* LIGAND DATABASE FILE (OPLS2005)
*
001     113   116    206    321     593
    1     0 S   NP   _N1_     1    28.73585    94.96356   -21.39499
    2     1 S   H    _HN1     2     1.02779    85.30274   -85.02138
    3     1 S   H    _H1_     3     1.02954    90.47973    23.33088
    4     1 S   H    _H2_     4     1.02833    34.64065   143.64068
    5     1 S   CT   _CA1     5     1.50092   145.16609   151.88942
    6     5 S   HC   _HA1     6     1.09569   105.26991    54.25129
    7     5 S   CO3  _C1_     7     1.53837   112.31683   -66.09342
    8     7 S   O2Z  _O11     8     1.26369   115.02614   -45.16485
    9     7 S   O2Z  _O12     9     1.26223   114.95415   134.07683
   10     5 S   CT   _CB1    10     1.53098   107.44363   172.27521
   11    10 S   HC   HB11    11     1.09820   109.55684   -49.53733
   12    10 S   HC   HB12    12     1.09819   110.37015    67.11075
   13    10 S   CT   _CG1    13     1.52945   112.52431  -170.55823
   14    13 S   HC   HG11    14     1.09567   110.46613   -60.37983
   15    13 S   HC   HG12    15     1.09650   110.04625    58.76156
   16    13 S   C    _CD1    16     1.51781   112.32627   179.19206
   17    16 S   O    _OE1    17     1.22700   123.39294    -5.46902
   18    16 S   N    _N2_    18     1.38524   111.44164   174.67851
   19    18 S   H    _HN2    19     1.01556   118.79007     2.10515
   20    18 S   CT1  _CA2    20     1.46193   123.70760  -178.66851
   21    20 S   HC   _HA2    21     1.09718   109.39413   -10.39402
   22    20 S   C    _C2_    22     1.53475   108.63952  -126.14568
   23    22 S   O    _O2_    23     1.23024   122.21165  -150.77919
   24    20 S   CT   _CB2    32     1.53396   111.00147   111.74199
   25    24 S   HC   HB21    33     1.09305   109.06883    55.66030
   26    24 S   HC   HB22    34     1.09513   110.65904   173.57807
   27    22 S   N    _N3_    24     1.38345   113.38850    36.74097
   28    27 S   H    _HN3    25     1.01603   119.08004    -3.36325
   29    24 S   S    _SG2    35     1.83495   111.28958   -67.68662
   30    27 S   CT   _CA3    26     1.45344   123.92241   176.13979
   31    30 S   HC   HA31    27     1.09510   106.92366   -94.35836
   32    30 S   HC   HA32    28     1.09394   109.30678    22.46368
   33    29 S   CT   _C27    36     1.85775   102.44947   140.67441
   34    30 S   CO3  _C3_    29     1.52954   113.58270   146.00863
   35    34 S   O2Z  _O31    30     1.26372   115.90038    20.29578
   36    34 S   O2Z  _O32    31     1.26410   114.54909  -159.88150
   37    33 S   CM   _C14    37     1.51793   110.94785    50.63390
   38    33 S   CT   _C32   110     1.53870   106.13329   171.52089
   39    38 S   HC   _H66   111     1.09657   111.76992    63.75319
   40    38 S   HC   _H67   112     1.09717   112.15641   -56.73544
   41    38 S   HC   _H68   113     1.09672   111.34197  -175.77015
   42    37 S   N    _N37    38     1.36818   108.57136  -118.38951
   43    42 S   H    _H79    39     1.01584   122.42160   179.92867
   44    37 S   CM   _C21    49     1.34342   127.09443    63.16049
   45    44 S   HC   _H50    50     1.08441   120.46233     0.35388
   46    42 S   C    _C16    40     1.37937   115.00034    -0.24147
   47    46 S   O    _O41    41     1.22220   126.28080   179.88809
   48    44 S   CD   _C13    51     1.47928   122.21108  -178.74243
   49    33 S   CT   _C26    42     1.56726   110.38970   -64.27270
   50    49 S   HC   _H53    43     1.09732   111.60247     4.65072
   51    48 S   CM   _C9_    52     1.47294   119.89615  -156.47764
   52    49 S   CM   _C22    44     1.50566   117.32236  -122.69268
   53    52 S   HC   _H51    45     1.08784   118.05382   -61.62794
   54    51 S   CM   _C8_    53     1.34295   101.49574  -179.54630
   55    51 S   CT   _C29   106     1.47901   126.49797     1.59176
   56    55 S   HC   _H57   107     1.09437   110.52782   -66.49945
   57    55 S   HC   _H58   108     1.09373   112.09436   173.23299
   58    55 S   HC   _H59   109     1.09469   110.57197    53.66095
   59    52 S   CM   _C17    46     1.33848   123.69914   119.40898
