* LIGAND DATABASE FILE (OPLS2005)
*
001     112   115    202    316     580
    1     0 S   NP   _N1_     1    29.96814    97.99830   -16.18237
    2     1 S   H    _HN1     2     1.02841    58.71214   146.95498
    3     1 S   H    _H1_     3     1.02767    59.15272   -71.51970
    4     1 S   H    _H2_     4     1.02953    92.44817    38.46322
    5     1 S   CT   _CA1     5     1.49975   157.11213  -145.19026
    6     5 S   HC   _HA1     6     1.09484   105.13446     0.99071
    7     5 S   CO3  _C1_     7     1.53637   112.65195  -118.87833
    8     7 S   O2Z  _O11     8     1.26328   114.96264   -44.63631
    9     7 S   O2Z  _O12     9     1.26250   114.71041   134.68903
   10     5 S   CT   _CB1    10     1.53067   107.58529   118.56723
   11    10 S   HC   HB11    11     1.09804   108.96179   -55.25497
   12    10 S   HC   HB12    12     1.09805   110.63146    61.31205
   13    10 S   CT   _CG1    13     1.52822   112.44093  -176.57566
   14    13 S   HC   HG11    14     1.09478   110.21307   -68.89730
   15    13 S   HC   HG12    15     1.09219   109.91915    49.76528
   16    13 S   C    _CD1    16     1.51577   112.99208   169.90833
   17    16 S   O    _OE1    17     1.22696   123.27132    -3.37069
   18    16 S   N    _N2_    18     1.38583   111.42959   177.02224
   19    18 S   H    _HN2    19     1.01627   118.98369     0.19281
   20    18 S   CT1  _CA2    20     1.46256   123.54188  -178.75040
   21    20 S   HC   _HA2    21     1.09738   109.39313   -17.68341
   22    20 S   C    _C2_    22     1.53321   107.65077  -133.22271
   23    22 S   O    _O2_    23     1.22974   122.51724  -141.10841
   24    20 S   CT   _CB2    32     1.53503   111.25734   104.66458
   25    24 S   HC   HB21    33     1.09316   108.95315    53.24499
   26    24 S   HC   HB22    34     1.09503   110.60601   171.30200
   27    22 S   N    _N3_    24     1.38696   113.20750    46.28996
   28    27 S   H    _HN3    25     1.01534   119.07126     0.68557
   29    24 S   S    _SG2    35     1.83491   111.18906   -70.10645
   30    27 S   CT   _CA3    26     1.45398   122.77653   175.01367
   31    30 S   HC   HA31    27     1.09569   108.60845    34.54960
   32    30 S   HC   HA32    28     1.09441   107.14520   151.47071
   33    29 S   CT   _C24    36     1.84467   102.39100   144.39964
   34    30 S   CO3  _C3_    29     1.53081   114.66516   -88.04094
   35    34 S   O2Z  _O31    30     1.26278   116.48067   -14.20882
   36    34 S   O2Z  _O32    31     1.26543   114.23714   166.47575
   37    33 S   CM   _C25    37     1.53798   111.70138    54.01118
   38    33 S   CT   _C29   109     1.53677   108.74748   177.95684
   39    38 S   HC   _H23   110     1.09666   111.97633    61.25400
   40    38 S   HC   _H24   111     1.09627   112.06578   -59.36944
   41    38 S   HC   _H25   112     1.09730   111.15251  -179.13589
   42    37 S   CMA  _C26    38     1.35614   108.87105  -121.57284
   43    42 S   OM   _O34    39     1.25406   137.30425  -177.22117
   44    37 S   CM   _C27   104     1.44535   122.67233    61.59276
   45    44 S   HC   _H20   105     1.08591   116.67184    39.09605
   46    42 S   NE   _N7_    40     1.37960   109.34689     2.23213
   47    46 S   H    _H19    41     1.00811   121.18746  -178.25348
   48    44 S   CM   _C28   106     1.33834   124.90051  -138.98072
   49    48 S   HC   _H21   107     1.08454   120.33904   179.11574
   50    48 S   HC   _H22   108     1.08501   122.03306    -0.50435
   51    33 S   CM   _C23    42     1.54114   111.26237   -59.62200
   52    51 S   CM   _C22    43     1.34452   125.56985   -59.85929
   53    52 S   HC   _H18    44     1.08627   119.79107    -2.87378
   54    52 S   C5A  _C21    45     1.41585   123.10967   177.87440
   55    54 S   C5BC _C20    46     1.38516   133.45913   130.59973
   56    55 S   C5BC _C19    47     1.43755   107.15378   178.85517
   57    55 S   CT   _C30   100     1.48807   126.63469    -2.57671
   58    57 S   HC   _H26   101     1.09459   110.13365  -100.30832
