* LIGAND DATABASE FILE (OPLS2005)
*
001     109   111    200    304     584
    1     0 S   NP   _N1_     1    28.84120    95.71070   -20.13780
    2     1 S   H    _HN1     2     1.02779    86.35960   -80.18507
    3     1 S   H    _H1_     3     1.02950    81.62981    29.02020
    4     1 S   H    _H2_     4     1.02828    41.20872   157.09049
    5     1 S   CT   _CA1     5     1.50141   151.61436   146.91606
    6     5 S   HC   _HA1     6     1.09574   105.14362    66.30670
    7     5 S   CO3  _C1_     7     1.53751   112.62189   -53.74024
    8     7 S   O2Z  _O11     8     1.26372   115.02118   -37.28468
    9     7 S   O2Z  _O12     9     1.26251   115.01925   141.95391
   10     5 S   CT   _CB1    10     1.53105   107.40613  -175.72222
   11    10 S   HC   HB11    11     1.09823   109.23777   -49.46954
   12    10 S   HC   HB12    12     1.09815   110.45821    67.13298
   13    10 S   CT   _CG1    13     1.52961   112.68313  -170.53357
   14    13 S   HC   HG11    14     1.09544   110.49997   -67.58840
   15    13 S   HC   HG12    15     1.09676   109.85555    51.57359
   16    13 S   C    _CD1    16     1.51818   112.45211   171.84019
   17    16 S   O    _OE1    17     1.22705   123.36803     3.09939
   18    16 S   N    _N2_    18     1.38610   111.50195  -176.64929
   19    18 S   H    _HN2    19     1.01586   118.85713     0.72036
   20    18 S   CT1  _CA2    20     1.46233   123.56574   177.43265
   21    20 S   HC   _HA2    21     1.09733   109.46602    -6.24466
   22    20 S   C    _C2_    22     1.53462   108.17454  -121.61130
   23    22 S   O    _O2_    23     1.23027   122.42042  -147.29911
   24    20 S   CT   _CB2    32     1.53293   111.32469   116.12906
   25    24 S   HC   HB21    33     1.09376   109.66643    54.44041
   26    24 S   HC   HB22    34     1.09498   110.55238   172.50328
   27    22 S   N    _N3_    24     1.38376   113.46572    40.14735
   28    27 S   H    _HN3    25     1.01629   119.49633    -3.48560
   29    24 S   S    _SG2    35     1.83021   111.16293   -68.96762
   30    27 S   CT   _CA3    26     1.45284   123.18108   177.04686
   31    30 S   HC   HA31    27     1.09550   107.51936   -64.10563
   32    30 S   HC   HA32    28     1.09557   107.96426    52.31776
   33    29 S   CT   _C25    36     1.85849   101.66469   138.28961
   34    33 S   HC   _H3_    37     1.09654   103.65665   172.49789
   35    30 S   CO3  _C3_    29     1.52947   114.09870   174.29576
   36    35 S   O2Z  _O31    30     1.26372   116.05303    -1.04867
   37    35 S   O2Z  _O32    31     1.26428   114.41578   179.01345
   38    33 S   CT   _C21    38     1.54512   108.37662   -72.53244
   39    38 S   HC   _H53    39     1.09306   110.56313   168.77500
   40    38 S   HC   _H54    40     1.09522   112.14834    50.72601
   41    33 S   CT   _C24    88     1.57156   114.34471    56.32926
   42    41 S   HC   _H58    89     1.09564   107.68203   -69.31209
   43    38 S   C    _C16    41     1.52512   113.94012   -73.20856
   44    43 S   O    _O36    42     1.22754   123.70438     2.51053
   45    41 S   CT   _C28    90     1.54280   111.33517    48.78785
   46    45 S   HC   _H64    91     1.09507   111.32314    57.88328
   47    45 S   HC   _H65    92     1.09327   112.02737   -63.19907
   48    45 S   HC   _H66    93     1.09319   111.77893   178.78566
   49    43 S   N    _N30    43     1.38948   111.73472  -175.32253
   50    49 S   H    _H74    44     1.01496   119.59399    -3.79834
   51    49 S   CT   _C19    45     1.45343   122.36749   170.76677
   52    51 S   HC   _H49    46     1.09323   108.13203   163.95555
   53    51 S   HC   _H50    47     1.09437   109.00714    44.93923
   54    51 S   CM   _C8_    48     1.49892   107.02145   -76.98017
   55    54 S   HC   _H42    49     1.08683   115.37798   -55.08921
   56    54 S   CM   _C7_    50     1.34333   123.65217   119.27551
   57    56 S   HC   _H41    51     1.08922   117.87790     5.47296
