* LIGAND DATABASE FILE (OPLS2005)
*
001     103   106    196    317     591
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02032   106.44263    -8.37384
    3     1 S   H    _H1_     3     1.02099    52.52684    92.90114
    4     1 S   H    _H2_     4     1.02135    59.66847  -110.72310
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08519   110.61667    58.77943
   26    24 S   HC   HB22    34     1.08547   109.95733   179.17291
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C21    36     1.83998    97.07400  -158.12541
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CO4  _C12    37     1.52006   103.89798   -60.02243
   38    37 S   O    _O33    38     1.22293   126.27801    70.58052
   39    33 S   CT   _C15    60     1.55373   112.95548    57.50918
   40    39 S   HC   _H45    61     1.10691   107.75251   -77.54405
   41    39 S   HC   _H46    62     1.10804   108.46047   172.87861
   42    37 S   OS   _O36    39     1.35891   110.34598  -107.01201
   43    42 S   CO4  _C11    40     1.35723   111.82537    -6.90257
   44    43 S   O    _O30    41     1.22063   123.66952  -179.52112
   45    33 S   CT   _C17    42     1.54329   116.61593  -170.93029
   46    45 S   HC   _H48    43     1.12149   107.63237  -154.25447
   47    45 S   CT   _C19    44     1.55398   117.29815   -33.73358
   48    47 S   HC   _H50    45     1.10410   108.87547   -12.03346
   49    47 S   CT   _C16    46     1.55320   111.37208  -128.62035
   50    49 S   HC   _H47    47     1.07170   109.06759  -178.27864
   51    47 S   CT   _C29    81     1.53831   114.84282   104.70801
   52    51 S   HC   _H66    82     1.08907   108.55959    67.07509
   53    49 S   CM   _C7_    48     1.51452   117.15866    57.07646
   54    49 S   OH   _O37    79     1.43325   107.87608   -67.97199
   55    54 S   HO   _H67    80     0.96738   106.06863  -170.94638
   56    51 S   CT   _C27    83     1.52444   110.47250  -171.21365
   57    56 S   HC   _H63    84     1.09773   109.86381    40.03051
   58    56 S   HC   _H64    85     1.09644   109.96985   -78.15496
   59    51 S   OH   _O39   102     1.41794   108.01928   -50.84920
   60    59 S   HO   _H69   103     0.97227   106.90385   -60.02743
   61    53 S   CM   _C6_    49     1.34061   132.79965    25.83785
   62    56 S   CT   _C26    86     1.53358   111.36751   160.35839
   63    62 S   HC   _H61    87     1.09564   109.40468   -59.64312
   64    62 S   HC   _H62    88     1.09586   109.49530    57.72549
   65    61 S   CO4  _C9_    50     1.47039   107.64138   176.72368
   66    65 S   O    _O28    51     1.21743   126.93318  -176.16845
   67    61 S   CT   _C14    55     1.49822   131.70127     5.89827
   68    67 S   HC   _H43    56     1.09468   106.68148    15.28980
   69    67 S   HC   _H44    57     1.09482   108.33643   129.15818
   70    62 S   CT   _C25    89     1.53059   111.14288   178.91321
   71    70 S   HC   _H59    90     1.09623   109.77503    58.27216
   72    70 S   HC   _H60    91     1.09730   109.00146   -58.32401
   73    65 S   OS   _O34    52     1.34998   107.53848     2.58467
   74    67 S   CT   _C18    58     1.54616   119.43483  -107.92755
   75    74 S   HC   _H49    59     1.14209   107.29935   175.83788
   76    70 S   CT   _C24    92     1.53141   113.38809  -178.74181
   77    76 S   HC   _H57    93     1.09613   109.62003    59.97660
   78    76 S   HC   _H58    94     1.09721   108.08538   175.88367
   79    53 S   CO4  _C10    53     1.47575   120.30637  -155.92927
   80    79 S   O    _O29    54     1.21766   127.02199     0.77632
   81    74 S   CT   _C28    63     1.53761   111.14612   -73.87735
   82    81 S   HC   _H65    64     1.08758   108.52780    79.93545
   83    76 S   CT   _C23    95     1.52962   113.43068   -63.10949
   84    83 S   HC   _H55    96     1.09554   109.86688   -55.92811
   85    83 S   HC   _H56    97     1.09490   110.37331    62.28100