   60    59 S   HC   _H45    47     1.08479   120.56051   179.43664
   61    59 S   HC   _H46    48     1.08442   121.76834    -0.50319
   62    54 S   CM   _C11    54     1.45525   109.94120     0.58884
   63    54 S   CT   _C34    97     1.50054   126.28052   178.18339
   64    63 S   HC   _H71    98     1.09727   109.94198  -139.01512
   65    63 S   HC   _H72    99     1.09746   109.69251   -24.34787
   66    48 S   NI   _N34    55     1.29921   125.26298    25.68511
   67    62 S   CM   _C18    56     1.34432   127.49131  -178.57825
   68    67 S   HC   _H47    57     1.08575   120.19200     3.09136
   69    63 S   CT   _C36   100     1.52661   112.55339    97.34142
   70    69 S   HC   _H75   101     1.09772   109.63890   -55.53674
   71    69 S   HC   _H76   102     1.09666   110.23731    62.22487
   72    67 S   C5A  _C7_    58     1.42251   122.85934  -179.86294
   73    69 S   CO3  _C24   103     1.53254   114.35904  -176.66117
   74    73 S   O2Z  _O39   104     1.26180   116.62409   -10.37725
   75    73 S   O2Z  _O43   105     1.26504   114.19756   169.66956
   76    72 S   C5BC _C5_    59     1.38791   133.44040  -140.28888
   77    76 S   C5BC _C4_    60     1.44062   107.16696   179.95154
   78    76 S   CT   _C33    88     1.50138   126.42267     1.37487
   79    78 S   HC   _H69    89     1.09699   108.70396  -137.24549
   80    78 S   HC   _H70    90     1.09656   110.03203   -21.96235
   81    77 S   C5A  _C6_    61     1.38568   107.01235    -0.41212
   82    77 S   CT   _C28    84     1.48868   126.39135  -179.74821
   83    82 S   HC   _H54    85     1.09441   110.24954    81.21795
   84    82 S   HC   _H55    86     1.09465   111.45280  -158.56801
   85    82 S   HC   _H56    87     1.09428   111.01499   -38.96129
   86    78 S   CT   _C35    91     1.52606   113.00720   101.81429
   87    86 S   HC   _H73    92     1.09695   109.20829   172.45041
   88    86 S   HC   _H74    93     1.09635   110.81797    55.11698
   89    72 S   NA   _N35    62     1.37409   119.17347    41.72664
   90    89 S   H    _H77    63     1.01153   124.35337    -2.19098
   91    81 S   CM   _C19    64     1.41653   135.35982  -178.50485
   92    91 S   HC   _H48    65     1.08511   116.39581  -121.87747
   93    86 S   CO3  _C23    94     1.52997   112.59966   -68.46681
   94    93 S   O2Z  _O38    95     1.26356   114.89307   122.81818
   95    93 S   O2Z  _O42    96     1.26276   115.42342   -58.39676
   96    91 S   CM   _C12    66     1.34220   123.09641    61.77952
   97    96 S   CM   _C10    67     1.45515   128.16003   178.55924
   98    97 S   CT   _C25    68     1.52085   107.65142  -164.30427
   99    98 S   HC   _H52    69     1.09592   111.05531  -128.31570
  100    97 S   CM   _C20    78     1.34442   130.55612    22.05406
  101   100 S   HC   _H49    79     1.08989   117.32536   178.30754
  102    98 S   C    _C15    70     1.51766   102.01997   -12.90941
  103   102 S   O    _O40    71     1.22198   125.42659  -172.06897
  104    98 S   CT   _C31    74     1.52235   112.93454   105.63689
  105   104 S   HC   _H63    75     1.09589   111.66984   -55.25492
  106   104 S   HC   _H64    76     1.09538   110.71897  -174.68961
  107   104 S   HC   _H65    77     1.09507   111.03996    65.36577
  108   100 S   CT   _C30    80     1.49281   128.70422     0.99347
  109   108 S   HC   _H60    81     1.09341   110.66487   -89.91786
  110   108 S   HC   _H61    82     1.09539   109.36248   151.36240
  111   108 S   HC   _H62    83     1.09295   112.44662    33.29071
  112    96 S   N    _N36    72     1.36844   124.47741     3.39009
  113   112 S   H    _H78    73     1.01329   123.44955    -6.56196
  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
  17   2   1   1  16   9   3   2   1   9   4   9   3   6   3  10
   6   3  12   4   3  16   6   2   1   1   2   1   1  10  10   5
   4   3   8   3   5   4   3  11   2   1   1  16  14  11   5   4
  11   5   2   1   1   5   4   3   4   1   8   3   2   1   1  11
