59    70.00000  117.00000
   52    58    60    70.00000  117.00000
   54    52    53    33.00000  107.80000
   58    52    53    35.00000  109.50000
   58    52    54    35.00000  109.50000
   60    58    59    80.00000  126.00000
   55    45    46    35.00000  109.50000
   55    45    52    50.00000  109.50000
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    63   0.01700  1.0 1.0
   24    29    33    63  -0.23550 -1.0 2.0
   24    29    33    63   0.21350  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    41   0.09700  1.0 1.0
   29    33    37    41   0.15600 -1.0 2.0
   29    33    37    41  -0.50800  1.0 3.0
   29    33    37    43   0.42700  1.0 1.0
   29    33    37    43  -0.70350 -1.0 2.0
   29    33    37    43  -0.43150  1.0 3.0
   29    33    63    57   0.56750  1.0 1.0
   29    33    63    57  -0.07550 -1.0 2.0
   29    33    63    57   0.20000  1.0 3.0
   29    33    63    64   0.15000  1.0 3.0
   29    33    63    65   0.15000  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    45   0.44750  1.0 1.0
   29    33    38    45  -0.17800 -1.0 2.0
   29    33    38    45   0.20200  1.0 3.0
   33    37    41    42  -0.64400  1.0 1.0
   33    37    41    42   0.26850 -1.0 2.0
   33    37    41    47   1.50000 -1.0 2.0
   33    37    43    44   7.00000 -1.0 2.0
   33    37    43    48   7.00000 -1.0 2.0
   33    38    45    46   0.15000  1.0 3.0
   33    38    45    52   0.56750  1.0 1.0
   33    38    45    52  -0.07550 -1.0 2.0
   33    38    45    52   0.20000  1.0 3.0
   33    38    45    55   0.86500  1.0 1.0
   33    38    45    55  -0.17500 -1.0 2.0
   33    38    45    55   0.20800  1.0 3.0
   37    33    63    57   0.21200  1.0 1.0
   37    33    63    57   0.16900 -1.0 2.0
   37    33    63    57  -1.15100  1.0 3.0
   37    33    63    64   0.15000  1.0 3.0
   37    33    63    65   0.15000  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    45   0.34400  1.0 1.0
   37    33    38    45   0.09450 -1.0 2.0
   37    33    38    45   0.11100  1.0 3.0
   37    41   -47    57  -0.11500  1.0 1.0
   37    41   -47    57   1.10450 -1.0 2.0
   37    41   -47    57  -0.48050  1.0 3.0
   37    41    47    70  -0.11500  1.0 1.0
   37    41    47    70   1.10450 -1.0 2.0
   37    41    47    70  -0.48050  1.0 3.0
   37    43    48    49   0.00000  1.0 1.0
   37    43    48    50   0.00000  1.0 1.0
   37    43    48    51   0.00000  1.0 1.0
   41    37    43    44   7.00000 -1.0 2.0
   41    37    43    48   7.00000 -1.0 2.0
   41    47    57    61   3.62500 -1.0 2.0
   41    47    57    63   3.62500 -1.0 2.0
   41    47    70    68   3.62500 -1.0 2.0
   41    47    70    71   3.62500 -1.0 2.0
   42    41    47    57   1.05000 -1.0 2.0
   42    41    47    70   1.05000 -1.0 2.0
   47    57    61    62   3.62500 -1.0 2.0
   47    57    61    66   3.62500 -1.0 2.0
   47    57   -63    33   0.04150 -1.0 2.0
   47    57    63    64   0.00000  1.0 1.0
   47    57    63    65   0.00000  1.0 1.0
   47    70    71    72   0.84100 -1.0 2.0
   57    47    70    68   3.62500 -1.0 2.0
   57    47    70    71   3.62500 -1.0 2.0
   57    61    66    67   3.62500 -1.0 2.0
   57    61   -66    68   3.62500 -1.0 2.0
   61    57    63    33   0.04150 -1.0 2.0
   61    57    63    64   0.00000  1.0 1.0
   61    57    63    65   0.00000  1.0 1.0
   61    66    68    69   3.62500 -1.0 2.0
   61    66    68    70   3.62500 -1.0 2.0
   62    61    66    67   3.62500 -1.0 2.0
   62    61    66    68   3.62500 -1.0 2.0