   59    57 S   HC   _H27   102     1.09446   111.63924    19.93826
   60    57 S   HC   _H28   103     1.09457   110.82043   139.71955
   61    56 S   C5A  _C18    48     1.38762   107.02295    -3.56777
   62    56 S   CT   _C31    91     1.49980   126.33683   176.19008
   63    62 S   HC   _H29    92     1.09745   109.13914  -143.36190
   64    62 S   HC   _H30    93     1.09744   109.22756   -28.44494
   65    54 S   NA   _N6_    49     1.37174   118.78941   -53.37844
   66    65 S   H    _H17    50     1.01139   125.03044     1.50506
   67    61 S   CT   _C17    51     1.49508   131.43451  -177.67241
   68    67 S   HC   _H15    52     1.09645   110.33003    -2.01344
   69    67 S   HC   _H16    53     1.09643   108.25761  -117.79924
   70    62 S   CT   _C32    94     1.52384   113.04543    94.00102
   71    70 S   HC   _H31    95     1.09684   109.85865    57.80122
   72    70 S   HC   _H32    96     1.09696   109.72608   -59.69264
   73    67 S   C5A  _C7_    54     1.49900   113.29876   119.52996
   74    70 S   CO3  _C33    97     1.53141   114.75213   179.08123
   75    74 S   O2Z  _O36    98     1.26526   114.15972  -177.81905
   76    74 S   O2Z  _O35    99     1.26171   116.68057     2.13084
   77    73 S   C5BC _C6_    55     1.38731   131.11049   127.35778
   78    77 S   C5BC _C5_    56     1.43852   107.27632   178.17801
   79    77 S   CT   _C34    82     1.49916   126.59805    -0.82282
   80    79 S   HC   _H33    83     1.09702   109.59317    30.61820
   81    79 S   HC   _H34    84     1.09691   109.40778   145.80356
   82    78 S   C5A  _C8_    57     1.38686   107.08951     1.48701
   83    78 S   CT   _C4_    78     1.48983   125.51293  -177.60755
   84    83 S   HC   _H3_    79     1.09462   110.65923    47.27277
   85    83 S   HC   _H4_    80     1.09388   111.95333   166.59892
   86    83 S   HC   _H5_    81     1.09414   110.26597   -72.60709
   87    79 S   CT   _C35    85     1.52552   112.37969   -91.96288
   88    87 S   HC   _H35    86     1.09749   109.91307    61.17255
   89    87 S   HC   _H36    87     1.09775   109.85763   -56.17543
   90    73 S   NA   _N4_    58     1.37403   121.44049   -54.37048
   91    90 S   H    _H6_    59     1.01331   124.51740     2.88127
   92    82 S   CM   _C9_    60     1.41790   135.78226   179.86012
   93    92 S   HC   _H7_    61     1.08778   116.73932   131.48604
   94    87 S   CO3  _C36    88     1.53196   114.24960  -177.49001
   95    94 S   O2Z  _O38    89     1.26455   114.18642   173.96178
   96    94 S   O2Z  _O37    90     1.26187   116.64253    -6.02685
   97    92 S   CM   _C10    62     1.34107   123.74512   -51.69784
   98    97 S   CM   _C11    63     1.46174   127.32382  -178.10452
   99    98 S   CM   _C12    64     1.35171   109.16231   177.92378
  100    98 S   CM   _C15    73     1.45094   125.68810    -6.21035
  101   100 S   HC   _H12    74     1.08762   116.13683   -41.73543
  102    99 S   C    _C13    65     1.48882   107.07430    -1.62606
  103   102 S   O    _O33    66     1.21762   125.70362  -178.11830
  104    99 S   CT   _C14    69     1.48484   132.60378   175.67500
  105   104 S   HC   _H9_    70     1.09438   110.26673   108.57000
  106   104 S   HC   _H10    71     1.09310   112.51597   -12.48604
  107   104 S   HC   _H11    72     1.09512   110.45051  -131.83473
  108   100 S   CM   _C16    75     1.33855   125.36875   135.30348
  109   108 S   HC   _H13    76     1.08515   120.18299  -178.57125
  110   108 S   HC   _H14    77     1.08453   122.25576     0.78059
  111    97 S   N    _N5_    67     1.36540   126.37572    -1.79711
  112   111 S   H    _H8_    68     1.01227   124.20638     1.06128
  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  11   5   4   3
  16   2   1   1  15   8   3   2   1   8   4   6   3   5   2   2
   1   1   5   8   3  11  13  18   6   2   1   1  12  10   5   4
   5   1   9   4   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