  16  12   8   8   4   7   3   4   2   1   1   3   2   1   1   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    49    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    46    49    50    52    44    38    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    43    46    47    49    50    52    53    59    44    45    48    38    39    40    41  
   35    36  
   36  
    0  
   42    43    46    47    49    50    52    44    45    48    51    66    38    39    40    41  
   39    40    41    42    44    46    49    50    52  
   40    41    49  
   41    49  
   49  
   43    46    47    49    50    52    44    45    48  
   46    47    49    44  
   45    48    51    54    62    66    55    46    49  
   48    51    66  
   47    49    50    52    53    59  
   49    50    52  
   51    54    62    66    67    63    55    56    57    58  
   50    52    53    59    60    61  
   52    53    59  
   54    62    66    67    63    64    65    69    55    56    57    58  
   53    59    60    61  
   59    60    61  
   62    66    67    68    72    63    64    65    69    70    71    73    55    56    57    58  
   56    57    58    62    63    66  
   57    58  
   58  
    0  
   60    61  
   61  
    0  
   66    67    68    72    76    89    63    64    65    69  
   64    65    69    70    71    73    74    75    66    67  
   65    69    70    71    73  
   69    70    71    73  
   67    68    72  
   68    72    76    77    81    89    90    78  
   72    76    89  
   70    71    73    74    75  
   71    73    74    75  
   73    74    75  
   76    77    81    89    90    91    82    78    79    80    86  
   74    75  
   75  
    0  
   77    81    89    90    91    82    83    84    85    78    79    80    86    87    88    93  
   81    89    90    91    92    96    82    83    84    85    78    79    80    86  
   79    80    86    87    88    93    94    95    81    82    89  
   80    86    87    88    93  
   86    87    88    93  
   89    90    91    92    96    97   112    82    83    84    85  
   83    84    85    89    91  
   84    85  
   85  
    0  
   87    88    93    94    95  
   88    93    94    95  
   93    94    95  
   90    91    92    96  
   91  
   92    96    97    98   102   112   113   100  
   96    97   112  
   94    95  
   95  
    0  
   97    98    99   102   103   112   113   104   100   101   108  
   98    99   102   103   112   113   104   105   106   107   100   101   108   109   110   111  
   99   102   103   112   113   104   105   106   107   100   101   108  
  102   103   112   104   105   106   107   100  
  101   108   109   110   111   102   104   112  
  108   109   110   111  
  103   112   113   104   105   106   107  
  112   113   104  
  105   106   107   112  
  106   107  
  107  
    0  
  109   110   111  
  110   111  
  111  
    0  
  113  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   43   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   44   3.5500   0.0760  -0.118300   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   48   3.7500   0.1050   0.396300   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0760  -0.003300   2.0020   1.7750   0.023028004  -0.852763146
   52   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   67   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   72   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   73   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   76   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   77   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   78   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   82   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   90   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   91   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   92   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   93   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   94   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   95   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   96   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   97   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   98   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  101   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  102   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