   66    68   -70    47   3.62500 -1.0 2.0
   66    68    70    71   3.62500 -1.0 2.0
   67    66    68    69   3.62500 -1.0 2.0
   67    66    68    70   3.62500 -1.0 2.0
   68    70    71    72   0.84100 -1.0 2.0
   69    68    70    47   3.62500 -1.0 2.0
   69    68    70    71   3.62500 -1.0 2.0
   70    47   -57    61   3.62500 -1.0 2.0
   70    47    57    63   3.62500 -1.0 2.0
   63    33   -37    41   0.09700  1.0 1.0
   63    33   -37    41   0.15600 -1.0 2.0
   63    33   -37    41  -0.50800  1.0 3.0
   63    33    37    43   0.09850  1.0 1.0
   63    33    37    43   0.15250 -1.0 2.0
   63    33    37    43  -0.50650  1.0 3.0
   63    33    38    39   0.15000  1.0 3.0
   63    33    38    40   0.15000  1.0 3.0
   63    33    38    45   0.56750  1.0 1.0
   63    33    38    45  -0.07550 -1.0 2.0
   63    33    38    45   0.20000  1.0 3.0
   63    57    61    62   3.62500 -1.0 2.0
   63    57    61    66   3.62500 -1.0 2.0
   43    37    41    42   1.00000 -1.0 2.0
   43    37    41    47  -1.65800  1.0 1.0
   43    37    41    47   0.77650 -1.0 2.0
   44    43    48    49   0.00000  1.0 1.0
   44    43    48    50   0.00000  1.0 1.0
   44    43    48    51   0.00000  1.0 1.0
   38    33    37    41   0.09700  1.0 1.0
   38    33    37    41   0.15600 -1.0 2.0
   38    33    37    41  -0.50800  1.0 3.0
   38    33    37    43   0.09850  1.0 1.0
   38    33    37    43   0.15250 -1.0 2.0
   38    33    37    43  -0.50650  1.0 3.0
   38    33    63    57  -0.03700  1.0 1.0
   38    33    63    57   0.37200 -1.0 2.0
   38    33    63    57  -0.47300  1.0 3.0
   38    33    63    64   0.15000  1.0 3.0
   38    33    63    65   0.15000  1.0 3.0
   38    45    52    53   0.15000  1.0 3.0
   38    45    52    54   0.15000  1.0 3.0
   38    45    52    58  -1.63150  1.0 1.0
   38    45    52    58  -0.43550 -1.0 2.0
   38    45    52    58   0.24500  1.0 3.0
   38    45    55    56  -0.11600  1.0 1.0
   38    45    55    56  -0.09450 -1.0 2.0
   38    45    55    56   0.21250  1.0 3.0
   39    38    45    46   0.15000  1.0 3.0
   39    38    45    52   0.15000  1.0 3.0
   39    38    45    55   0.23400  1.0 3.0
   40    38    45    46   0.15000  1.0 3.0
   40    38    45    52   0.15000  1.0 3.0
   40    38    45    55   0.23400  1.0 3.0
   45    52    58    59   0.41150 -1.0 2.0
   45    52    58    60   0.41150 -1.0 2.0
   46    45    52    53   0.15000  1.0 3.0
   46    45    52    54   0.15000  1.0 3.0
   46    45    52    58  -0.11250  1.0 3.0
   46    45    55    56   0.19450  1.0 3.0
   52    45    55    56  -0.11600  1.0 1.0
   52    45    55    56  -0.09450 -1.0 2.0
   52    45    55    56   0.21250  1.0 3.0
   53    52    58    59   0.00000  1.0 1.0
   53    52    58    60   0.00000  1.0 1.0
   54    52    58    59   0.00000  1.0 1.0
   54    52    58    60   0.00000  1.0 1.0
   55    45    52    53   0.23400  1.0 3.0
   55    45    52    54   0.23400  1.0 3.0
   55    45    52    58  -5.33000  1.0 1.0
   55    45    52    58  -0.54250 -1.0 2.0
   55    45    52    58  -0.07300  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    41    37    43   1.10000 -1.0 2.0
   37    47    41    42  10.50000 -1.0 2.0
   57    70    47    41   4.00000 -1.0 2.0
   61    63    57    47   4.00000 -1.0 2.0
   66    62    61    57   1.10000 -1.0 2.0
   68    67    66    61   1.10000 -1.0 2.0
   70    69    68    66   1.10000 -1.0 2.0
   68    71    70    47   4.00000 -1.0 2.0
   48    44    43    37   1.10000 -1.0 2.0
   59    52    58    60  10.50000 -1.0 2.0
END