  10  14  11   7   3   7   3   4   2   1   1   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    51    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    46    51    52    44    38    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    43    46    47    51    52    53    54    44    45    48    38    39    40    41  
   35    36  
   36  
    0  
   42    43    46    47    51    52    44    45    48    49    50    38    39    40    41  
   39    40    41    42    44    46    51    52  
   40    41    51  
   41    51  
   51  
   43    46    47    51    52    44    45    48  
   46    47    51    44  
   45    48    49    50    46    51  
   48    49    50  
   47    51    52    53    54  
   51    52  
   49    50  
   50  
    0  
   52    53    54    55    65  
   53    54    55    56    61    65    66    57  
   54    55    65  
   55    56    61    65    66    67    62    57    58    59    60  
   56    61    65    66    67    62    63    64    70    57    58    59    60  
   61    65    66    67    68    69    73    62    63    64    70    71    72    74    57    58    59    60  
   58    59    60    61    62    65  
   59    60  
   60  
    0  
   65    66    67    68    69    73    77    90    62    63    64    70  
   63    64    70    71    72    74    75    76    65    67  
   64    70    71    72    74  
   70    71    72    74  
   66    67    68    69    73  
   67  
   68    69    73    77    78    82    90    91    79  
   69    73    77    90  
   73    77    90  
   71    72    74    75    76  
   72    74    75    76  
   74    75    76  
   77    78    82    90    91    92    83    79    80    81    87  
   75    76  
   76  
    0  
   78    82    90    91    92    83    84    85    86    79    80    81    87    88    89    94  
   82    90    91    92    93    97    83    84    85    86    79    80    81    87  
   80    81    87    88    89    94    95    96    82    83    90  
   81    87    88    89    94  
   87    88    89    94  
   90    91    92    93    97    98   111    83    84    85    86  
   84    85    86    90    92  
   85    86  
   86  
    0  
   88    89    94    95    96  
   89    94    95    96  
   94    95    96  
   91    92    93    97  
   92  
   93    97    98    99   102   111   112   100  
   97    98   111  
   95    96  
   96  
    0  
   98    99   102   103   111   112   104   100   101   108  
   99   102   103   111   112   104   105   106   107   100   101   108   109   110  
  102   103   111   112   104   105   106   107   100   101   108  
  101   108   109   110   102   104   111  
  108   109   110  
  103   111   112   104   105   106   107  
  111   112   104  
  105   106   107   111  
  106   107  
  107  
    0  
  109   110  
  110  
    0  
  112  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.180000   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   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.2500   0.1700  -0.894200   1.8650   1.6500   0.051222218  -2.220205820
   47   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0760   0.018000   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   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   57   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0700  -0.163000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   66   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   67   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   73   3.5500   0.0700  -0.163000   2.0020   1.7750   0.001000000  -0.843144165
