* LIGAND DATABASE FILE (OPLS2005)
*
001     102   103    185    278     534
    1     0 S   NP   _N1_     1    29.00711    93.54311   -18.66371
    2     1 S   H    _HN1     2     1.02953   104.29981    21.48682
    3     1 S   H    _H1_     3     1.02839    40.22555   121.18708
    4     1 S   H    _H2_     4     1.02779    70.97326   -83.27599
    5     1 S   CT   _CA1     5     1.50103   141.22065   174.65713
    6     5 S   HC   _HA1     6     1.09560   105.34856    25.61175
    7     5 S   CO3  _C1_     7     1.53901   112.11896   -94.88725
    8     7 S   O2Z  _O11     8     1.26377   115.05330   -48.32096
    9     7 S   O2Z  _O12     9     1.26237   114.88518   130.79522
   10     5 S   CT   _CB1    10     1.53022   107.42257   143.68236
   11    10 S   HC   HB11    11     1.09817   109.76372   -48.85590
   12    10 S   HC   HB12    12     1.09760   110.13439    67.72733
   13    10 S   CT   _CG1    13     1.53040   112.73322  -170.10252
   14    13 S   HC   HG11    14     1.09581   110.34800   -54.93060
   15    13 S   HC   HG12    15     1.09585   110.34629    64.40606
   16    13 S   C    _CD1    16     1.51730   111.60712  -175.23441
   17    16 S   O    _OE1    17     1.22757   123.06909   -16.08131
   18    16 S   N    _N2_    18     1.38605   111.93324   163.86975
   19    18 S   H    _HN2    19     1.01568   119.28770     4.37376
   20    18 S   CT1  _CA2    20     1.46193   122.91768  -172.47705
   21    20 S   HC   _HA2    21     1.09731   109.31442   -10.91421
   22    20 S   C    _C2_    22     1.53279   108.85247  -127.01997
   23    22 S   O    _O2_    23     1.23023   122.15727  -146.22383
   24    20 S   CT   _CB2    32     1.53786   111.35220   110.45346
   25    24 S   HC   HB21    33     1.09512   109.13819    61.46659
   26    24 S   HC   HB22    34     1.09391   109.68713  -179.69868
   27    22 S   N    _N3_    24     1.38477   113.40688    41.14303
   28    27 S   H    _HN3    25     1.01529   118.91446    -0.53266
   29    24 S   S    _SG2    35     1.82902   111.33797   -58.58641
   30    27 S   CT   _CA3    26     1.45440   123.36713   175.09511
   31    30 S   HC   HA31    27     1.09530   109.13783    26.30081
   32    30 S   HC   HA32    28     1.09493   107.15002   143.28716
   33    29 S   CT   _C16    36     1.87541   103.38359  -174.69308
   34    30 S   CO3  _C3_    29     1.52931   113.17411   -97.10574
   35    34 S   O2Z  _O31    30     1.26397   115.42746   -44.21587
   36    34 S   O2Z  _O32    31     1.26360   114.96966   136.72679
   37    33 S   CT   _C15    37     1.54825   111.10702   -38.20450
   38    37 S   HC   _H18    38     1.09693   110.61293    67.65486
   39    37 S   HC   _H19    39     1.09486   110.91388   -49.90952
   40    33 S   CT   _C17    98     1.56135   105.32448    78.77908
   41    40 S   HC   _H20    99     1.09572   111.53516   -58.29152
   42    40 S   HC   _H21   100     1.09274   111.46154  -176.98585
   43    37 S   CT   _C14    40     1.52585   113.74620  -171.89107
   44    43 S   HC   _H16    41     1.09760   109.42476   177.22561
   45    43 S   HC   _H17    42     1.09635   111.11491   -67.45938
   46    40 S   OH   _O34   101     1.42460   112.23700    63.00930
   47    46 S   HO   _H22   102     0.97234   107.08024   179.86152
   48    43 S   CT   _C13    43     1.52163   111.35011    56.32809
   49    48 S   HC   _H6_    44     1.09330   107.86420    65.27808
   50    48 S   CT   _C12    45     1.53786   111.99802   -57.17046
   51    50 S   HC   _H5_    46     1.09661   107.85476   175.93634
   52    48 S   OS   _O35    76     1.44655   107.35456  -178.27603
   53    33 S   CT   _C11    47     1.58745   109.23630  -162.10641