   58    56 S   CM   _C12    52     1.46305   125.76042  -168.24160
   59    58 S   CM   _C9_    53     1.35048   119.15707   178.44543
   60    59 S   HC   _H43    54     1.09044   118.10222     5.27121
   61    58 S   CT   _C27   106     1.50449   117.09547     3.08604
   62    61 S   HC   _H61   107     1.09469   110.86443    59.44186
   63    61 S   HC   _H62   108     1.09562   110.68253   -61.54352
   64    61 S   HC   _H63   109     1.08760   112.77822   179.69739
   65    59 S   CT   _C23    55     1.50660   126.89261  -166.42027
   66    65 S   HC   _H57    56     1.09311   108.12397    47.70706
   67    65 S   CT   _C20    57     1.53042   115.92215   -77.60276
   68    67 S   HC   _H51    58     1.09393   112.09815    42.84629
   69    67 S   HC   _H52    59     1.09623   111.58749   -77.83541
   70    65 S   OH   _O39   104     1.43376   106.84611   160.98384
   71    70 S   HO   _H75   105     0.97367   107.45919  -176.61106
   72    67 S   CO4  _C15    60     1.52604   109.46247   163.63532
   73    72 S   O    _O35    61     1.23355   120.71405    60.07752
   74    72 S   CT   _C17    62     1.51308   118.57537  -119.27984
   75    74 S   HC   _H45    63     1.09482   108.63330   -47.54808
   76    74 S   HC   _H46    64     1.09525   108.64763  -164.09041
   77    74 S   CRA  _C6_    65     1.48019   110.82486    75.10384
   78    77 S   N5B  _N29    66     1.31727   129.83306    13.62324
   79    78 S   C5B  _C5_    67     1.37756   104.47469  -173.58256
   80    79 S   C5A  _C4_    68     1.37858   108.66319    -3.37435
   81    80 S   HA   _H40    69     1.08010   135.00927   178.70487
   82    79 S   C    _C11    71     1.45868   125.46099   170.38812
   83    82 S   O    _O33    72     1.23090   119.18381  -163.20612
   84    77 S   OA   _O37    70     1.36764   115.95099  -163.60669
   85    82 S   N    _N31    73     1.39717   117.62153    15.95400
   86    85 S   CM   _C13    74     1.38573   125.61387  -162.46437
   87    86 S   CM   _C10    75     1.33991   111.73042  -168.28927
   88    87 S   HC   _H44    76     1.08082   125.79956  -177.72876
   89    86 S   CO4  _C14    83     1.47933   124.86851    17.13645
   90    89 S   O    _O34    84     1.22159   123.99263    29.36467
   91    87 S   CT   _C18    77     1.49328   111.00147     1.79907
   92    91 S   HC   _H47    78     1.09460   110.53147   110.71490
   93    91 S   HC   _H48    79     1.09382   112.08571  -127.58089
   94    89 S   OS   _O38    85     1.36045   109.61004  -151.66676
   95    85 S   CT   _C22    80     1.47662   125.87846    24.46312
   96    95 S   HC   _H55    81     1.09481   110.42868    41.48631
   97    95 S   HC   _H56    82     1.09361   108.78681   -78.46669
   98    94 S   CT   _C26    86     1.45182   118.71532  -179.46332
   99    98 S   HC   _H60    87     1.09387   110.49120     1.29980
  100    98 S   CT   _C31    94     1.55461   107.52143  -114.24418
  101   100 S   HC   _H73    95     1.09647   109.51894   -53.77023
  102   100 S   CT   _C29    96     1.53659   110.73059    62.64620
  103   102 S   HC   _H67    97     1.09528   111.22909    58.91353
  104   102 S   HC   _H68    98     1.09444   111.36111   -61.87266
  105   102 S   HC   _H69    99     1.09546   110.76716   178.97990
  106   100 S   CT   _C30   100     1.52996   112.56109  -174.98206
  107   106 S   HC   _H70   101     1.09520   111.18368   -54.98534
  108   106 S   HC   _H71   102     1.09550   110.84920  -175.03036
  109   106 S   HC   _H72   103     1.09387   111.50035    65.97422
  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
  17   8   2   1   1  11   5   4  14   8   7   3   7   3   2   1
   7   4   7   4   3   6   3   9   3  10  13   5   4   2   1   1
   9   6  10   5   4   2   1   7   4   7   4   3   6   7   8   5
   2  10   3   1  12  12  10   5   7   2   5   4   3   6   2   1
   1  11   4   9   8   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    98    41    42    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    44    49    94    98    99    41    42    45    46    47    48   100  