  103   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  104   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
  113   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    49   268.000  1.529
   33    38   268.000  1.529
   37    42   400.000  1.384
   37    44   549.000  1.340
   42    43   434.000  1.010
   42    46   490.000  1.335
   46    47   570.000  1.229
   46    49   317.000  1.522
   49    50   340.000  1.090
   49    52   317.000  1.510
   52    53   340.000  1.080
   52    59   549.000  1.340
   59    60   340.000  1.080
   59    61   340.000  1.080
   44    45   340.000  1.080
   44    48   320.000  1.464
   48    51   320.000  1.464
   48    66   500.000  1.261
   51    54   549.000  1.340
   51    55   317.000  1.510
   54    62   380.000  1.444
   54    63   317.000  1.510
   62    66   405.000  1.380
   62    67   549.000  1.340
   67    68   340.000  1.080
   67    72   375.000  1.423
   72    76   546.000  1.367
   72    89   427.000  1.381
   76    77   469.000  1.424
   76    78   285.000  1.502
   77    81   546.000  1.367
   77    82   285.000  1.502
   81    89   427.000  1.381
   81    91   375.000  1.423
   89    90   434.000  1.010
   91    92   340.000  1.080
   91    96   549.000  1.340
   96    97   380.000  1.444
   96   112   400.000  1.384
   97    98   317.000  1.510
   97   100   549.000  1.340
   98    99   340.000  1.090
   98   102   317.000  1.522
   98   104   268.000  1.529
  102   103   570.000  1.229
  102   112   490.000  1.335
  112   113   434.000  1.010
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   340.000  1.090
  100   101   340.000  1.080
  100   108   317.000  1.510
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   111   340.000  1.090
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    93   317.000  1.522
   93    94   656.000  1.250
   93    95   656.000  1.250
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    73   317.000  1.522
   73    74   656.000  1.250
   73    75   656.000  1.250
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    49    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    42    70.00000  113.82800
   33    37    44    70.00000  124.00000
   33    49    46    63.00000  111.10000
   33    49    50    37.50000  110.70000
   33    49    52    70.00000  112.02700
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   37    42    43    45.00000  117.55000
   37    42    46    70.00000  120.89900
   37    44    45    35.00000  120.00000
   37    44    48    60.00000  120.31500
   42    46    47    80.00000  122.90000
   42    46    49    70.00000  116.60000
   46    42    43    35.00000  119.80000
   46    49    50    35.00000  109.50000
   46    49    52    70.00000  115.00700
   49    33    37    70.00000  112.02700
   49    46    47    80.00000  120.40000
   49    52    53    35.00000  117.00000
   49    52    59    70.00000  124.00000
   52    49    50    35.00000  109.50000
   52    59    60    35.00000  120.00000
   52    59    61    35.00000  120.00000
   59    52    53    35.00000  120.00000
   61    59    60    35.00000  117.00000
   44    37    42    75.00000  120.83300
   44    48    51    65.00000  123.36000
   44    48    66    70.00000  121.86000
   48    44    45    40.00000  114.85300
   48    51    54    60.00000  120.31500
   48    51    55    65.00000  117.22000
   48    66    62    75.00000  115.77100
   51    54    62    70.00000  123.01800
   51    54    63    70.00000  124.00000
   51    55    56    35.00000  109.50000
   51    55    57    35.00000  109.50000
   51    55    58    35.00000  109.50000
   54    62    66    70.00000  120.83400
   54    62    67    70.00000  123.01800
   54    63    64    35.00000  109.50000
   54    63    65    35.00000  109.50000
   54    63    69    70.00000  112.02700
   62    67    68    35.00000  120.00000
   62    67    72    55.00000  128.24000
   66    48    51    70.00000  121.86000
   67    62    66    70.00000  120.83400