   74   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   77   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   78   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   79   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   83   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   90   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   91   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   92   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   93   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   94   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   95   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   96   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   97   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   98   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   99   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
  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   0.556700   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   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
  109   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  110   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  111   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
  112   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    51   317.000  1.510
   33    38   268.000  1.529
   37    42   465.000  1.376
   37    44   380.000  1.444
   42    43   745.000  1.250
   42    46   415.000  1.382
   46    47   434.000  1.010
   46    51   425.000  1.378
   51    52   549.000  1.340
   52    53   340.000  1.080
   52    54   375.000  1.423
   54    55   546.000  1.367
   54    65   427.000  1.381
   55    56   469.000  1.424
   55    57   285.000  1.502
   56    61   546.000  1.367
   56    62   285.000  1.502
   61    65   427.000  1.381
   61    67   295.000  1.489
   65    66   434.000  1.010
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    73   295.000  1.489
   73    77   546.000  1.367
   73    90   427.000  1.381
   77    78   469.000  1.424
   77    79   285.000  1.502
   78    82   546.000  1.367
   78    83   285.000  1.502
   82    90   427.000  1.381
   82    92   375.000  1.423
   90    91   434.000  1.010
   92    93   340.000  1.080
   92    97   549.000  1.340
   97    98   380.000  1.444
   97   111   400.000  1.384
   98    99   549.000  1.340
   98   100   380.000  1.444
   99   102   410.000  1.444
   99   104   317.000  1.510
  102   103   570.000  1.229
  102   111   490.000  1.335
  111   112   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   549.000  1.340
  108   109   340.000  1.080
  108   110   340.000  1.080
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    86   340.000  1.090
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    94   317.000  1.522
   94    95   656.000  1.250
   94    96   656.000  1.250
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    70   268.000  1.529
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    74   317.000  1.522
   74    75   656.000  1.250
   74    76   656.000  1.250
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   44    45   340.000  1.080
   44    48   549.000  1.340
   48    49   340.000  1.080
   48    50   340.000  1.080
   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    51    75.00000  112.20000
   29    33    38    75.00000  111.63000
   33    37    42    70.00000  124.00000
   33    37    44    70.00000  124.00000
   33    51    46    75.00000  116.24600
   33    51    52    70.00000  124.00000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   37    42    43    65.00000  137.10300
   37    42    46    75.00000  114.40000
   37    44    45    35.00000  120.00000
   37    44    48    70.00000  123.01800
   42    46    47    50.00000  121.48000
   42    46    51    75.00000  118.45600
   46    42    43   105.00000  113.92000
   46    51    52    70.00000  124.03900
   51    33    37    70.00000  110.12100
   51    46    47    35.00000  114.50000
   51    52    53    35.00000  120.00000
   51    52    54    55.00000  128.24000
   52    54    55    50.00000  133.16000
   52    54    65    70.00000  120.38000
   54    52    53    40.00000  117.26300
   54    55    56    70.00000  107.30000
   54    55    57    60.00000  130.00000
   54    65    61    70.00000  109.80000
   54    65    66    35.00000  120.00000
   55    56    61    70.00000  107.30000