   54    53 S   HC   _H4_    48     1.09262   104.61947   -78.32992
   55    50 S   OS   _O39    71     1.44000   107.41877   -68.26756
   56    52 S   CO4  _C18    77     1.35639   117.43422  -157.13831
   57    56 S   O    _O36    78     1.22339   126.48586     1.45508
   58    53 S   C3T  _C9_    49     1.54552   116.98144    36.82181
   59    55 S   CT   _C28    72     1.42178   113.27679  -148.17994
   60    59 S   HC   _H31    73     1.09327   108.16806  -177.94395
   61    59 S   HC   _H32    74     1.09422   110.23370    63.69090
   62    59 S   HC   _H33    75     1.09303   111.39064   -58.80673
   63    56 S   CM   _C19    79     1.48007   111.73265  -178.59027
   64    63 S   HC   _H23    80     1.08642   114.92572  -178.15411
   65    58 S   C3T  _C8_    50     1.54300   121.23721  -106.11345
   66    65 S   HC   _H3_    51     1.08471   117.83246   155.32792
   67    58 S   CT   _C10    67     1.50480   120.03719    56.98060
   68    67 S   HC   _H13    68     1.09664   111.06629  -175.04275
   69    67 S   HC   _H14    69     1.09140   111.36672    66.73575
   70    67 S   HC   _H15    70     1.09026   112.42211   -56.18696
   71    63 S   CM   _C20    81     1.34086   124.10936     2.20975
   72    71 S   HC   _H24    82     1.08697   120.82951    -0.07662
   73    58 S   O3T  _O33    52     1.44428   112.57128  -170.15310
   74    65 S   CT   _C7_    53     1.49773   127.58601    -3.23422
   75    74 S   HC   _H11    54     1.09667   108.09466  -143.46253
   76    74 S   HC   _H12    55     1.09595   111.62431   -29.79825
   77    71 S   CM   _C21    83     1.44754   122.62263   179.80719
   78    77 S   HC   _H25    84     1.08795   117.08490     0.07913
   79    74 S   CM   _C6_    56     1.50198   114.60243    93.53363
   80    79 S   HC   _H10    57     1.08871   114.43127   -90.84674
   81    77 S   CM   _C22    85     1.34175   122.99697  -179.91377
   82    81 S   HC   _H26    86     1.08787   120.01175    -0.02798
   83    79 S   CM   _C5_    58     1.34666   127.23918    91.44669
   84    81 S   CM   _C23    87     1.44690   122.99154   179.97202
   85    84 S   HC   _H27    88     1.08786   117.08353     0.00000
   86    83 S   CT   _C4_    59     1.50486   120.59633   178.08133
   87    86 S   HC   _H7_    60     1.09467   110.34870   121.68792
   88    86 S   HC   _H8_    61     1.09490   110.15864  -118.61154
   89    86 S   HC   _H9_    62     1.09511   112.39659     1.55771
   90    83 S   CT   _C29    63     1.50272   124.78620    -2.46839
   91    90 S   HC   _H34    64     1.09479   110.07593   114.36530
   92    90 S   HC   _H35    65     1.09504   110.16079  -126.30709
   93    90 S   HC   _H36    66     1.09266   113.36518    -6.61767
   94    84 S   CM   _C24    89     1.34173   123.00531  -179.98022
   95    94 S   HC   _H28    90     1.08776   120.02260     0.01978
   96    94 S   CM   _C25    91     1.44711   122.99993   179.98022
   97    96 S   HC   _H29    92     1.08725   116.86256    -0.02798
   98    96 S   CM   _C26    93     1.34036   122.85435   179.98022
   99    98 S   HC   _H30    94     1.08918   119.86723    -0.00000
  100    98 S   CO3  _C27    95     1.53472   121.83667  -180.00000
  101   100 S   O2Z  _O38    96     1.26258   116.96161    -0.00000
  102   100 S   O2Z  _O37    97     1.26612   113.88904   180.00000
  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  13   5   4   3
  21   2   1   1  16   7   6   9   4   3  10   5   4   2   1  12
   6  14   6   7  12   5   5   6   3  11   3   2   1   1   6   3
  12   6   5   3   2   1   6   3   4   7   4   3   6   3  10   3
   6   3   8   6   3   7   3   2   1   3   2   1   1   6   3   6