   67    72    76    50.00000  133.16000
   67    72    89    70.00000  120.38000
   72    67    68    40.00000  117.26300
   72    76    77    70.00000  107.30000
   72    76    78    60.00000  130.00000
   72    89    81    70.00000  109.80000
   72    89    90    35.00000  120.00000
   76    77    81    70.00000  107.30000
   76    77    82    60.00000  130.00000
   76    78    79    35.00000  109.50000
   76    78    80    35.00000  109.50000
   76    78    86    70.00000  112.17500
   77    81    89    70.00000  107.70000
   77    81    91    50.00000  133.16000
   77    82    83    35.00000  109.50000
   77    82    84    35.00000  109.50000
   77    82    85    35.00000  109.50000
   81    89    90    35.00000  120.00000
   81    91    92    40.00000  117.26300
   81    91    96    55.00000  128.24000
   89    72    76    70.00000  107.70000
   91    81    89    70.00000  120.38000
   91    96    97    70.00000  123.01800
   91    96   112    75.00000  120.83300
   96    91    92    35.00000  120.00000
   96    97    98    70.00000  124.00000
   96    97   100    70.00000  123.01800
   96   112   102    70.00000  120.89900
   96   112   113    45.00000  117.55000
   97    98    99    35.00000  109.50000
   97    98   102    70.00000  115.00700
   97    98   104    70.00000  112.02700
   97   100   101    35.00000  120.00000
   97   100   108    70.00000  124.00000
   98   102   103    80.00000  120.40000
   98   102   112    70.00000  116.60000
   98   104   105    37.50000  110.70000
   98   104   106    37.50000  110.70000
   98   104   107    37.50000  110.70000
  102    98    99    35.00000  109.50000
  102   112   113    35.00000  119.80000
  112    96    97    75.00000  120.83300
  112   102   103    80.00000  122.90000
  104    98    99    37.50000  110.70000
  104    98   102    63.00000  111.10000
  106   104   105    33.00000  107.80000
  107   104   105    33.00000  107.80000
  107   104   106    33.00000  107.80000
  100    97    98    70.00000  124.00000
  100   108   109    35.00000  109.50000
  100   108   110    35.00000  109.50000
  100   108   111    35.00000  109.50000
  108   100   101    35.00000  117.00000
  110   108   109    33.00000  107.80000
  111   108   109    33.00000  107.80000
  111   108   110    33.00000  107.80000
   82    77    81    60.00000  130.00000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   78    76    77    60.00000  130.00000
   78    86    87    37.50000  110.70000
   78    86    88    37.50000  110.70000
   78    86    93    70.00000  109.69300
   80    78    79    33.00000  107.80000
   86    78    79    37.50000  110.70000
   86    78    80    37.50000  110.70000
   86    93    94    70.00000  117.00000
   86    93    95    70.00000  117.00000
   88    86    87    33.00000  107.80000
   93    86    87    35.00000  109.50000
   93    86    88    35.00000  109.50000
   95    93    94    80.00000  126.00000
   63    54    62    70.00000  124.00000
   63    69    70    37.50000  110.70000
   63    69    71    37.50000  110.70000
   63    69    73    70.00000  109.69300
   65    63    64    33.00000  107.80000
   69    63    64    37.50000  110.70000
   69    63    65    37.50000  110.70000
   69    73    74    70.00000  117.00000
   69    73    75    70.00000  117.00000
   71    69    70    33.00000  107.80000
   73    69    70    35.00000  109.50000
   73    69    71    35.00000  109.50000
   75    73    74    80.00000  126.00000
   55    51    54    70.00000  124.00000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    49    58.35000  112.70000
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    42   0.09700  1.0 1.0
   29    33    37    42   0.15600 -1.0 2.0
   29    33    37    42  -0.50800  1.0 3.0
   29    33    37    44   0.42700  1.0 1.0
   29    33    37    44  -0.70350 -1.0 2.0
   29    33    37    44  -0.43150  1.0 3.0
   29    33    49    46   0.56750  1.0 1.0
   29    33    49    46  -0.07550 -1.0 2.0
   29    33    49    46   0.20000  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    52   0.56750  1.0 1.0
   29    33    49    52  -0.07550 -1.0 2.0