   55    56    62    60.00000  130.00000
   55    57    58    35.00000  109.50000
   55    57    59    35.00000  109.50000
   55    57    60    35.00000  109.50000
   56    61    65    70.00000  107.70000
   56    61    67    50.00000  133.50000
   56    62    63    35.00000  109.50000
   56    62    64    35.00000  109.50000
   56    62    70    70.00000  112.17500
   61    65    66    35.00000  120.00000
   61    67    68    45.00000  110.47400
   61    67    69    45.00000  110.47400
   61    67    73    70.00000  112.04700
   65    54    55    70.00000  107.70000
   67    61    65    65.00000  122.56900
   67    73    77    50.00000  133.50000
   67    73    90    65.00000  122.56900
   69    67    68    33.00000  107.80000
   73    67    68    45.00000  110.47400
   73    67    69    45.00000  110.47400
   73    77    78    70.00000  107.30000
   73    77    79    60.00000  130.00000
   73    90    82    70.00000  109.80000
   73    90    91    35.00000  120.00000
   77    78    82    70.00000  107.30000
   77    78    83    60.00000  130.00000
   77    79    80    35.00000  109.50000
   77    79    81    35.00000  109.50000
   77    79    87    70.00000  112.17500
   78    82    90    70.00000  107.70000
   78    82    92    50.00000  133.16000
   78    83    84    35.00000  109.50000
   78    83    85    35.00000  109.50000
   78    83    86    35.00000  109.50000
   82    90    91    35.00000  120.00000
   82    92    93    40.00000  117.26300
   82    92    97    55.00000  128.24000
   90    73    77    70.00000  107.70000
   92    82    90    70.00000  120.38000
   92    97    98    70.00000  123.01800
   92    97   111    75.00000  120.83300
   97    92    93    35.00000  120.00000
   97    98    99    70.00000  123.01800
   97    98   100    70.00000  123.01800
   97   111   102    70.00000  120.89900
   97   111   112    45.00000  117.55000
   98    99   102    70.00000  118.70000
   98    99   104    70.00000  124.00000
   98   100   101    35.00000  120.00000
   98   100   108    70.00000  123.01800
   99   102   103    80.00000  125.30000
   99   102   111    80.00000  111.56200
   99   104   105    35.00000  109.50000
   99   104   106    35.00000  109.50000
   99   104   107    35.00000  109.50000
  102   111   112    35.00000  119.80000
  111    97    98    75.00000  120.83300
  111   102   103    80.00000  122.90000
  104    99   102    70.00000  119.70000
  106   104   105    33.00000  107.80000
  107   104   105    33.00000  107.80000
  107   104   106    33.00000  107.80000
  100    98    99    70.00000  123.01800
  100   108   109    35.00000  120.00000
  100   108   110    35.00000  120.00000
  108   100   101    35.00000  120.00000
  110   108   109    35.00000  117.00000
   83    78    82    60.00000  130.00000
   85    83    84    33.00000  107.80000
   86    83    84    33.00000  107.80000
   86    83    85    33.00000  107.80000
   79    77    78    60.00000  130.00000
   79    87    88    37.50000  110.70000
   79    87    89    37.50000  110.70000
   79    87    94    70.00000  109.69300
   81    79    80    33.00000  107.80000
   87    79    80    37.50000  110.70000
   87    79    81    37.50000  110.70000
   87    94    95    70.00000  117.00000
   87    94    96    70.00000  117.00000
   89    87    88    33.00000  107.80000
   94    87    88    35.00000  109.50000
   94    87    89    35.00000  109.50000
   96    94    95    80.00000  126.00000
   62    56    61    60.00000  130.00000
   62    70    71    37.50000  110.70000
   62    70    72    37.50000  110.70000
   62    70    74    70.00000  109.69300
   64    62    63    33.00000  107.80000
   70    62    63    37.50000  110.70000
   70    62    64    37.50000  110.70000
   70    74    75    70.00000  117.00000
   70    74    76    70.00000  117.00000
   72    70    71    33.00000  107.80000
   74    70    71    35.00000  109.50000
   74    70    72    35.00000  109.50000
   76    74    75    80.00000  126.00000