   38    39    40    43    98    41    42    45  
   36    37  
   37  
    0  
   39    40    43    44    49    50    51    98    41    42    45  
   40    43    44    49    41  
   43    44    49    41  
   42    45    46    47    48   100   101   102   106    43    89    94    98    99  
   45    46    47    48   100    94    98    99  
   44    49    50    51    52    53    54  
   49    50    51  
   46    47    48   100    94    98    99  
   47    48    98  
   48    98  
   98  
   50    51    52    53    54    55    56  
   51    52    53    54  
   52    53    54    55    56    57    58  
   53    54    55    56  
   54    55    56  
   55    56    57    58    59    61  
   56    57    58  
   57    58    59    60    65    61    62    63    64  
   58    59    61  
   59    60    65    66    67    70    61    62    63    64  
   60    65    66    67    68    69    72    70    71    61    62    63    64  
   65    66    67    70    61  
   62    63    64    65  
   63    64  
   64  
    0  
   66    67    68    69    72    73    74    70    71  
   67    68    69    72    70    71  
   68    69    72    73    74    75    76    77    70    71  
   69    72    73    74    70  
   72    73    74    70  
   71    72  
    0  
   73    74    75    76    77    78    84  
   74    75    76    77  
   75    76    77    78    79    80    84  
   76    77    78    84  
   77    78    84  
   78    79    80    81    84    82  
   79    80    81    84    82    83    85  
   80    81    84    82    83    85    86    95  
   81    84    82    83    85  
   84    82  
   83    85    86    87    91    95    96    97    89    84  
   85    86    95  
    0  
   86    87    88    91    92    93    95    96    97    89    90    94  
   87    88    91    92    93    95    96    97    89    90    94    98  
   88    91    92    93    95    96    97    89    90    94  
   91    92    93    95    89  
   90    94    98    99   100    91    95  
   94    98  
   92    93    95    96    97  
   93    95    96    97  
   95    96    97  
   98    99   100   101   102   106  
   96    97  
   97  
    0  
   99   100   101   102   103   104   105   106   107   108   109  
  100   101   102   106  
  101   102   103   104   105   106   107   108   109  
  102   103   104   105   106   107   108   109  
  103   104   105   106   107   108   109  
  104   105   106  
  105   106  
  106  
  107   108   109  
  108   109  
  109  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   50   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   51   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   59   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   72   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   73   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   74   3.5000   0.0660  -0.005000   2.4950   1.7500   0.005000000  -0.741685710
   75   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   76   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   77   3.5500   0.0700   0.439000   2.5000   1.7750   0.001000000  -0.843144165
   78   3.2500   0.1700  -0.590000   1.8650   1.6500   0.001000000  -0.511443539
   79   3.5500   0.0700   0.145000   2.5000   1.7750   0.001000000  -0.843144165
   80   3.5500   0.0700  -0.148000   2.0020   1.7750   0.001000000  -0.843144165
   81   2.4200   0.0300   0.181000   1.3810   1.2100   0.030040813   0.268726247
   82   3.7500   0.1050   0.615000   1.9250   1.7000   0.001000000  -0.126889456
   83   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   84   2.9000   0.1400  -0.257000   1.6450   1.4500   0.001000000  -0.126889456
   85   3.2500   0.1700   0.003200   1.8100   1.6000   0.054801302  -1.445846770
   86   3.5500   0.0760  -0.073200   2.0020   1.7750   0.023028004  -0.852763146