   86    81 S   CT   _C20    65     1.52192   111.13163  -158.38781
   87    86 S   HC   _H51    66     1.09697   108.46358   -38.22579
   88    81 S   OH   _O38    77     1.41790   108.40848   -37.40639
   89    88 S   HO   _H68    78     0.97211   107.02910   -59.96957
   90    83 S   CT   _C22    98     1.52159   111.34584  -177.01364
   91    90 S   HC   _H52    99     1.09440   111.02261   -58.50212
   92    90 S   HC   _H53   100     1.09514   110.24605    61.25135
   93    90 S   HC   _H54   101     1.09444   110.96367  -179.01127
   94    86 S   CT   _C13    67     1.52294   111.44769  -160.46638
   95    94 S   HC   _H41    68     1.09571   109.84638    68.92618
   96    94 S   HC   _H42    69     1.09621   111.61439   -50.66479
   97    94 S   CM   _C5_    70     1.49094   108.88124  -170.46820
   98    97 S   HC   _H40    71     1.08539   118.51131  -153.64300
   99    97 S   CM   _C4_    72     1.33695   121.74144    26.60923
  100    99 S   HC   _H39    73     1.08374   121.13781   179.23128
  101    99 S   CO4  _C8_    74     1.47388   120.56820     3.87606
  102   101 S   O    _O27    75     1.22569   120.81761   167.89131
  103    86 S   OS   _O35    76     1.44461   107.93939    78.03977
  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
  18   2   1   1  11   4  17   6   5   5   7   3  12   4  16   8
  14   6  12   6  12   3   1  11   6   5   2   1  11   9   5   4
   8   3  10   4   3   9   5   4   2   9   4   9   5   4   1   1
  11   6   6   5   4  12   7   3   1   3   2   1   1   8   5   4
   6   3   4   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    45    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    43    45    46    47    74    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    44    45    46    47    48    49    67    74    75    39    40    41    81    51  
   35    36  
   36  
    0  
   38    42    43    44    45    46    47    74    39    40    41  
   42    43    45    39  
   40    41    81    82    86    88    42    43    45    46    47    61    67    68    69    74    75  
   41    81    45    67    74    75  
   81    45    67    74    75  
   43    44    45    46    47  
   44    45    46    47    48    49    51  
   45    46    47  
   46    47    48    49    50    53    74    54    51    52    56    59  
   47    48    49    51  
   48    49    50    53    61    79    54    55    51    52    56    57    58    62    59    60  
   49    50    53    54    51    52    56    59  
   50    53    61    65    73    79    80    67    54    55    51    52    56    59  
   53    61    79    54    55    51  
   52    56    57    58    62    63    64    70    59    60    53    54  
   56    57    58    62    59    60  
   61    65    66    73    79    80    67    68    69    74    54    55  
   55    61    79  
    0  
   57    58    62    63    64    70    71    72    76    59    60  
   58    62    63    64    70    59  
   62    63    64    70    59  
   60    62  
    0  
   65    66    73    79    80    67    68    69    74    75    81  
   63    64    70    71    72    76    77    78    83  
   64    70    71    72    76  
   70    71    72    76  
   66    73    79    80    67    68    69    74  
   73    79    67  
   68    69    74    75    81    82    86    88    73    79  
   69    74    75    81  
   74    75    81  
   71    72    76    77    78    83    84    85    90  
   72    76    77    78    83  
   76    77    78    83  
   79    80  
   75    81    82    86    87    94   103    88    89  
   81    82    86    88  
   77    78    83    84    85    90    91    92    93  
   78    83    84    85    90  
   83    84    85    90  
   80  
    0  
   82    86    87    94    95    96    97   101   103    88    89  
   86    87    94   103    88    89  
   84    85    90    91    92    93  
   85    90    91    92    93  
   90    91    92    93  
   87    94    95    96    97    98    99   101   102   103    88    89  