   3   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    53    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    43    50    53    54    58    40    41    42    46  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    44    45    48    50    51    53    54    58    65    73    67    55    40    41    42    46    47  
   35    36  
   36  
    0  
   38    39    43    44    45    48    49    50    53    54    58    52    40    41    42    46  
   39    43    44    45    48    53    40  
   43    44    45    48    53    40  
   41    42    46    47    43    50    53    54    58  
   42    46    47    53  
   46    47    53  
   44    45    48    49    50    51    53    55    52    56  
   45    48    49    50    52  
   48    49    50    52  
   47    53  
    0  
   49    50    51    53    54    58    55    59    52    56    57    63  
   50    51    53    55    52    56  
   51    53    54    58    65    73    67    55    59    60    61    62    52    56  
   53    54    58    55    59    52  
   56    57    63    64    71    53    55  
   54    58    65    66    73    74    67    68    69    70    55    59  
   58    65    73    67    55  
   59    60    61    62    58  
   57    63    64    71    72    77  
   63    64    71  
   65    66    73    74    75    76    79    67    68    69    70  
   60    61    62  
   61    62  
   62  
    0  
   64    71    72    77    78    81  
   71    72    77  
   66    73    74    75    76    79    80    83    67    68    69    70  
   73    74    75    76    79    67  
   68    69    70    73    74  
   69    70    73  
   70    73  
   73  
   72    77    78    81    82    84  
   77    78    81  
   74    75    76    79  
   75    76    79    80    83    86    90  
   76    79    80    83  
   79    80    83  
   78    81    82    84    85    94  
   81    82    84  
   80    83    86    87    88    89    90    91    92    93  
   83    86    90  
   82    84    85    94    95    96  
   84    85    94  
   86    87    88    89    90    91    92    93  
   85    94    95    96    97    98  
   94    95    96  
   87    88    89    90    91    92    93  
   88    89    90  
   89    90  
   90  
   91    92    93  
   92    93  
   93  
    0  
   95    96    97    98    99   100  
   96    97    98  
   97    98    99   100   101   102  
   98    99   100  
   99   100   101   102  
  100   101   102  
  101   102  
  102  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   56   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   58   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
   59   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.116200   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   72   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   73   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   74   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   78   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   80   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   82   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   84   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   85   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   95   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   97   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5500   0.0760  -0.425300   2.0020   1.7750   0.023028004  -0.852763146
   99   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  100   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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   268.000  1.529
   33    53   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    43   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    48   268.000  1.529