   87   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   88   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   89   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   90   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   95   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
  100   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   317.000  1.522
   43    44   570.000  1.229
   43    49   490.000  1.335
   49    50   434.000  1.010
   49    51   337.000  1.449
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   317.000  1.510
   54    55   340.000  1.080
   54    56   549.000  1.340
   56    57   340.000  1.080
   56    58   380.000  1.444
   58    59   549.000  1.340
   58    61   317.000  1.510
   59    60   340.000  1.080
   59    65   317.000  1.510
   65    66   340.000  1.090
   65    67   268.000  1.529
   65    70   320.000  1.410
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    72   317.000  1.522
   72    73   570.000  1.229
   72    74   317.000  1.522
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   295.000  1.488
   77    78   488.000  1.335
   77    84   462.000  1.357
   78    79   410.000  1.394
   79    80   520.000  1.370
   79    82   310.000  1.477
   80    81   367.000  1.080
   80    84   340.000  1.360
   82    83   570.000  1.229
   82    85   490.000  1.335
   85    86   400.000  1.384
   85    95   337.000  1.449
   86    87   549.000  1.340
   86    89   320.000  1.462
   87    88   340.000  1.080
   87    91   317.000  1.510
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    95   268.000  1.529
   95    96   340.000  1.090
   95    97   340.000  1.090
   89    90   570.000  1.229
   89    94   214.000  1.327
   94    98   320.000  1.410
   98    99   340.000  1.090
   98    41   268.000  1.529
   98   100   268.000  1.529
   41    42   340.000  1.090
   41    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
  100   101   340.000  1.090
  100   102   268.000  1.529
  100   106   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   340.000  1.090
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   340.000  1.090
   70    71   553.000  0.945
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    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    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    63.00000  111.10000
   33    41    98    58.35000  112.70000
   33    41    42    37.50000  110.70000
   33    41    45    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    43    44    80.00000  120.40000
   38    43    49    70.00000  116.60000
   40    38    39    33.00000  107.80000
   43    38    39    35.00000  109.50000
   43    38    40    35.00000  109.50000
   43    49    50    35.00000  119.80000
   43    49    51    50.00000  121.90000
   49    43    44    80.00000  122.90000
   49    51    52    35.00000  109.50000
   49    51    53    35.00000  109.50000
   49    51    54    75.00000  110.78400
   51    49    50    38.00000  118.40000
   51    54    55    35.00000  117.00000
   51    54    56    70.00000  124.00000
   53    51    52    33.00000  107.80000
   54    51    52    35.00000  109.50000
   54    51    53    35.00000  109.50000
   54    56    57    35.00000  120.00000
   54    56    58    70.00000  123.01800
   56    54    55    35.00000  120.00000
   56    58    59    70.00000  123.01800
   56    58    61    70.00000  124.00000
   58    56    57    35.00000  120.00000
   58    59    60    35.00000  120.00000
   58    59    65    70.00000  124.00000
   58    61    62    35.00000  109.50000
   58    61    63    35.00000  109.50000
   58    61    64    35.00000  109.50000
   59    65    66    35.00000  109.50000
   59    65    67    70.00000  112.02700
   59    65    70    90.00000  110.39200
   65    59    60    35.00000  117.00000
   65    67    68    37.50000  110.70000
   65    67    69    37.50000  110.70000
   65    67    72    63.00000  111.10000
   65    70    71    55.00000  108.50000
   67    65    66    37.50000  110.70000
   67    72    73    80.00000  120.40000
   67    72    74    70.00000  116.00000