   29    33    49    52   0.20000  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.15000  1.0 3.0
   33    37    42    43   2.40850 -1.0 2.0
   33    37   -42    46  -0.45200  1.0 1.0
   33    37   -42    46   0.85900 -1.0 2.0
   33    37   -42    46   0.16650  1.0 3.0
   33    37    44    45   7.00000 -1.0 2.0
   33    37    44    48   7.00000 -1.0 2.0
   33    49    52    53   0.00000  1.0 1.0
   33    49    52    59   0.09850  1.0 1.0
   33    49    52    59   0.15250 -1.0 2.0
   33    49    52    59  -0.50650  1.0 3.0
   37    33   -49    46  -0.98800  1.0 1.0
   37    33   -49    46   0.48800 -1.0 2.0
   37    33   -49    46   0.76800  1.0 3.0
   37    33    49    50   0.15000  1.0 3.0
   37    33    49    52   0.31000  1.0 1.0
   37    33    49    52   0.14700 -1.0 2.0
   37    33    49    52   0.07550  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    33    38    41   0.15000  1.0 3.0
   37    42    46    47   2.67200 -1.0 2.0
   37    42   -46    49   0.67100  1.0 1.0
   37    42   -46    49   1.42150 -1.0 2.0
   37    42   -46    49   0.18700  1.0 3.0
   37    44    48    51   0.69550 -1.0 2.0
   37    44    48    66   1.09650  1.0 1.0
   37    44    48    66   0.48950 -1.0 2.0
   37    44    48    66   0.49400  1.0 3.0
   42    37    44    45   7.00000 -1.0 2.0
   42    37    44    48   7.00000 -1.0 2.0
   42    46   -49    33   1.39750  1.0 1.0
   42    46   -49    33  -0.07950 -1.0 2.0
   42    46   -49    33  -0.18750  1.0 3.0
   42    46    49    50   0.00000  1.0 1.0
   42    46    49    52   0.00000  1.0 1.0
   43    42    46    47   2.45000 -1.0 2.0
   43    42    46    49   2.45000 -1.0 2.0
   46    49    52    53   0.00000  1.0 1.0
   46    49    52    59  -0.51250  1.0 1.0
   46    49    52    59  -0.88800 -1.0 2.0
   46    49    52    59   0.08850  1.0 3.0
   47    46    49    33   0.30150 -1.0 2.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    52   0.30150 -1.0 2.0
   49    33   -37    42  -0.93550  1.0 1.0
   49    33   -37    42   0.38900 -1.0 2.0
   49    33   -37    42   0.16950  1.0 3.0
   49    33    37    44   0.09850  1.0 1.0
   49    33    37    44   0.15250 -1.0 2.0
   49    33    37    44  -0.50650  1.0 3.0
   49    33    38    39   0.15000  1.0 3.0
   49    33    38    40   0.15000  1.0 3.0
   49    33    38    41   0.15000  1.0 3.0
   49    52    59    60   7.00000 -1.0 2.0
   49    52    59    61   7.00000 -1.0 2.0
   50    49    52    53   0.33100  1.0 3.0
   50    49    52    59   0.00000  1.0 1.0
   53    52    59    60   7.00000 -1.0 2.0
   53    52    59    61   7.00000 -1.0 2.0
   44    37    42    43   0.78350 -1.0 2.0
   44    37    42    46  -0.18900  1.0 1.0
   44    37    42    46   1.70900 -1.0 2.0
   44    48    51    54   0.69550 -1.0 2.0
   44    48    51    55   7.00000 -1.0 2.0
   44    48    66    62   6.00000 -1.0 2.0
   45    44    48    51   0.00000  1.0 1.0
   45    44    48    66   1.00600 -1.0 2.0
   48    51   -54    62   7.00000 -1.0 2.0
   48    51    54    63   7.00000 -1.0 2.0
   48    51    55    56   0.00000  1.0 1.0
   48    51    55    57   0.00000  1.0 1.0
   48    51    55    58   0.00000  1.0 1.0
   51    48   -66    62   6.00000 -1.0 2.0
   51    54   -62    66  -0.18600  1.0 3.0
   51    54    62    67   0.28850  1.0 1.0
   51    54    62    67   2.61350 -1.0 2.0
   51    54    62    67   0.78400  1.0 3.0
   51    54    63    64   0.00000  1.0 1.0
   51    54    63    65   0.00000  1.0 1.0
   51    54    63    69   0.09850  1.0 1.0
   51    54    63    69   0.15250 -1.0 2.0
   51    54    63    69  -0.50650  1.0 3.0
   54    51    55    56   0.00000  1.0 1.0
   54    51    55    57   0.00000  1.0 1.0
   54    51    55    58   0.00000  1.0 1.0
   54    62   -66    48   1.00000 -1.0 2.0
   54    62    67    68   7.00000 -1.0 2.0
   54    62    67    72   7.00000 -1.0 2.0
   54    63    69    70   0.15000  1.0 3.0
   54    63    69    71   0.15000  1.0 3.0
   54    63    69    73  -0.98800  1.0 1.0
   54    63    69    73   0.48800 -1.0 2.0
   54    63    69    73   0.76800  1.0 3.0
   62    54    63    64   0.00000  1.0 1.0