   94    95    96    97   101   103    88  
   89    94   103  
    0  
   91    92    93  
   92    93  
   93  
    0  
   95    96    97    98    99   100   101   103  
   96    97    98    99   103  
   97    98    99   103  
   98    99   100   101   102   103  
   99   100   101  
  100   101   102   103  
  101   102   103  
  102   103  
  103  
    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   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.0000   0.1700  -0.160000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   67   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.0000   0.1700  -0.160000   1.5900   1.4000   0.020110767  -0.896042159
   74   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   80   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   81   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   88   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   89   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   90   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   98   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  100   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  101   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  103   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
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    45   268.000  1.529
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    42   214.000  1.327
   42    43   214.000  1.327
   43    44   570.000  1.229
   43    45   317.000  1.522
   45    46   340.000  1.090
   45    47   268.000  1.529
   47    48   340.000  1.090
   47    49   268.000  1.529
   47    51   268.000  1.529
   49    50   340.000  1.090
   49    53   317.000  1.510
   49    54   320.000  1.410
   53    61   549.000  1.340
   53    79   320.000  1.462
   61    65   320.000  1.462
   61    67   317.000  1.510
   65    66   570.000  1.229
   65    73   214.000  1.327
   73    79   214.000  1.327
   79    80   570.000  1.229
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    74   268.000  1.529
   74    75   340.000  1.090
   74    39   268.000  1.529
   74    81   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   81    82   340.000  1.090
   81    86   268.000  1.529
   81    88   320.000  1.410
   86    87   340.000  1.090
   86    94   268.000  1.529
   86   103   320.000  1.410
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   317.000  1.510
   97    98   340.000  1.080
   97    99   549.000  1.340
   99   100   340.000  1.080
   99   101   320.000  1.462
  101   102   570.000  1.229
  101   103   214.000  1.327
   88    89   553.000  0.945
   54    55   553.000  0.945
   51    52   340.000  1.090
   51    56   268.000  1.529
   51    59   320.000  1.410
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    70   268.000  1.529
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    76   268.000  1.529
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    83   268.000  1.529
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    90   268.000  1.529
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   340.000  1.090
   59    60   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  110.18000
   29    33    45    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    42    81.00000  111.40000
   33    45    43    63.00000  111.10000
   33    45    46    37.50000  110.70000
   33    45    47    58.35000  112.70000
   33    39    74    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   37    42    43   105.00000  110.06700
   42    37    38    83.00000  123.40000
   42    43    44    83.00000  123.40000
   42    43    45    81.00000  111.40000
   43    45    46    35.00000  109.50000
   43    45    47    63.00000  111.10000
   45    33    37    63.00000  111.10000
   45    43    44    80.00000  120.40000
   45    47    48    37.50000  110.70000
   45    47    49    58.35000  112.70000