   69    67    68    33.00000  107.80000
   72    67    68    35.00000  109.50000
   72    67    69    35.00000  109.50000
   72    74    75    35.00000  109.50000
   72    74    76    35.00000  109.50000
   72    74    77    75.00000  105.85400
   74    72    73    80.00000  120.40000
   74    77    78    65.00000  125.57700
   74    77    84    80.00000  117.62500
   76    74    75    33.00000  107.80000
   77    74    75    45.00000  109.19200
   77    74    76    45.00000  109.19200
   77    78    79    70.00000  110.00000
   77    84    80    70.00000  104.00000
   78    79    80    70.00000  111.00000
   78    79    82    65.00000  122.69000
   79    80    81    35.00000  130.70000
   79    80    84    70.00000  108.00000
   79    82    83    80.00000  122.33200
   79    82    85    75.00000  113.48100
   84    77    78    70.00000  115.00000
   84    80    81    35.00000  113.40000
   82    79    80    60.00000  124.35000
   82    85    86    70.00000  120.89900
   82    85    95    50.00000  121.90000
   85    82    83    80.00000  122.90000
   85    86    87    75.00000  120.83300
   85    86    89    70.00000  117.92000
   85    95    91    70.00000  110.72300
   85    95    96    35.00000  109.50000
   85    95    97    35.00000  109.50000
   86    87    88    35.00000  120.00000
   86    87    91    70.00000  124.00000
   86    89    90    80.00000  123.72100
   86    89    94    90.00000  111.29400
   87    91    92    35.00000  109.50000
   87    91    93    35.00000  109.50000
   87    91    95    70.00000  112.02700
   91    87    88    35.00000  117.00000
   91    95    96    37.50000  110.70000
   91    95    97    37.50000  110.70000
   93    91    92    33.00000  107.80000
   95    85    86    70.00000  119.94800
   95    91    92    37.50000  110.70000
   95    91    93    37.50000  110.70000
   97    95    96    33.00000  107.80000
   89    86    87    65.00000  118.96000
   89    94    98    83.00000  116.90000
   94    89    90    83.00000  123.40000
   94    98    99    35.00000  109.50000
   94    98    41    50.00000  109.50000
   94    98   100    50.00000  109.50000
   98    41    42    37.50000  110.70000
   98    41    45    58.35000  112.70000
   98   100   101    37.50000  110.70000
   98   100   102    58.35000  112.70000
   98   100   106    58.35000  112.70000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41    98    99    37.50000  110.70000
   41    45    46    37.50000  110.70000
   41    45    47    37.50000  110.70000
   41    45    48    37.50000  110.70000
   45    41    42    37.50000  110.70000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
  100    98    99    37.50000  110.70000
  100    98    41    58.35000  112.70000
  100   102   103    37.50000  110.70000
  100   102   104    37.50000  110.70000
  100   102   105    37.50000  110.70000
  100   106   107    37.50000  110.70000
  100   106   108    37.50000  110.70000
  100   106   109    37.50000  110.70000
  102   100   101    37.50000  110.70000
  104   102   103    33.00000  107.80000
  105   102   103    33.00000  107.80000
  105   102   104    33.00000  107.80000
  106   100   101    37.50000  110.70000
  106   100   102    58.35000  112.70000
  108   106   107    33.00000  107.80000
  109   106   107    33.00000  107.80000
  109   106   108    33.00000  107.80000
   70    65    66    35.00000  109.50000
   70    65    67    50.00000  109.50000
   61    58    59    70.00000  124.00000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  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
   24    29    33    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   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    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    41    98   0.44750  1.0 1.0
   29    33    41    98  -0.17800 -1.0 2.0
   29    33    41    98   0.20200  1.0 3.0
   29    33    41    42   0.15000  1.0 3.0
   29    33    41    45   0.44750  1.0 1.0