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    52   320.000  1.410
   50    51   340.000  1.090
   50    53   268.000  1.529
   50    55   320.000  1.410
   53    54   340.000  1.090
   53    58   275.000  1.510
   58    65   260.000  1.509
   58    73   335.000  1.432
   58    67   275.000  1.510
   65    66   340.000  1.088
   65    73   335.000  1.432
   65    74   275.000  1.510
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    79   317.000  1.510
   79    80   340.000  1.080
   79    83   549.000  1.340
   83    86   317.000  1.510
   83    90   317.000  1.510
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   55    59   320.000  1.410
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   52    56   214.000  1.327
   56    57   570.000  1.229
   56    63   320.000  1.462
   63    64   340.000  1.080
   63    71   549.000  1.340
   71    72   340.000  1.080
   71    77   380.000  1.444
   77    78   340.000  1.080
   77    81   549.000  1.340
   81    82   340.000  1.080
   81    84   380.000  1.444
   84    85   340.000  1.080
   84    94   549.000  1.340
   94    95   340.000  1.080
   94    96   380.000  1.444
   96    97   340.000  1.080
   96    98   549.000  1.340
   98    99   340.000  1.080
   98   100   230.000  1.545
  100   101   656.000  1.250
  100   102   656.000  1.250
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    46   320.000  1.410
   46    47   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    53    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    43    58.35000  112.70000
   33    53    50    58.35000  112.70000
   33    53    54    37.50000  110.70000
   33    53    58    70.00000  112.37300
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    46    50.00000  109.50000
   37    43    44    37.50000  110.70000
   37    43    45    37.50000  110.70000
   37    43    48    58.35000  112.70000
   39    37    38    33.00000  107.80000
   43    37    38    37.50000  110.70000
   43    37    39    37.50000  110.70000
   43    48    49    37.50000  110.70000
   43    48    50    58.35000  112.70000
   43    48    52    50.00000  109.50000
   45    43    44    33.00000  107.80000
   48    43    44    37.50000  110.70000
   48    43    45    37.50000  110.70000
   48    50    51    37.50000  110.70000
   48    50    53    58.35000  112.70000
   48    50    55    50.00000  109.50000
   48    52    56    83.00000  116.90000
   50    48    49    37.50000  110.70000
   50    53    54    37.50000  110.70000
   50    53    58    70.00000  112.37300
   50    55    59    60.00000  109.50000
   53    33    37    58.35000  112.70000
   53    50    51    37.50000  110.70000
   53    58    65    60.00000  120.94000
   53    58    73    80.00000  116.47100
   53    58    67    58.35000  112.70000
   58    53    54    45.00000  109.38400
   58    65    66    37.50000  117.20000
   58    65    73    15.00000   60.43100
   58    65    74    60.00000  120.94000
   58    73    65    15.00000   59.14900
   58    67    68    45.00000  109.38400
   58    67    69    45.00000  109.38400
   58    67    70    45.00000  109.38400
   65    74    75    45.00000  109.38400
   65    74    76    45.00000  109.38400
   65    74    79    70.00000  112.02700
   73    58    65    15.00000   60.43100
   73    65    66    50.00000  114.27700
   74    65    66    40.00000  115.04500
   74    65    73    80.00000  116.47100
   74    79    80    35.00000  117.00000
   74    79    83    70.00000  124.00000
   76    74    75    33.00000  107.80000
   79    74    75    35.00000  109.50000
   79    74    76    35.00000  109.50000