   45    47    51    58.35000  112.70000
   47    45    46    37.50000  110.70000
   47    49    50    37.50000  110.70000
   47    49    53    70.00000  112.02700
   47    49    54    50.00000  109.50000
   47    51    52    37.50000  110.70000
   47    51    56    58.35000  112.70000
   47    51    59    50.00000  109.50000
   49    47    48    37.50000  110.70000
   49    53    61    70.00000  124.00000
   49    53    79    65.00000  116.34900
   49    54    55    55.00000  108.50000
   53    49    50    35.00000  109.50000
   53    61    65    65.00000  118.96000
   53    61    67    70.00000  124.00000
   53    79    73    90.00000  111.29400
   53    79    80    80.00000  123.72100
   61    65    66    80.00000  123.72100
   61    65    73    90.00000  111.29400
   61    67    68    35.00000  109.50000
   61    67    69    35.00000  109.50000
   61    67    74    70.00000  112.02700
   65    73    79   105.00000  110.06700
   73    65    66    83.00000  123.40000
   73    79    80    83.00000  123.40000
   79    53    61    65.00000  118.96000
   67    61    65    65.00000  116.34900
   67    74    75    37.50000  110.70000
   67    74    39    58.35000  112.70000
   67    74    81    58.35000  112.70000
   69    67    68    33.00000  107.80000
   74    67    68    37.50000  110.70000
   74    67    69    37.50000  110.70000
   74    39    40    37.50000  110.70000
   74    39    41    37.50000  110.70000
   74    81    82    37.50000  110.70000
   74    81    86    58.35000  112.70000
   74    81    88    50.00000  109.50000
   39    33    37    63.00000  111.10000
   39    33    45    58.35000  112.70000
   39    74    75    37.50000  110.70000
   41    39    40    33.00000  107.80000
   81    74    75    37.50000  110.70000
   81    74    39    58.35000  112.70000
   81    86    87    37.50000  110.70000
   81    86    94    58.35000  112.70000
   81    86   103    50.00000  109.50000
   81    88    89    55.00000  108.50000
   86    81    82    37.50000  110.70000
   86    94    95    37.50000  110.70000
   86    94    96    37.50000  110.70000
   86    94    97    70.00000  112.02700
   86   103   101    83.00000  116.90000
   94    86    87    37.50000  110.70000
   94    97    98    35.00000  117.00000
   94    97    99    70.00000  124.00000
   96    94    95    33.00000  107.80000
   97    94    95    35.00000  109.50000
   97    94    96    35.00000  109.50000
   97    99   100    35.00000  120.00000
   97    99   101    65.00000  118.96000
   99    97    98    35.00000  120.00000
   99   101   102    80.00000  123.72100
   99   101   103    90.00000  111.29400
  101    99   100    40.00000  117.72500
  103    86    87    35.00000  109.50000
  103    86    94    50.00000  109.50000
  103   101   102    83.00000  123.40000
   88    81    82    35.00000  109.50000
   88    81    86    50.00000  109.50000
   54    49    50    35.00000  109.50000
   54    49    53    90.00000  110.39200
   51    47    48    37.50000  110.70000
   51    47    49    58.35000  112.70000
   51    56    57    37.50000  110.70000
   51    56    58    37.50000  110.70000
   51    56    62    58.35000  112.70000
   51    59    60    55.00000  108.50000
   56    51    52    37.50000  110.70000
   56    62    63    37.50000  110.70000
   56    62    64    37.50000  110.70000
   56    62    70    58.35000  112.70000
   58    56    57    33.00000  107.80000
   62    56    57    37.50000  110.70000
   62    56    58    37.50000  110.70000
   62    70    71    37.50000  110.70000
   62    70    72    37.50000  110.70000
   62    70    76    58.35000  112.70000
   64    62    63    33.00000  107.80000
   70    62    63    37.50000  110.70000
   70    62    64    37.50000  110.70000
   70    76    77    37.50000  110.70000
   70    76    78    37.50000  110.70000
   70    76    83    58.35000  112.70000
   72    70    71    33.00000  107.80000
   76    70    71    37.50000  110.70000