   62    54    63    65   0.00000  1.0 1.0
   62    54    63    69   0.98200  1.0 1.0
   62    54    63    69  -0.11900 -1.0 2.0
   62    54    63    69   0.24250  1.0 3.0
   62    67    72    76   0.15800  1.0 1.0
   62    67    72    76   1.85350 -1.0 2.0
   62    67    72    76  -0.48700  1.0 3.0
   62    67    72    89   0.11450  1.0 1.0
   62    67    72    89   1.85100 -1.0 2.0
   62    67    72    89  -0.49050  1.0 3.0
   66    48   -51    54   1.09650  1.0 1.0
   66    48   -51    54   0.48950 -1.0 2.0
   66    48   -51    54   0.49400  1.0 3.0
   66    48    51    55   7.00000 -1.0 2.0
   66    62    67    68   7.00000 -1.0 2.0
   66    62    67    72   7.00000 -1.0 2.0
   67    62    66    48   1.00000 -1.0 2.0
   67    72    76    77   3.62500 -1.0 2.0
   67    72    76    78   3.62500 -1.0 2.0
   67    72    89    81   3.62500 -1.0 2.0
   67    72    89    90   2.00000 -1.0 2.0
   68    67    72    76   0.56550  1.0 3.0
   68    67    72    89   0.54250  1.0 3.0
   72    76   -77    81   3.62500 -1.0 2.0
   72    76    77    82   3.62500 -1.0 2.0
   72    76    78    79   0.00000  1.0 1.0
   72    76    78    80   0.00000  1.0 1.0
   72    76    78    86   0.04150 -1.0 2.0
   76    72   -89    81   3.62500 -1.0 2.0
   76    72    89    90   2.00000 -1.0 2.0
   76    77   -81    89   3.62500 -1.0 2.0
   76    77    81    91   3.62500 -1.0 2.0
   76    77    82    83   0.00000  1.0 1.0
   76    77    82    84   0.00000  1.0 1.0
   76    77    82    85   0.00000  1.0 1.0
   76    78    86    87   0.43200  1.0 3.0
   76    78    86    88   0.43200  1.0 3.0
   76    78    86    93  -2.95950  1.0 1.0
   76    78    86    93   0.02300  1.0 3.0
   77    76    78    79   0.00000  1.0 1.0
   77    76    78    80   0.00000  1.0 1.0
   77    76    78    86   0.04150 -1.0 2.0
   77    81   -89    72   3.62500 -1.0 2.0
   77    81    89    90   2.00000 -1.0 2.0
   77    81    91    92   0.56550  1.0 3.0
   77    81    91    96   0.15800  1.0 1.0
   77    81    91    96   1.85350 -1.0 2.0
   77    81    91    96  -0.48700  1.0 3.0
   81    77    82    83   0.00000  1.0 1.0
   81    77    82    84   0.00000  1.0 1.0
   81    77    82    85   0.00000  1.0 1.0
   81    91    96    97   7.00000 -1.0 2.0
   81    91    96   112   7.00000 -1.0 2.0
   89    72   -76    77   3.62500 -1.0 2.0
   89    72    76    78   3.62500 -1.0 2.0
   89    81    91    92   0.54250  1.0 3.0
   89    81    91    96   0.11450  1.0 1.0
   89    81    91    96   1.85100 -1.0 2.0
   89    81    91    96  -0.49050  1.0 3.0
   91    81    89    72   3.62500 -1.0 2.0
   91    81    89    90   2.00000 -1.0 2.0
   91    96    97    98  -0.18600  1.0 3.0
   91    96    97   100   0.28850  1.0 1.0
   91    96    97   100   2.61350 -1.0 2.0
   91    96    97   100   0.78400  1.0 3.0
   91    96   112   102  -0.18900  1.0 1.0
   91    96   112   102   1.70900 -1.0 2.0
   91    96   112   113   0.78350 -1.0 2.0
   92    91    96    97   7.00000 -1.0 2.0
   92    91    96   112   7.00000 -1.0 2.0
   96    97    98    99   0.00000  1.0 1.0
   96    97   -98   102  -0.51250  1.0 1.0
   96    97   -98   102  -0.88800 -1.0 2.0
   96    97   -98   102   0.08850  1.0 3.0
   96    97    98   104   0.98200  1.0 1.0
   96    97    98   104  -0.11900 -1.0 2.0
   96    97    98   104   0.24250  1.0 3.0
   96    97   100   101   7.00000 -1.0 2.0
   96    97   100   108   7.00000 -1.0 2.0
   97    96  -112   102  -0.18900  1.0 1.0
   97    96  -112   102   1.70900 -1.0 2.0
   97    96   112   113   0.78350 -1.0 2.0
   97    98   102   103   0.30150 -1.0 2.0
   97    98  -102   112   0.00000  1.0 1.0
   97    98   104   105   0.15000  1.0 3.0
   97    98   104   106   0.15000  1.0 3.0
   97    98   104   107   0.15000  1.0 3.0
   97   100   108   109   0.00000  1.0 1.0
   97   100   108   110   0.00000  1.0 1.0
   97   100   108   111   0.00000  1.0 1.0
   98    97   100   101   7.00000 -1.0 2.0
   98    97   100   108   7.00000 -1.0 2.0
   98   102  -112    96   0.67100  1.0 1.0
   98   102  -112    96   1.42150 -1.0 2.0
   98   102  -112    96   0.18700  1.0 3.0
   98   102   112   113   2.45000 -1.0 2.0