   79    83    86    70.00000  124.00000
   79    83    90    70.00000  124.00000
   83    79    80    35.00000  120.00000
   83    86    87    35.00000  109.50000
   83    86    88    35.00000  109.50000
   83    86    89    35.00000  109.50000
   83    90    91    35.00000  109.50000
   83    90    92    35.00000  109.50000
   83    90    93    35.00000  109.50000
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   90    83    86    65.00000  117.92700
   92    90    91    33.00000  107.80000
   93    90    91    33.00000  107.80000
   93    90    92    33.00000  107.80000
   67    58    65    60.00000  120.94000
   67    58    73    80.00000  116.47100
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   55    50    51    35.00000  109.50000
   55    50    53    50.00000  109.50000
   55    59    60    35.00000  109.50000
   55    59    61    35.00000  109.50000
   55    59    62    35.00000  109.50000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   52    48    49    35.00000  109.50000
   52    48    50    50.00000  109.50000
   52    56    57    83.00000  123.40000
   52    56    63    90.00000  111.29400
   56    63    64    40.00000  117.72500
   56    63    71    65.00000  118.96000
   63    56    57    80.00000  123.72100
   63    71    72    35.00000  120.00000
   63    71    77    70.00000  123.01800
   71    63    64    35.00000  120.00000
   71    77    78    35.00000  120.00000
   71    77    81    70.00000  123.01800
   77    71    72    35.00000  120.00000
   77    81    82    35.00000  120.00000
   77    81    84    70.00000  123.01800
   81    77    78    35.00000  120.00000
   81    84    85    35.00000  120.00000
   81    84    94    70.00000  123.01800
   84    81    82    35.00000  120.00000
   84    94    95    35.00000  120.00000
   84    94    96    70.00000  123.01800
   94    84    85    35.00000  120.00000
   94    96    97    35.00000  120.00000
   94    96    98    70.00000  123.01800
   96    94    95    35.00000  120.00000
   96    98    99    35.00000  120.00000
   96    98   100    55.00000  124.75400
   98    96    97    35.00000  120.00000
   98   100   101    85.00000  113.83300
   98   100   102    85.00000  113.83300
  100    98    99    40.00000  118.53000
  102   100   101    80.00000  126.00000
   40    33    37    58.35000  112.70000
   40    33    53    58.35000  112.70000
   40    46    47    55.00000  108.50000
   42    40    41    33.00000  107.80000
   46    40    41    35.00000  109.50000
   46    40    42    35.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    53   0.01700  1.0 1.0
   24    29    33    53  -0.23550 -1.0 2.0
   24    29    33    53   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    43   0.44750  1.0 1.0
   29    33    37    43  -0.17800 -1.0 2.0
   29    33    37    43   0.20200  1.0 3.0
   29    33    53    50   0.44750  1.0 1.0
   29    33    53    50  -0.17800 -1.0 2.0
   29    33    53    50   0.20200  1.0 3.0
   29    33    53    54   0.15000  1.0 3.0
   29    33    53    58   0.44750  1.0 1.0
   29    33    53    58  -0.17800 -1.0 2.0
   29    33    53    58   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    46   0.56750  1.0 1.0
   29    33    40    46  -0.07550 -1.0 2.0
   29    33    40    46   0.20000  1.0 3.0
   33    37    43    44   0.15000  1.0 3.0
   33    37    43    45   0.15000  1.0 3.0
   33    37    43    48   0.56750  1.0 1.0
   33    37    43    48  -0.07550 -1.0 2.0
   33    37    43    48   0.20000  1.0 3.0
   33    53    58    65   0.07850  1.0 1.0
   33    53    58    65  -0.03950 -1.0 2.0
   33    53    58    65   0.67350  1.0 3.0
   33    53    58    73   0.02550  1.0 1.0