   76    70    72    37.50000  110.70000
   76    83    84    37.50000  110.70000
   76    83    85    37.50000  110.70000
   76    83    90    58.35000  112.70000
   78    76    77    33.00000  107.80000
   83    76    77    37.50000  110.70000
   83    76    78    37.50000  110.70000
   83    90    91    37.50000  110.70000
   83    90    92    37.50000  110.70000
   83    90    93    37.50000  110.70000
   85    83    84    33.00000  107.80000
   90    83    84    37.50000  110.70000
   90    83    85    37.50000  110.70000
   92    90    91    33.00000  107.80000
   93    90    91    33.00000  107.80000
   93    90    92    33.00000  107.80000
   59    51    52    35.00000  109.50000
   59    51    56    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   0.01700  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    45   0.01700  1.0 1.0
   24    29    33    45  -0.23550 -1.0 2.0
   24    29    33    45   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
   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    42   0.40000  1.0 3.0
   29    33    45    43   0.56750  1.0 1.0
   29    33    45    43  -0.07550 -1.0 2.0
   29    33    45    43   0.20000  1.0 3.0
   29    33    45    46   0.15000  1.0 3.0
   29    33    45    47   0.44750  1.0 1.0
   29    33    45    47  -0.17800 -1.0 2.0
   29    33    45    47   0.20200  1.0 3.0
   29    33    39    74   0.44750  1.0 1.0
   29    33    39    74  -0.17800 -1.0 2.0
   29    33    39    74   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   33    37   -42    43   2.00000 -1.0 2.0
   33    45    47    48   0.15000  1.0 3.0
   33    45    47    49   0.56750  1.0 1.0
   33    45    47    49  -0.07550 -1.0 2.0
   33    45    47    49   0.20000  1.0 3.0
   33    45    47    51   0.56750  1.0 1.0
   33    45    47    51  -0.07550 -1.0 2.0
   33    45    47    51   0.20000  1.0 3.0
   37    33   -45    43   0.11950  1.0 1.0
   37    33   -45    43   0.20300 -1.0 2.0
   37    33   -45    43  -0.70800  1.0 3.0
   37    33    45    46  -0.11250  1.0 3.0
   37    33    45    47  -0.95700  1.0 1.0
   37    33    45    47  -0.18200 -1.0 2.0
   37    33    45    47   0.29450  1.0 3.0
   37    33    39    74  -0.95700  1.0 1.0
   37    33    39    74  -0.18200 -1.0 2.0
   37    33    39    74   0.29450  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    41  -0.11250  1.0 3.0
   37    42    43    44   3.00000 -1.0 2.0
   37    42   -43    45   2.00000 -1.0 2.0
   38    37    42    43   3.00000 -1.0 2.0
   42    43   -45    33   0.36750  1.0 3.0
   42    43    45    46   0.00000  1.0 1.0
   42    43    45    47   0.36750  1.0 3.0
   43    45    47    48  -0.11250  1.0 3.0
   43    45    47    49  -0.95700  1.0 1.0
   43    45    47    49  -0.18200 -1.0 2.0
   43    45    47    49   0.29450  1.0 3.0
   43    45    47    51  -0.95700  1.0 1.0
   43    45    47    51  -0.18200 -1.0 2.0
   43    45    47    51   0.29450  1.0 3.0
   44    43    45    33   0.30150 -1.0 2.0
   44    43    45    46   0.00000  1.0 1.0
   44    43    45    47   0.30150 -1.0 2.0
   45    33    37    38   0.30150 -1.0 2.0
   45    33   -37    42   0.36750  1.0 3.0
   45    33    39    74   0.56750  1.0 1.0
   45    33    39    74  -0.07550 -1.0 2.0
   45    33    39    74   0.20000  1.0 3.0
   45    33    39    40   0.15000  1.0 3.0
   45    33    39    41   0.15000  1.0 3.0
   45    47    49    50   0.15000  1.0 3.0
   45    47    49    53   0.34400  1.0 1.0
   45    47    49    53   0.09450 -1.0 2.0
   45    47    49    53   0.11100  1.0 3.0
   45    47    49    54   0.86500  1.0 1.0
   45    47    49    54  -0.17500 -1.0 2.0
   45    47    49    54   0.20800  1.0 3.0
   45    47    51    52   0.15000  1.0 3.0
   45    47    51    56   0.56750  1.0 1.0
   45    47    51    56  -0.07550 -1.0 2.0
   45    47    51    56   0.20000  1.0 3.0
   45    47    51    59   0.86500  1.0 1.0
   45    47    51    59  -0.17500 -1.0 2.0
   45    47    51    59   0.20800  1.0 3.0