   29    33    41    45  -0.17800 -1.0 2.0
   29    33    41    45   0.20200  1.0 3.0
   33    38    43    44   0.30150 -1.0 2.0
   33    38    43    49   1.39750  1.0 1.0
   33    38    43    49  -0.07950 -1.0 2.0
   33    38    43    49  -0.18750  1.0 3.0
   33    41    45    46   0.15000  1.0 3.0
   33    41    45    47   0.15000  1.0 3.0
   33    41    45    48   0.15000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    43  -0.11250  1.0 3.0
   34    33    41    98   0.15000  1.0 3.0
   34    33    41    42   0.15000  1.0 3.0
   34    33    41    45   0.15000  1.0 3.0
   38    33    41    98   0.56750  1.0 1.0
   38    33    41    98  -0.07550 -1.0 2.0
   38    33    41    98   0.20000  1.0 3.0
   38    33    41    42   0.15000  1.0 3.0
   38    33    41    45   0.56750  1.0 1.0
   38    33    41    45  -0.07550 -1.0 2.0
   38    33    41    45   0.20000  1.0 3.0
   38    43    49    50   2.45000 -1.0 2.0
   38    43    49    51   1.49850  1.0 1.0
   38    43    49    51   1.53950 -1.0 2.0
   39    38    43    44   0.00000  1.0 1.0
   39    38    43    49   0.00000  1.0 1.0
   40    38    43    44   0.00000  1.0 1.0
   40    38    43    49   0.00000  1.0 1.0
   43    49    51    52   0.00000  1.0 1.0
   43    49    51    53   0.00000  1.0 1.0
   43    49    51    54  -0.19250  1.0 1.0
   43    49    51    54  -0.00500 -1.0 2.0
   43    49    51    54   0.17000  1.0 3.0
   44    43    49    50   2.45000 -1.0 2.0
   44    43    49    51   3.04450 -1.0 2.0
   49    51    54    55   0.00000  1.0 1.0
   49    51    54    56   0.62150  1.0 1.0
   49    51    54    56   0.42850 -1.0 2.0
   49    51    54    56  -0.68200  1.0 3.0
   50    49    51    52   0.00000  1.0 1.0
   50    49    51    53   0.00000  1.0 1.0
   50    49    51    54   0.00000  1.0 1.0
   51    54    56    57   7.00000 -1.0 2.0
   51    54    56    58   7.00000 -1.0 2.0
   52    51    54    55   0.33100  1.0 3.0
   52    51    54    56   0.00000  1.0 1.0
   53    51    54    55   0.33100  1.0 3.0
   53    51    54    56   0.00000  1.0 1.0
   54    56    58    59   0.28850  1.0 1.0
   54    56    58    59   2.61350 -1.0 2.0
   54    56    58    59   0.78400  1.0 3.0
   54    56    58    61  -0.18600  1.0 3.0
   55    54    56    57   7.00000 -1.0 2.0
   55    54    56    58   7.00000 -1.0 2.0
   56    58    59    60   7.00000 -1.0 2.0
   56    58    59    65   7.00000 -1.0 2.0
   56    58    61    62   0.00000  1.0 1.0
   56    58    61    63   0.00000  1.0 1.0
   56    58    61    64   0.00000  1.0 1.0
   57    56    58    59  -0.18600  1.0 3.0
   57    56    58    61   0.00000  1.0 1.0
   58    59    65    66   0.00000  1.0 1.0
   58    59    65    67   0.09850  1.0 1.0
   58    59    65    67   0.15250 -1.0 2.0
   58    59    65    67  -0.50650  1.0 3.0
   58    59    65    70   0.67800  1.0 1.0
   58    59    65    70   0.47050 -1.0 2.0
   58    59    65    70  -0.62500  1.0 3.0
   59    58    61    62   0.00000  1.0 1.0
   59    58    61    63   0.00000  1.0 1.0
   59    58    61    64   0.00000  1.0 1.0
   59    65    67    68   0.15000  1.0 3.0
   59    65    67    69   0.15000  1.0 3.0
   59    65    67    72  -0.98800  1.0 1.0
   59    65    67    72   0.48800 -1.0 2.0
   59    65    67    72   0.76800  1.0 3.0
   59    65    70    71  -0.07800  1.0 1.0
   59    65    70    71  -0.21500 -1.0 2.0
   59    65    70    71  -0.03150  1.0 3.0
   60    59    65    66   0.33100  1.0 3.0
   60    59    65    67   0.00000  1.0 1.0
   60    59    65    70   0.00000  1.0 1.0
   65    67    72    73   0.30150 -1.0 2.0
   65    67    72    74   0.60050  1.0 1.0
   65    67    72    74   0.05600 -1.0 2.0
   65    67    72    74   0.26150  1.0 3.0
   66    65    67    68   0.15000  1.0 3.0
   66    65    67    69   0.15000  1.0 3.0
   66    65    67    72  -0.11250  1.0 3.0
   66    65    70    71   0.19450  1.0 3.0
   67    65    70    71  -0.11600  1.0 1.0
   67    65    70    71  -0.09450 -1.0 2.0
   67    65    70    71   0.21250  1.0 3.0