   33    53    58    73  -0.02600 -1.0 2.0
   33    53    58    73   1.20400  1.0 3.0
   33    53    58    67   0.56750  1.0 1.0
   33    53    58    67  -0.07550 -1.0 2.0
   33    53    58    67   0.20000  1.0 3.0
   33    40    46    47  -0.11600  1.0 1.0
   33    40    46    47  -0.09450 -1.0 2.0
   33    40    46    47   0.21250  1.0 3.0
   37    33    53    50   0.56750  1.0 1.0
   37    33    53    50  -0.07550 -1.0 2.0
   37    33    53    50   0.20000  1.0 3.0
   37    33    53    54   0.15000  1.0 3.0
   37    33    53    58   0.47050  1.0 1.0
   37    33    53    58   0.03900 -1.0 2.0
   37    33    53    58   0.20100  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    46   0.86500  1.0 1.0
   37    33    40    46  -0.17500 -1.0 2.0
   37    33    40    46   0.20800  1.0 3.0
   37    43    48    49   0.15000  1.0 3.0
   37    43   -48    50   0.56750  1.0 1.0
   37    43   -48    50  -0.07550 -1.0 2.0
   37    43   -48    50   0.20000  1.0 3.0
   37    43    48    52   0.62750  1.0 1.0
   37    43    48    52  -0.30950 -1.0 2.0
   37    43    48    52   0.27300  1.0 3.0
   38    37    43    44   0.15000  1.0 3.0
   38    37    43    45   0.15000  1.0 3.0
   38    37    43    48   0.15000  1.0 3.0
   39    37    43    44   0.15000  1.0 3.0
   39    37    43    45   0.15000  1.0 3.0
   39    37    43    48   0.15000  1.0 3.0
   43    48    50    51   0.15000  1.0 3.0
   43    48    50    53   0.56750  1.0 1.0
   43    48    50    53  -0.07550 -1.0 2.0
   43    48    50    53   0.20000  1.0 3.0
   43    48    50    55   0.62750  1.0 1.0
   43    48    50    55  -0.30950 -1.0 2.0
   43    48    50    55   0.27300  1.0 3.0
   43    48    52    56  -0.25900  1.0 1.0
   43    48    52    56  -0.47000 -1.0 2.0
   43    48    52    56   0.11750  1.0 3.0
   44    43    48    49   0.15000  1.0 3.0
   44    43    48    50   0.15000  1.0 3.0
   44    43    48    52   0.23400  1.0 3.0
   45    43    48    49   0.15000  1.0 3.0
   45    43    48    50   0.15000  1.0 3.0
   45    43    48    52   0.23400  1.0 3.0
   48    50   -53    33   0.56750  1.0 1.0
   48    50   -53    33  -0.07550 -1.0 2.0
   48    50   -53    33   0.20000  1.0 3.0
   48    50    53    54   0.15000  1.0 3.0
   48    50    53    58   0.47050  1.0 1.0
   48    50    53    58   0.03900 -1.0 2.0
   48    50    53    58   0.20100  1.0 3.0
   48    50    55    59   0.06250  1.0 1.0
   48    50    55    59  -0.01100 -1.0 2.0
   48    50    55    59   0.28050  1.0 3.0
   48    52    56    57   3.00000 -1.0 2.0
   48    52    56    63   2.00000 -1.0 2.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    53   0.15000  1.0 3.0
   49    48    50    55   0.23400  1.0 3.0
   49    48    52    56   0.08050  1.0 3.0
   50    48    52    56  -0.25900  1.0 1.0
   50    48    52    56  -0.47000 -1.0 2.0
   50    48    52    56   0.11750  1.0 3.0
   50    53    58    65   0.07850  1.0 1.0
   50    53    58    65  -0.03950 -1.0 2.0
   50    53    58    65   0.67350  1.0 3.0
   50    53    58    73   0.02550  1.0 1.0
   50    53    58    73  -0.02600 -1.0 2.0
   50    53    58    73   1.20400  1.0 3.0
   50    53    58    67   0.56750  1.0 1.0
   50    53    58    67  -0.07550 -1.0 2.0
   50    53    58    67   0.20000  1.0 3.0
   50    55    59    60   0.37050  1.0 3.0
   50    55    59    61   0.37050  1.0 3.0
   50    55    59    62   0.37050  1.0 3.0
   51    50    53    33   0.15000  1.0 3.0
   51    50    53    54   0.15000  1.0 3.0
   51    50    53    58   0.15000  1.0 3.0
   51    50    55    59   0.37050  1.0 3.0
   53    33    37    38   0.15000  1.0 3.0
   53    33    37    39   0.15000  1.0 3.0
   53    33   -37    43   0.56750  1.0 1.0
   53    33   -37    43  -0.07550 -1.0 2.0