   46    45    47    48   0.15000  1.0 3.0
   46    45    47    49   0.15000  1.0 3.0
   46    45    47    51   0.15000  1.0 3.0
   47    49    53    61   0.09850  1.0 1.0
   47    49    53    61   0.15250 -1.0 2.0
   47    49    53    61  -0.50650  1.0 3.0
   47    49    53    79   0.09700  1.0 1.0
   47    49    53    79   0.15600 -1.0 2.0
   47    49    53    79  -0.50800  1.0 3.0
   47    49    54    55  -0.11600  1.0 1.0
   47    49    54    55  -0.09450 -1.0 2.0
   47    49    54    55   0.21250  1.0 3.0
   47    51    56    57   0.15000  1.0 3.0
   47    51    56    58   0.15000  1.0 3.0
   47    51    56    62   0.56750  1.0 1.0
   47    51    56    62  -0.07550 -1.0 2.0
   47    51    56    62   0.20000  1.0 3.0
   47    51    59    60  -0.11600  1.0 1.0
   47    51    59    60  -0.09450 -1.0 2.0
   47    51    59    60   0.21250  1.0 3.0
   48    47    49    50   0.15000  1.0 3.0
   48    47    49    53   0.15000  1.0 3.0
   48    47    49    54   0.23400  1.0 3.0
   48    47    51    52   0.15000  1.0 3.0
   48    47    51    56   0.15000  1.0 3.0
   48    47    51    59   0.23400  1.0 3.0
   49    47    51    52   0.15000  1.0 3.0
   49    47    51    56   0.56750  1.0 1.0
   49    47    51    56  -0.07550 -1.0 2.0
   49    47    51    56   0.20000  1.0 3.0
   49    47    51    59   0.86500  1.0 1.0
   49    47    51    59  -0.17500 -1.0 2.0
   49    47    51    59   0.20800  1.0 3.0
   49    53    61    65   7.00000 -1.0 2.0
   49    53    61    67   7.00000 -1.0 2.0
   49    53    79    73  -0.15000  1.0 1.0
   49    53    79    73   0.89550 -1.0 2.0
   49    53    79    73  -0.06900  1.0 3.0
   49    53    79    80  -0.64400  1.0 1.0
   49    53    79    80   0.26850 -1.0 2.0
   50    49    53    61   0.00000  1.0 1.0
   50    49    53    79   0.15000  1.0 3.0
   50    49    54    55   0.19450  1.0 3.0
   53    49    54    55  -0.07800  1.0 1.0
   53    49    54    55  -0.21500 -1.0 2.0
   53    49    54    55  -0.03150  1.0 3.0
   53    61    65    66   1.00000 -1.0 2.0
   53    61   -65    73  -0.56150  1.0 1.0
   53    61   -65    73   2.19150 -1.0 2.0
   53    61    67    68   0.00000  1.0 1.0
   53    61    67    69   0.00000  1.0 1.0
   53    61    67    74   0.09850  1.0 1.0
   53    61    67    74   0.15250 -1.0 2.0
   53    61    67    74  -0.50650  1.0 3.0
   61    53   -79    73  -0.56150  1.0 1.0
   61    53   -79    73   2.19150 -1.0 2.0
   61    53    79    80   1.00000 -1.0 2.0
   61    65   -73    79   2.00000 -1.0 2.0
   61    67    74    75   0.15000  1.0 3.0
   61    67    74    39   0.34400  1.0 1.0
   61    67    74    39   0.09450 -1.0 2.0
   61    67    74    39   0.11100  1.0 3.0
   61    67    74    81   0.34400  1.0 1.0
   61    67    74    81   0.09450 -1.0 2.0
   61    67    74    81   0.11100  1.0 3.0
   65    61    67    68   0.15000  1.0 3.0
   65    61    67    69   0.15000  1.0 3.0
   65    61    67    74   0.09700  1.0 1.0
   65    61    67    74   0.15600 -1.0 2.0
   65    61    67    74  -0.50800  1.0 3.0
   65    73   -79    53   2.00000 -1.0 2.0
   65    73    79    80   3.00000 -1.0 2.0
   66    65    73    79   3.00000 -1.0 2.0
   79    53   -61    65   7.00000 -1.0 2.0
   79    53    61    67   7.00000 -1.0 2.0
   67    61    65    66  -0.64400  1.0 1.0
   67    61    65    66   0.26850 -1.0 2.0
   67    61    65    73  -0.15000  1.0 1.0
   67    61    65    73   0.89550 -1.0 2.0
   67    61    65    73  -0.06900  1.0 3.0
   67    74    39    33   0.56750  1.0 1.0
   67    74    39    33  -0.07550 -1.0 2.0
   67    74    39    33   0.20000  1.0 3.0
   67    74    39    40   0.15000  1.0 3.0
   67    74    39    41   0.15000  1.0 3.0
   67    74    81    82   0.15000  1.0 3.0
   67    74    81    86   0.56750  1.0 1.0
   67    74    81    86  -0.07550 -1.0 2.0
   67    74    81    86   0.20000  1.0 3.0
   67    74    81    88   0.86500  1.0 1.0
   67    74    81    88  -0.17500 -1.0 2.0