   67    72    74    75   0.00000  1.0 1.0
   67    72    74    76   0.00000  1.0 1.0
   67    72    74    77   0.65300  1.0 1.0
   67    72    74    77  -0.03850 -1.0 2.0
   67    72    74    77   0.33900  1.0 3.0
   68    67    72    73   0.00000  1.0 1.0
   68    67    72    74   0.00000  1.0 1.0
   69    67    72    73   0.00000  1.0 1.0
   69    67    72    74   0.00000  1.0 1.0
   72    74    77    78   0.04300 -1.0 2.0
   72    74    77    84   0.04300 -1.0 2.0
   73    72    74    75   0.00000  1.0 1.0
   73    72    74    76   0.00000  1.0 1.0
   73    72    74    77   0.30150 -1.0 2.0
   74    77    78    79   3.62500 -1.0 2.0
   74    77    84    80   3.62500 -1.0 2.0
   75    74    77    78   0.00000  1.0 1.0
   75    74    77    84   0.00000  1.0 1.0
   76    74    77    78   0.00000  1.0 1.0
   76    74    77    84   0.00000  1.0 1.0
   77    78   -79    80   2.40000 -1.0 2.0
   77    78    79    82   3.62500 -1.0 2.0
   78    77   -84    80   3.62500 -1.0 2.0
   78    79    80    81   3.62500 -1.0 2.0
   78    79   -80    84   3.62500 -1.0 2.0
   78    79    82    83   1.05000 -1.0 2.0
   78    79    82    85   1.61600  1.0 1.0
   78    79    82    85  -0.04750 -1.0 2.0
   78    79    82    85   0.11700  1.0 3.0
   79    80   -84    77   3.62500 -1.0 2.0
   79    82    85    86   2.45000 -1.0 2.0
   79    82    85    95   1.49850  1.0 1.0
   79    82    85    95   1.53950 -1.0 2.0
   80    79    82    83   1.05000 -1.0 2.0
   80    79    82    85   0.75700  1.0 1.0
   80    79    82    85   0.34650 -1.0 2.0
   80    79    82    85   0.33000  1.0 3.0
   80    79    82    85  -0.28100 -1.0 4.0
   81    80    84    77   3.62500 -1.0 2.0
   84    77   -78    79   3.62500 -1.0 2.0
   82    79    80    81   3.62500 -1.0 2.0
   82    79    80    84   3.62500 -1.0 2.0
   82    85    86    87  -0.18900  1.0 1.0
   82    85    86    87   1.70900 -1.0 2.0
   82    85    86    89  -0.56400  1.0 1.0
   82    85    86    89   0.77500 -1.0 2.0
   82    85    86    89   0.18700  1.0 3.0
   82    85    95    91  -0.43950  1.0 1.0
   82    85    95    91  -0.08100 -1.0 2.0
   82    85    95    91   0.03350  1.0 3.0
   82    85    95    96   0.00000  1.0 1.0
   82    85    95    97   0.00000  1.0 1.0
   83    82    85    86   2.67200 -1.0 2.0
   83    82    85    95   3.04450 -1.0 2.0
   85    86    87    88   7.00000 -1.0 2.0
   85    86   -87    91   7.00000 -1.0 2.0
   85    86    89    90  -0.52200  1.0 1.0
   85    86    89    90   0.82950 -1.0 2.0
   85    86    89    94   1.50000 -1.0 2.0
   86    85   -95    91  -0.05900 -1.0 2.0
   86    85    95    96   0.00000  1.0 1.0
   86    85    95    97   0.00000  1.0 1.0
   86    87    91    92   0.00000  1.0 1.0
   86    87    91    93   0.00000  1.0 1.0
   86    87   -91    95   0.09850  1.0 1.0
   86    87   -91    95   0.15250 -1.0 2.0
   86    87   -91    95  -0.50650  1.0 3.0
   86    89    94    98   2.00000 -1.0 2.0
   87    86    89    90   1.00000 -1.0 2.0
   87    86    89    94  -0.56150  1.0 1.0
   87    86    89    94   2.19150 -1.0 2.0
   87    91   -95    85   0.21700  1.0 1.0
   87    91   -95    85   0.68550 -1.0 2.0
   87    91   -95    85  -0.27950  1.0 3.0
   87    91    95    96   0.15000  1.0 3.0
   87    91    95    97   0.15000  1.0 3.0
   88    87    91    92   0.33100  1.0 3.0
   88    87    91    93   0.33100  1.0 3.0
   88    87    91    95   0.00000  1.0 1.0
   92    91    95    85   0.15000  1.0 3.0
   92    91    95    96   0.15000  1.0 3.0
   92    91    95    97   0.15000  1.0 3.0
   93    91    95    85   0.15000  1.0 3.0
   93    91    95    96   0.15000  1.0 3.0
   93    91    95    97   0.15000  1.0 3.0
   95    85   -86    87  -0.88150  1.0 1.0
   95    85   -86    87   2.95600 -1.0 2.0
   95    85    86    89   1.00000 -1.0 2.0
   89    86    87    88   7.00000 -1.0 2.0
   89    86    87    91   7.00000 -1.0 2.0
   89    94    98    99   0.08050  1.0 3.0
   89    94    98    41  -0.25900  1.0 1.0
   89    94    98    41  -0.47000 -1.0 2.0