   99    98   102   103   0.00000  1.0 1.0
   99    98   102   112   0.00000  1.0 1.0
   99    98   104   105   0.15000  1.0 3.0
   99    98   104   106   0.15000  1.0 3.0
   99    98   104   107   0.15000  1.0 3.0
  102    98   104   105  -0.11250  1.0 3.0
  102    98   104   106  -0.11250  1.0 3.0
  102    98   104   107  -0.11250  1.0 3.0
  103   102   112    96   2.67200 -1.0 2.0
  103   102   112   113   2.45000 -1.0 2.0
  112    96   -97    98   1.08500 -1.0 2.0
  112    96    97   100  -0.18600  1.0 3.0
  104    98   102   103   0.30150 -1.0 2.0
  104    98   102   112   1.39750  1.0 1.0
  104    98   102   112  -0.07950 -1.0 2.0
  104    98   102   112  -0.18750  1.0 3.0
  100    97    98    99   0.00000  1.0 1.0
  100    97    98   102  -0.51250  1.0 1.0
  100    97    98   102  -0.88800 -1.0 2.0
  100    97    98   102   0.08850  1.0 3.0
  100    97    98   104   0.09850  1.0 1.0
  100    97    98   104   0.15250 -1.0 2.0
  100    97    98   104  -0.50650  1.0 3.0
  101   100   108   109   0.33100  1.0 3.0
  101   100   108   110   0.33100  1.0 3.0
  101   100   108   111   0.33100  1.0 3.0
   82    77    81    89   3.62500 -1.0 2.0
   82    77    81    91   3.62500 -1.0 2.0
   78    76    77    81   3.62500 -1.0 2.0
   78    76    77    82   3.62500 -1.0 2.0
   78    86    93    94   0.41150 -1.0 2.0
   78    86    93    95   0.41150 -1.0 2.0
   79    78    86    87   0.15000  1.0 3.0
   79    78    86    88   0.15000  1.0 3.0
   79    78    86    93  -0.11250  1.0 3.0
   80    78    86    87   0.15000  1.0 3.0
   80    78    86    88   0.15000  1.0 3.0
   80    78    86    93  -0.11250  1.0 3.0
   87    86    93    94   0.00000  1.0 1.0
   87    86    93    95   0.00000  1.0 1.0
   88    86    93    94   0.00000  1.0 1.0
   88    86    93    95   0.00000  1.0 1.0
   63    54    62    66   1.08500 -1.0 2.0
   63    54    62    67  -0.18600  1.0 3.0
   63    69    73    74   0.41150 -1.0 2.0
   63    69    73    75   0.41150 -1.0 2.0
   64    63    69    70   0.15000  1.0 3.0
   64    63    69    71   0.15000  1.0 3.0
   64    63    69    73  -0.11250  1.0 3.0
   65    63    69    70   0.15000  1.0 3.0
   65    63    69    71   0.15000  1.0 3.0
   65    63    69    73  -0.11250  1.0 3.0
   70    69    73    74   0.00000  1.0 1.0
   70    69    73    75   0.00000  1.0 1.0
   71    69    73    74   0.00000  1.0 1.0
   71    69    73    75   0.00000  1.0 1.0
   55    51    54    62   7.00000 -1.0 2.0
   55    51    54    63   7.00000 -1.0 2.0
   38    33    37    42  -0.93550  1.0 1.0
   38    33    37    42   0.38900 -1.0 2.0
   38    33    37    42   0.16950  1.0 3.0
   38    33    37    44   0.09850  1.0 1.0
   38    33    37    44   0.15250 -1.0 2.0
   38    33    37    44  -0.50650  1.0 3.0
   38    33    49    46  -0.95700  1.0 1.0
   38    33    49    46  -0.18200 -1.0 2.0
   38    33    49    46   0.29450  1.0 3.0
   38    33    49    50   0.15000  1.0 3.0
   38    33    49    52   0.34400  1.0 1.0
   38    33    49    52   0.09450 -1.0 2.0
   38    33    49    52   0.11100  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    44   1.10000 -1.0 2.0
   43    46    42    37   1.00000 -1.0 2.0
   42    49    46    47  10.50000 -1.0 2.0
   49    53    52    59  15.00000 -1.0 2.0
   60    61    59    52  15.00000 -1.0 2.0
   48    45    44    37   1.10000 -1.0 2.0
   44    51    48    66  10.50000 -1.0 2.0
   48    55    51    54   1.10000 -1.0 2.0
   62    63    54    51   1.10000 -1.0 2.0
   54    66    62    67   1.10000 -1.0 2.0
   72    68    67    62   1.10000 -1.0 2.0
   76    89    72    67   4.00000 -1.0 2.0
   77    78    76    72   4.00000 -1.0 2.0
   81    82    77    76   4.00000 -1.0 2.0
   91    89    81    77   4.00000 -1.0 2.0
   90    72    89    81   1.00000 -1.0 2.0
   81    92    91    96   1.10000 -1.0 2.0
   97   112    96    91   1.10000 -1.0 2.0
   96    98    97   100   1.10000 -1.0 2.0
   98   112   102   103  10.50000 -1.0 2.0
  113   102   112    96   1.00000 -1.0 2.0
  108   101   100    97   1.10000 -1.0 2.0
   94    86    93    95  10.50000 -1.0 2.0
   74    69    73    75  10.50000 -1.0 2.0
END