   57    55    56    60.00000  130.00000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   44    37    42    70.00000  117.34000
   44    48    49    35.00000  120.00000
   44    48    50    35.00000  120.00000
   48    44    45    35.00000  120.00000
   50    48    49    35.00000  117.00000
   38    33    37    70.00000  112.02700
   38    33    51    70.00000  112.02700
   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    51  -0.62250  1.0 1.0
   24    29    33    51  -0.38450 -1.0 2.0
   24    29    33    51   0.81900  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   0.42700  1.0 1.0
   29    33    37    42  -0.70350 -1.0 2.0
   29    33    37    42  -0.43150  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    51    46   0.09700  1.0 1.0
   29    33    51    46   0.15600 -1.0 2.0
   29    33    51    46  -0.50800  1.0 3.0
   29    33    51    52   0.42700  1.0 1.0
   29    33    51    52  -0.70350 -1.0 2.0
   29    33    51    52  -0.43150  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   7.00000 -1.0 2.0
   33    37   -42    46   7.00000 -1.0 2.0
   33    37    44    45   0.00000  1.0 1.0
   33    37    44    48  -0.18600  1.0 3.0
   33    51    52    53   7.00000 -1.0 2.0
   33    51    52    54   7.00000 -1.0 2.0
   37    33   -51    46  -1.35150  1.0 1.0
   37    33   -51    46   0.13900 -1.0 2.0
   37    33   -51    46   0.25250  1.0 3.0
   37    33    51    52  -0.28300  1.0 1.0
   37    33    51    52   0.26700 -1.0 2.0
   37    33    51    52  -0.63300  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   1.00000 -1.0 2.0
   37    42   -46    51  -0.54500  1.0 1.0
   37    42   -46    51   1.14150 -1.0 2.0
   37    44    48    49   7.00000 -1.0 2.0
   37    44    48    50   7.00000 -1.0 2.0
   42    37    44    45  -0.18600  1.0 3.0
   42    37    44    48   0.28850  1.0 1.0
   42    37    44    48   2.61350 -1.0 2.0
   42    37    44    48   0.78400  1.0 3.0
   42    46   -51    33   1.00000 -1.0 2.0
   42    46    51    52  -0.54500  1.0 1.0
   42    46    51    52   1.14150 -1.0 2.0
   43    42    46    47   1.00000 -1.0 2.0
   43    42    46    51   1.00000 -1.0 2.0
   46    51    52    53   7.00000 -1.0 2.0
   46    51    52    54   7.00000 -1.0 2.0
   47    46    51    33   2.40850 -1.0 2.0
   47    46    51    52   1.00000 -1.0 2.0
   51    33   -37    42  -0.28300  1.0 1.0
   51    33   -37    42   0.26700 -1.0 2.0
   51    33   -37    42  -0.63300  1.0 3.0
   51    33    37    44  -0.28300  1.0 1.0
   51    33    37    44   0.26700 -1.0 2.0
   51    33    37    44  -0.63300  1.0 3.0
   51    33    38    39   0.15000  1.0 3.0
   51    33    38    40   0.15000  1.0 3.0
   51    33    38    41   0.15000  1.0 3.0
   51    52    54    55   0.15800  1.0 1.0
   51    52    54    55   1.85350 -1.0 2.0
   51    52    54    55  -0.48700  1.0 3.0
   51    52    54    65   0.11450  1.0 1.0
   51    52    54    65   1.85100 -1.0 2.0
   51    52    54    65  -0.49050  1.0 3.0
   52    54    55    56   3.62500 -1.0 2.0
   52    54    55    57   3.62500 -1.0 2.0
   52    54    65    61   3.62500 -1.0 2.0
   52    54    65    66   2.00000 -1.0 2.0
   53    52    54    55   0.56550  1.0 3.0
   53    52    54    65   0.54250  1.0 3.0
   54    55   -56    61   3.62500 -1.0 2.0
   54    55    56    62   3.62500 -1.0 2.0
   54    55    57    58   0.00000  1.0 1.0
   54    55    57    59   0.00000  1.0 1.0
   54    55    57    60   0.00000  1.0 1.0
   55    54   -65    61   3.62500 -1.0 2.0
   55    54    65    66   2.00000 -1.0 2.0
   55    56   -61    65   3.62500 -1.0 2.0
   55    56    61    67   3.62500 -1.0 2.0
   55    56    62    63   0.00000  1.0 1.0
   55    56    62    64   0.00000  1.0 1.0
   55    56    62    70   0.04150 -1.0 2.0
   56    55    57    58   0.00000  1.0 1.0
   56    55    57    59   0.00000  1.0 1.0
   56    55    57    60   0.00000  1.0 1.0
   56    61   -65    54   3.62500 -1.0 2.0
   56    61    65    66   2.00000 -1.0 2.0
   56    61    67    68   0.00000  1.0 1.0