   67    74    81    88   0.20800  1.0 3.0
   68    67    74    75   0.15000  1.0 3.0
   68    67    74    39   0.15000  1.0 3.0
   68    67    74    81   0.15000  1.0 3.0
   69    67    74    75   0.15000  1.0 3.0
   69    67    74    39   0.15000  1.0 3.0
   69    67    74    81   0.15000  1.0 3.0
   74    81    86    87   0.15000  1.0 3.0
   74    81    86    94   0.56750  1.0 1.0
   74    81    86    94  -0.07550 -1.0 2.0
   74    81    86    94   0.20000  1.0 3.0
   74    81    86   103   0.62750  1.0 1.0
   74    81    86   103  -0.30950 -1.0 2.0
   74    81    86   103   0.27300  1.0 3.0
   74    81    88    89  -0.11600  1.0 1.0
   74    81    88    89  -0.09450 -1.0 2.0
   74    81    88    89   0.21250  1.0 3.0
   75    74    39    33   0.15000  1.0 3.0
   75    74    39    40   0.15000  1.0 3.0
   75    74    39    41   0.15000  1.0 3.0
   75    74    81    82   0.15000  1.0 3.0
   75    74    81    86   0.15000  1.0 3.0
   75    74    81    88   0.23400  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    42   0.36750  1.0 3.0
   39    33    45    43  -0.95700  1.0 1.0
   39    33    45    43  -0.18200 -1.0 2.0
   39    33    45    43   0.29450  1.0 3.0
   39    33    45    46   0.15000  1.0 3.0
   39    33    45    47   0.56750  1.0 1.0
   39    33    45    47  -0.07550 -1.0 2.0
   39    33    45    47   0.20000  1.0 3.0
   39    74    81    82   0.15000  1.0 3.0
   39    74    81    86   0.56750  1.0 1.0
   39    74    81    86  -0.07550 -1.0 2.0
   39    74    81    86   0.20000  1.0 3.0
   39    74    81    88   0.86500  1.0 1.0
   39    74    81    88  -0.17500 -1.0 2.0
   39    74    81    88   0.20800  1.0 3.0
   81    74    39    33   0.56750  1.0 1.0
   81    74    39    33  -0.07550 -1.0 2.0
   81    74    39    33   0.20000  1.0 3.0
   81    74    39    40   0.15000  1.0 3.0
   81    74    39    41   0.15000  1.0 3.0
   81    86    94    95   0.15000  1.0 3.0
   81    86    94    96   0.15000  1.0 3.0
   81    86    94    97   0.34400  1.0 1.0
   81    86    94    97   0.09450 -1.0 2.0
   81    86    94    97   0.11100  1.0 3.0
   81    86   103   101  -0.25900  1.0 1.0
   81    86   103   101  -0.47000 -1.0 2.0
   81    86   103   101   0.11750  1.0 3.0
   82    81    86    87   0.15000  1.0 3.0
   82    81    86    94   0.15000  1.0 3.0
   82    81    86   103   0.23400  1.0 3.0
   82    81    88    89   0.19450  1.0 3.0
   86    81    88    89  -0.11600  1.0 1.0
   86    81    88    89  -0.09450 -1.0 2.0
   86    81    88    89   0.21250  1.0 3.0
   86    94    97    98   0.00000  1.0 1.0
   86    94    97    99   0.09850  1.0 1.0
   86    94    97    99   0.15250 -1.0 2.0
   86    94    97    99  -0.50650  1.0 3.0
   87    86    94    95   0.15000  1.0 3.0
   87    86    94    96   0.15000  1.0 3.0
   87    86    94    97   0.15000  1.0 3.0
   87    86   103   101   0.08050  1.0 3.0
   94    86   103   101  -0.25900  1.0 1.0
   94    86   103   101  -0.47000 -1.0 2.0
   94    86   103   101   0.11750  1.0 3.0
   94    97    99   100   7.00000 -1.0 2.0
   94    97   -99   101   7.00000 -1.0 2.0
   95    94    97    98   0.33100  1.0 3.0
   95    94    97    99   0.00000  1.0 1.0
   96    94    97    98   0.33100  1.0 3.0
   96    94    97    99   0.00000  1.0 1.0
   97    99   101   102   1.00000 -1.0 2.0
   97    99   101   103  -0.56150  1.0 1.0
   97    99   101   103   2.19150 -1.0 2.0
   98    97    99   100   7.00000 -1.0 2.0
   98    97    99   101   7.00000 -1.0 2.0
   99   101  -103    86   2.00000 -1.0 2.0
  100    99   101   102   0.00000  1.0 1.0
  100    99   101   103   1.63100 -1.0 2.0
  102   101   103    86   3.00000 -1.0 2.0
  103    86    94    95   0.23400  1.0 3.0
  103    86    94    96   0.23400  1.0 3.0
  103    86   -94    97   0.61850  1.0 1.0
  103    86   -94    97  -0.22750 -1.0 2.0
  103    86   -94    97   0.15300  1.0 3.0
   88    81    86    87   0.23400  1.0 3.0
   88    81    86    94   0.86500  1.0 1.0