   89    94    98    41   0.11750  1.0 3.0
   89    94    98   100  -0.25900  1.0 1.0
   89    94    98   100  -0.47000 -1.0 2.0
   89    94    98   100   0.11750  1.0 3.0
   90    89    94    98   3.00000 -1.0 2.0
   94    98    41    33   0.62750  1.0 1.0
   94    98    41    33  -0.30950 -1.0 2.0
   94    98    41    33   0.27300  1.0 3.0
   94    98    41    42   0.23400  1.0 3.0
   94    98    41    45   0.62750  1.0 1.0
   94    98    41    45  -0.30950 -1.0 2.0
   94    98    41    45   0.27300  1.0 3.0
   94    98   100   101   0.23400  1.0 3.0
   94    98   100   102   0.62750  1.0 1.0
   94    98   100   102  -0.30950 -1.0 2.0
   94    98   100   102   0.27300  1.0 3.0
   94    98   100   106   0.62750  1.0 1.0
   94    98   100   106  -0.30950 -1.0 2.0
   94    98   100   106   0.27300  1.0 3.0
   98    41    45    46   0.15000  1.0 3.0
   98    41    45    47   0.15000  1.0 3.0
   98    41    45    48   0.15000  1.0 3.0
   98   100   102   103   0.15000  1.0 3.0
   98   100   102   104   0.15000  1.0 3.0
   98   100   102   105   0.15000  1.0 3.0
   98   100   106   107   0.15000  1.0 3.0
   98   100   106   108   0.15000  1.0 3.0
   98   100   106   109   0.15000  1.0 3.0
   99    98    41    33   0.15000  1.0 3.0
   99    98    41    42   0.15000  1.0 3.0
   99    98    41    45   0.15000  1.0 3.0
   99    98   100   101   0.15000  1.0 3.0
   99    98   100   102   0.15000  1.0 3.0
   99    98   100   106   0.15000  1.0 3.0
   41    33    38    39   0.15000  1.0 3.0
   41    33    38    40   0.15000  1.0 3.0
   41    33    38    43  -0.95700  1.0 1.0
   41    33    38    43  -0.18200 -1.0 2.0
   41    33    38    43   0.29450  1.0 3.0
   41    98   100   101   0.15000  1.0 3.0
   41    98   100   102   0.56750  1.0 1.0
   41    98   100   102  -0.07550 -1.0 2.0
   41    98   100   102   0.20000  1.0 3.0
   41    98   100   106   0.56750  1.0 1.0
   41    98   100   106  -0.07550 -1.0 2.0
   41    98   100   106   0.20000  1.0 3.0
   42    41    45    46   0.15000  1.0 3.0
   42    41    45    47   0.15000  1.0 3.0
   42    41    45    48   0.15000  1.0 3.0
  100    98    41    33   0.56750  1.0 1.0
  100    98    41    33  -0.07550 -1.0 2.0
  100    98    41    33   0.20000  1.0 3.0
  100    98    41    42   0.15000  1.0 3.0
  100    98    41    45   0.56750  1.0 1.0
  100    98    41    45  -0.07550 -1.0 2.0
  100    98    41    45   0.20000  1.0 3.0
  101   100   102   103   0.15000  1.0 3.0
  101   100   102   104   0.15000  1.0 3.0
  101   100   102   105   0.15000  1.0 3.0
  101   100   106   107   0.15000  1.0 3.0
  101   100   106   108   0.15000  1.0 3.0
  101   100   106   109   0.15000  1.0 3.0
  102   100   106   107   0.15000  1.0 3.0
  102   100   106   108   0.15000  1.0 3.0
  102   100   106   109   0.15000  1.0 3.0
  106   100   102   103   0.15000  1.0 3.0
  106   100   102   104   0.15000  1.0 3.0
  106   100   102   105   0.15000  1.0 3.0
   70    65    67    68   0.23400  1.0 3.0
   70    65    67    69   0.23400  1.0 3.0
   70    65    67    72  -0.09450  1.0 1.0
   70    65    67    72  -1.12950 -1.0 2.0
   70    65    67    72   0.54000  1.0 3.0
   61    58    59    60   7.00000 -1.0 2.0
   61    58    59    65   7.00000 -1.0 2.0
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
   37    30    35    36  10.50000 -1.0 2.0
   38    49    43    44  10.50000 -1.0 2.0
   50    43    49    51   1.00000 -1.0 2.0
   51    55    54    56   1.10000 -1.0 2.0
   58    57    56    54   1.10000 -1.0 2.0
   56    61    58    59   1.10000 -1.0 2.0
   65    60    59    58   1.10000 -1.0 2.0
   67    74    72    73  10.50000 -1.0 2.0
   78    84    77    74   4.00000 -1.0 2.0
   80    82    79    78   4.00000 -1.0 2.0
   84    81    80    79   1.10000 -1.0 2.0
   79    85    82    83  10.50000 -1.0 2.0
   95    82    85    86   1.00000 -1.0 2.0
   85    89    86    87   1.10000 -1.0 2.0
   91    88    87    86   1.10000 -1.0 2.0
   86    94    89    90  10.50000 -1.0 2.0
END