   56    61    67    69   0.00000  1.0 1.0
   56    61    67    73   0.04300 -1.0 2.0
   56    62    70    71   0.43200  1.0 3.0
   56    62    70    72   0.43200  1.0 3.0
   56    62    70    74  -2.95950  1.0 1.0
   56    62    70    74   0.02300  1.0 3.0
   61    56    62    63   0.00000  1.0 1.0
   61    56    62    64   0.00000  1.0 1.0
   61    56    62    70   0.04150 -1.0 2.0
   61    67    73    77   0.04300 -1.0 2.0
   61    67    73    90   0.04300 -1.0 2.0
   65    54   -55    56   3.62500 -1.0 2.0
   65    54    55    57   3.62500 -1.0 2.0
   65    61    67    68   0.00000  1.0 1.0
   65    61    67    69   0.00000  1.0 1.0
   65    61    67    73   0.04300 -1.0 2.0
   67    61    65    54   3.62500 -1.0 2.0
   67    61    65    66   2.00000 -1.0 2.0
   67    73    77    78   3.62500 -1.0 2.0
   67    73    77    79   3.62500 -1.0 2.0
   67    73    90    82   3.62500 -1.0 2.0
   67    73    90    91   2.00000 -1.0 2.0
   68    67    73    77   0.00000  1.0 1.0
   68    67    73    90   0.00000  1.0 1.0
   69    67    73    77   0.00000  1.0 1.0
   69    67    73    90   0.00000  1.0 1.0
   73    77   -78    82   3.62500 -1.0 2.0
   73    77    78    83   3.62500 -1.0 2.0
   73    77    79    80   0.00000  1.0 1.0
   73    77    79    81   0.00000  1.0 1.0
   73    77    79    87   0.04150 -1.0 2.0
   77    73   -90    82   3.62500 -1.0 2.0
   77    73    90    91   2.00000 -1.0 2.0
   77    78   -82    90   3.62500 -1.0 2.0
   77    78    82    92   3.62500 -1.0 2.0
   77    78    83    84   0.00000  1.0 1.0
   77    78    83    85   0.00000  1.0 1.0
   77    78    83    86   0.00000  1.0 1.0
   77    79    87    88   0.43200  1.0 3.0
   77    79    87    89   0.43200  1.0 3.0
   77    79    87    94  -2.95950  1.0 1.0
   77    79    87    94   0.02300  1.0 3.0
   78    77    79    80   0.00000  1.0 1.0
   78    77    79    81   0.00000  1.0 1.0
   78    77    79    87   0.04150 -1.0 2.0
   78    82   -90    73   3.62500 -1.0 2.0
   78    82    90    91   2.00000 -1.0 2.0
   78    82    92    93   0.56550  1.0 3.0
   78    82    92    97   0.15800  1.0 1.0
   78    82    92    97   1.85350 -1.0 2.0
   78    82    92    97  -0.48700  1.0 3.0
   82    78    83    84   0.00000  1.0 1.0
   82    78    83    85   0.00000  1.0 1.0
   82    78    83    86   0.00000  1.0 1.0
   82    92    97    98   7.00000 -1.0 2.0
   82    92    97   111   7.00000 -1.0 2.0
   90    73   -77    78   3.62500 -1.0 2.0
   90    73    77    79   3.62500 -1.0 2.0
   90    82    92    93   0.54250  1.0 3.0
   90    82    92    97   0.11450  1.0 1.0
   90    82    92    97   1.85100 -1.0 2.0
   90    82    92    97  -0.49050  1.0 3.0
   92    82    90    73   3.62500 -1.0 2.0
   92    82    90    91   2.00000 -1.0 2.0
   92    97    98    99   0.28850  1.0 1.0
   92    97    98    99   2.61350 -1.0 2.0
   92    97    98    99   0.78400  1.0 3.0
   92    97    98   100   0.28850  1.0 1.0
   92    97    98   100   2.61350 -1.0 2.0
   92    97    98   100   0.78400  1.0 3.0
   92    97   111   102  -0.18900  1.0 1.0
   92    97   111   102   1.70900 -1.0 2.0
   92    97   111   112   0.78350 -1.0 2.0
   93    92    97    98   7.00000 -1.0 2.0
   93    92    97   111   7.00000 -1.0 2.0
   97    98   -99   102   7.00000 -1.0 2.0
   97    98    99   104   7.00000 -1.0 2.0
   97    98   100   101  -0.18600  1.0 3.0
   97    98   100   108   0.28850  1.0 1.0
   97    98   100   108   2.61350 -1.0 2.0
   97    98   100   108   0.78400  1.0 3.0
   98    97  -111   102  -0.18900  1.0 1.0
   98    97  -111   102   1.70900 -1.0 2.0
   98    97   111   112   0.78350 -1.0 2.0
   98    99   102   103   1.00000 -1.0 2.0
   98    99  -102   111   0.49500  1.0 1.0
   98    99  -102   111   1.31600 -1.0 2.0
   98    99  -102   111  -0.02300  1.0 3.0
   98    99   104   105   0.00000  1.0 1.0
   98    99   104   106   0.00000  1.0 1.0
   98    99   104   107   0.00000  1.0 1.0
   98   100   108   109   7.00000 -1.0 2.0