   53    33   -37    43   0.20000  1.0 3.0
   53    33    40    41   0.15000  1.0 3.0
   53    33    40    42   0.15000  1.0 3.0
   53    33    40    46   0.86500  1.0 1.0
   53    33    40    46  -0.17500 -1.0 2.0
   53    33    40    46   0.20800  1.0 3.0
   53    50    55    59   0.06250  1.0 1.0
   53    50    55    59  -0.01100 -1.0 2.0
   53    50    55    59   0.28050  1.0 3.0
   53    58    65    66   0.15000  1.0 3.0
   53    58   -65    73   0.02550  1.0 1.0
   53    58   -65    73  -0.02600 -1.0 2.0
   53    58   -65    73   1.20400  1.0 3.0
   53    58    65    74   0.56750  1.0 1.0
   53    58    65    74  -0.07550 -1.0 2.0
   53    58    65    74   0.20000  1.0 3.0
   53    58   -73    65   0.06250  1.0 1.0
   53    58   -73    65  -0.01100 -1.0 2.0
   53    58   -73    65   0.28050  1.0 3.0
   53    58    67    68   0.15000  1.0 3.0
   53    58    67    69   0.15000  1.0 3.0
   53    58    67    70   0.15000  1.0 3.0
   54    53    58    65   0.15000  1.0 3.0
   54    53    58    73   0.23400  1.0 3.0
   54    53    58    67   0.15000  1.0 3.0
   58    65    74    75   0.15000  1.0 3.0
   58    65    74    76   0.15000  1.0 3.0
   58    65    74    79   0.34400  1.0 1.0
   58    65    74    79   0.09450 -1.0 2.0
   58    65    74    79   0.11100  1.0 3.0
   65    58    67    68   0.15000  1.0 3.0
   65    58    67    69   0.15000  1.0 3.0
   65    58    67    70   0.15000  1.0 3.0
   65    74    79    80   0.00000  1.0 1.0
   65    74    79    83   0.09850  1.0 1.0
   65    74    79    83   0.15250 -1.0 2.0
   65    74    79    83  -0.50650  1.0 3.0
   66    65   -73    58   0.36800  1.0 3.0
   66    65    74    75   0.15000  1.0 3.0
   66    65    74    76   0.15000  1.0 3.0
   66    65    74    79   0.15000  1.0 3.0
   73    58   -65    66   0.23400  1.0 3.0
   73    58   -65    74   0.02550  1.0 1.0
   73    58   -65    74  -0.02600 -1.0 2.0
   73    58   -65    74   1.20400  1.0 3.0
   73    58    67    68   0.23400  1.0 3.0
   73    58    67    69   0.23400  1.0 3.0
   73    58    67    70   0.23400  1.0 3.0
   73    65    74    75   0.23400  1.0 3.0
   73    65    74    76   0.23400  1.0 3.0
   73    65    74    79   0.61850  1.0 1.0
   73    65    74    79  -0.22750 -1.0 2.0
   73    65    74    79   0.15300  1.0 3.0
   74    65   -73    58   0.06250  1.0 1.0
   74    65   -73    58  -0.01100 -1.0 2.0
   74    65   -73    58   0.28050  1.0 3.0
   74    79    83    86   7.00000 -1.0 2.0
   74    79    83    90   7.00000 -1.0 2.0
   75    74    79    80   0.33100  1.0 3.0
   75    74    79    83   0.00000  1.0 1.0
   76    74    79    80   0.33100  1.0 3.0
   76    74    79    83   0.00000  1.0 1.0
   79    83    86    87   0.00000  1.0 1.0
   79    83    86    88   0.00000  1.0 1.0
   79    83    86    89   0.00000  1.0 1.0
   79    83    90    91   0.00000  1.0 1.0
   79    83    90    92   0.00000  1.0 1.0
   79    83    90    93   0.00000  1.0 1.0
   80    79    83    86   7.00000 -1.0 2.0
   80    79    83    90   7.00000 -1.0 2.0
   86    83    90    91   0.34800  1.0 3.0
   86    83    90    92   0.34800  1.0 3.0
   86    83    90    93   0.34800  1.0 3.0
   90    83    86    87   0.34800  1.0 3.0
   90    83    86    88   0.34800  1.0 3.0
   90    83    86    89   0.34800  1.0 3.0
   67    58    65    66   0.15000  1.0 3.0
   67    58   -65    73   0.02550  1.0 1.0
   67    58   -65    73  -0.02600 -1.0 2.0
   67    58   -65    73   1.20400  1.0 3.0
   67    58    65    74   0.56750  1.0 1.0
   67    58    65    74  -0.07550 -1.0 2.0
   67    58    65    74   0.20000  1.0 3.0
   67    58   -73    65   0.06250  1.0 1.0
   67    58   -73    65  -0.01100 -1.0 2.0