   88    81    86    94  -0.17500 -1.0 2.0
   88    81    86    94   0.20800  1.0 3.0
   88    81    86   103   3.69350  1.0 1.0
   88    81    86   103  -1.82950 -1.0 2.0
   54    49    53    61   0.67800  1.0 1.0
   54    49    53    61   0.47050 -1.0 2.0
   54    49    53    61  -0.62500  1.0 3.0
   54    49    53    79   0.09700  1.0 1.0
   54    49    53    79   0.15600 -1.0 2.0
   54    49    53    79  -0.50800  1.0 3.0
   51    47    49    50   0.15000  1.0 3.0
   51    47    49    53   0.34400  1.0 1.0
   51    47    49    53   0.09450 -1.0 2.0
   51    47    49    53   0.11100  1.0 3.0
   51    47    49    54   0.86500  1.0 1.0
   51    47    49    54  -0.17500 -1.0 2.0
   51    47    49    54   0.20800  1.0 3.0
   51    56    62    63   0.15000  1.0 3.0
   51    56    62    64   0.15000  1.0 3.0
   51    56    62    70   0.56750  1.0 1.0
   51    56    62    70  -0.07550 -1.0 2.0
   51    56    62    70   0.20000  1.0 3.0
   52    51    56    57   0.15000  1.0 3.0
   52    51    56    58   0.15000  1.0 3.0
   52    51    56    62   0.15000  1.0 3.0
   52    51    59    60   0.19450  1.0 3.0
   56    51    59    60  -0.11600  1.0 1.0
   56    51    59    60  -0.09450 -1.0 2.0
   56    51    59    60   0.21250  1.0 3.0
   56    62    70    71   0.15000  1.0 3.0
   56    62    70    72   0.15000  1.0 3.0
   56    62    70    76   0.56750  1.0 1.0
   56    62    70    76  -0.07550 -1.0 2.0
   56    62    70    76   0.20000  1.0 3.0
   57    56    62    63   0.15000  1.0 3.0
   57    56    62    64   0.15000  1.0 3.0
   57    56    62    70   0.15000  1.0 3.0
   58    56    62    63   0.15000  1.0 3.0
   58    56    62    64   0.15000  1.0 3.0
   58    56    62    70   0.15000  1.0 3.0
   62    70    76    77   0.15000  1.0 3.0
   62    70    76    78   0.15000  1.0 3.0
   62    70    76    83   0.56750  1.0 1.0
   62    70    76    83  -0.07550 -1.0 2.0
   62    70    76    83   0.20000  1.0 3.0
   63    62    70    71   0.15000  1.0 3.0
   63    62    70    72   0.15000  1.0 3.0
   63    62    70    76   0.15000  1.0 3.0
   64    62    70    71   0.15000  1.0 3.0
   64    62    70    72   0.15000  1.0 3.0
   64    62    70    76   0.15000  1.0 3.0
   70    76    83    84   0.15000  1.0 3.0
   70    76    83    85   0.15000  1.0 3.0
   70    76    83    90   0.56750  1.0 1.0
   70    76    83    90  -0.07550 -1.0 2.0
   70    76    83    90   0.20000  1.0 3.0
   71    70    76    77   0.15000  1.0 3.0
   71    70    76    78   0.15000  1.0 3.0
   71    70    76    83   0.15000  1.0 3.0
   72    70    76    77   0.15000  1.0 3.0
   72    70    76    78   0.15000  1.0 3.0
   72    70    76    83   0.15000  1.0 3.0
   76    83    90    91   0.15000  1.0 3.0
   76    83    90    92   0.15000  1.0 3.0
   76    83    90    93   0.15000  1.0 3.0
   77    76    83    84   0.15000  1.0 3.0
   77    76    83    85   0.15000  1.0 3.0
   77    76    83    90   0.15000  1.0 3.0
   78    76    83    84   0.15000  1.0 3.0
   78    76    83    85   0.15000  1.0 3.0
   78    76    83    90   0.15000  1.0 3.0
   84    83    90    91   0.15000  1.0 3.0
   84    83    90    92   0.15000  1.0 3.0
   84    83    90    93   0.15000  1.0 3.0
   85    83    90    91   0.15000  1.0 3.0
   85    83    90    92   0.15000  1.0 3.0
   85    83    90    93   0.15000  1.0 3.0
   59    51    56    57   0.23400  1.0 3.0
   59    51    56    58   0.23400  1.0 3.0
   59    51    56    62   0.86500  1.0 1.0
   59    51    56    62  -0.17500 -1.0 2.0
   59    51    56    62   0.20800  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    42    37    38  10.50000 -1.0 2.0
   42    45    43    44  10.50000 -1.0 2.0
   49    79    53    61   1.10000 -1.0 2.0
   65    67    61    53   1.10000 -1.0 2.0
   61    73    65    66  10.50000 -1.0 2.0
   53    73    79    80  10.50000 -1.0 2.0
   94    98    97    99   1.10000 -1.0 2.0
  101   100    99    97   1.10000 -1.0 2.0
   99   103   101   102  10.50000 -1.0 2.0
END