   67    58   -73    65   0.28050  1.0 3.0
   55    50    53    33   0.62750  1.0 1.0
   55    50    53    33  -0.30950 -1.0 2.0
   55    50    53    33   0.27300  1.0 3.0
   55    50    53    54   0.23400  1.0 3.0
   55    50    53    58  -0.26800  1.0 1.0
   55    50    53    58   0.69150 -1.0 2.0
   55    50    53    58  -0.48750  1.0 3.0
   52    48    50    51   0.23400  1.0 3.0
   52    48    50    53   0.62750  1.0 1.0
   52    48    50    53  -0.30950 -1.0 2.0
   52    48    50    53   0.27300  1.0 3.0
   52    48    50    55   1.11900  1.0 1.0
   52    48    50    55  -1.16350 -1.0 2.0
   52    48    50    55  -0.34150  1.0 3.0
   52    56    63    64   1.63100 -1.0 2.0
   52    56    63    71  -0.56150  1.0 1.0
   52    56    63    71   2.19150 -1.0 2.0
   56    63    71    72   7.00000 -1.0 2.0
   56    63    71    77   7.00000 -1.0 2.0
   57    56    63    64   0.00000  1.0 1.0
   57    56    63    71   1.00000 -1.0 2.0
   63    71    77    78  -0.18600  1.0 3.0
   63    71    77    81   0.28850  1.0 1.0
   63    71    77    81   2.61350 -1.0 2.0
   63    71    77    81   0.78400  1.0 3.0
   64    63    71    72   7.00000 -1.0 2.0
   64    63    71    77   7.00000 -1.0 2.0
   71    77    81    82   7.00000 -1.0 2.0
   71    77    81    84   7.00000 -1.0 2.0
   72    71    77    78   0.00000  1.0 1.0
   72    71    77    81  -0.18600  1.0 3.0
   77    81    84    85  -0.18600  1.0 3.0
   77    81    84    94   0.28850  1.0 1.0
   77    81    84    94   2.61350 -1.0 2.0
   77    81    84    94   0.78400  1.0 3.0
   78    77    81    82   7.00000 -1.0 2.0
   78    77    81    84   7.00000 -1.0 2.0
   81    84    94    95   7.00000 -1.0 2.0
   81    84    94    96   7.00000 -1.0 2.0
   82    81    84    85   0.00000  1.0 1.0
   82    81    84    94  -0.18600  1.0 3.0
   84    94    96    97  -0.18600  1.0 3.0
   84    94    96    98   0.28850  1.0 1.0
   84    94    96    98   2.61350 -1.0 2.0
   84    94    96    98   0.78400  1.0 3.0
   85    84    94    95   7.00000 -1.0 2.0
   85    84    94    96   7.00000 -1.0 2.0
   94    96    98    99   7.00000 -1.0 2.0
   94    96    98   100   7.00000 -1.0 2.0
   95    94    96    97   0.00000  1.0 1.0
   95    94    96    98  -0.18600  1.0 3.0
   96    98   100   101  -0.04000 -1.0 2.0
   96    98   100   101  -0.29050  1.0 3.0
   96    98   100   102  -0.04000 -1.0 2.0
   96    98   100   102  -0.29050  1.0 3.0
   97    96    98    99   7.00000 -1.0 2.0
   97    96    98   100   7.00000 -1.0 2.0
   99    98   100   101   0.00000  1.0 1.0
   99    98   100   102   0.00000  1.0 1.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    43   0.56750  1.0 1.0
   40    33    37    43  -0.07550 -1.0 2.0
   40    33    37    43   0.20000  1.0 3.0
   40    33    53    50   0.56750  1.0 1.0
   40    33    53    50  -0.07550 -1.0 2.0
   40    33    53    50   0.20000  1.0 3.0
   40    33    53    54   0.15000  1.0 3.0
   40    33    53    58   0.47050  1.0 1.0
   40    33    53    58   0.03900 -1.0 2.0
   40    33    53    58   0.20100  1.0 3.0
   41    40    46    47   0.19450  1.0 3.0
   42    40    46    47   0.19450  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   74    80    79    83  15.00000 -1.0 2.0
   86    90    83    79  15.00000 -1.0 2.0
   52    63    56    57  10.50000 -1.0 2.0
   56    64    63    71  15.00000 -1.0 2.0
   77    72    71    63  15.00000 -1.0 2.0
   71    78    77    81  15.00000 -1.0 2.0
   84    82    81    77  15.00000 -1.0 2.0
   81    85    84    94  15.00000 -1.0 2.0
   96    95    94    84  15.00000 -1.0 2.0
   94    97    96    98  15.00000 -1.0 2.0
  100    99    98    96  15.00000 -1.0 2.0
  101    98   100   102  10.50000 -1.0 2.0
END