   98   100   108   110   7.00000 -1.0 2.0
   99    98   100   101  -0.18600  1.0 3.0
   99    98   100   108   0.28850  1.0 1.0
   99    98   100   108   2.61350 -1.0 2.0
   99    98   100   108   0.78400  1.0 3.0
   99   102  -111    97   2.45000 -1.0 2.0
   99   102   111   112   2.56700 -1.0 2.0
  102    99   104   105   0.15000  1.0 3.0
  102    99   104   106   0.15000  1.0 3.0
  102    99   104   107   0.15000  1.0 3.0
  103   102   111    97   2.67200 -1.0 2.0
  103   102   111   112   2.45000 -1.0 2.0
  111    97   -98    99  -0.18600  1.0 3.0
  111    97    98   100  -0.18600  1.0 3.0
  104    99   102   103  -0.64400  1.0 1.0
  104    99   102   103   0.26850 -1.0 2.0
  104    99   102   111   1.59650  1.0 1.0
  104    99   102   111   0.42750 -1.0 2.0
  104    99   102   111  -0.48350  1.0 3.0
  100    98    99   102   7.00000 -1.0 2.0
  100    98    99   104   7.00000 -1.0 2.0
  101   100   108   109   7.00000 -1.0 2.0
  101   100   108   110   7.00000 -1.0 2.0
   83    78    82    90   3.62500 -1.0 2.0
   83    78    82    92   3.62500 -1.0 2.0
   79    77    78    82   3.62500 -1.0 2.0
   79    77    78    83   3.62500 -1.0 2.0
   79    87    94    95   0.41150 -1.0 2.0
   79    87    94    96   0.41150 -1.0 2.0
   80    79    87    88   0.15000  1.0 3.0
   80    79    87    89   0.15000  1.0 3.0
   80    79    87    94  -0.11250  1.0 3.0
   81    79    87    88   0.15000  1.0 3.0
   81    79    87    89   0.15000  1.0 3.0
   81    79    87    94  -0.11250  1.0 3.0
   88    87    94    95   0.00000  1.0 1.0
   88    87    94    96   0.00000  1.0 1.0
   89    87    94    95   0.00000  1.0 1.0
   89    87    94    96   0.00000  1.0 1.0
   62    56    61    65   3.62500 -1.0 2.0
   62    56    61    67   3.62500 -1.0 2.0
   62    70    74    75   0.41150 -1.0 2.0
   62    70    74    76   0.41150 -1.0 2.0
   63    62    70    71   0.15000  1.0 3.0
   63    62    70    72   0.15000  1.0 3.0
   63    62    70    74  -0.11250  1.0 3.0
   64    62    70    71   0.15000  1.0 3.0
   64    62    70    72   0.15000  1.0 3.0
   64    62    70    74  -0.11250  1.0 3.0
   71    70    74    75   0.00000  1.0 1.0
   71    70    74    76   0.00000  1.0 1.0
   72    70    74    75   0.00000  1.0 1.0
   72    70    74    76   0.00000  1.0 1.0
   57    55    56    61   3.62500 -1.0 2.0
   57    55    56    62   3.62500 -1.0 2.0
   44    37    42    43   7.00000 -1.0 2.0
   44    37    42    46   7.00000 -1.0 2.0
   45    44    48    49   7.00000 -1.0 2.0
   45    44    48    50   7.00000 -1.0 2.0
   38    33    37    42   0.09850  1.0 1.0
   38    33    37    42   0.15250 -1.0 2.0
   38    33    37    42  -0.50650  1.0 3.0
   38    33    37    44   0.98200  1.0 1.0
   38    33    37    44  -0.11900 -1.0 2.0
   38    33    37    44   0.24250  1.0 3.0
   38    33    51    46  -0.93550  1.0 1.0
   38    33    51    46   0.38900 -1.0 2.0
   38    33    51    46   0.16950  1.0 3.0
   38    33    51    52   0.09850  1.0 1.0
   38    33    51    52   0.15250 -1.0 2.0
   38    33    51    52  -0.50650  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
   33    44    37    42   1.10000 -1.0 2.0
   46    43    42    37   1.10000 -1.0 2.0
   47    42    46    51   1.00000 -1.0 2.0
   33    46    51    52   1.10000 -1.0 2.0
   54    53    52    51   1.10000 -1.0 2.0
   55    65    54    52   4.00000 -1.0 2.0
   56    57    55    54   4.00000 -1.0 2.0
   61    62    56    55   4.00000 -1.0 2.0
   67    65    61    56   4.00000 -1.0 2.0
   66    54    65    61   1.00000 -1.0 2.0
   77    90    73    67   4.00000 -1.0 2.0
   78    79    77    73   4.00000 -1.0 2.0
   82    83    78    77   4.00000 -1.0 2.0
   92    90    82    78   4.00000 -1.0 2.0
   91    73    90    82   1.00000 -1.0 2.0
   82    93    92    97   1.10000 -1.0 2.0
   98   111    97    92   1.10000 -1.0 2.0
   97   100    98    99   1.10000 -1.0 2.0
  102   104    99    98   1.10000 -1.0 2.0
   99   111   102   103  10.50000 -1.0 2.0
  112   102   111    97   1.00000 -1.0 2.0
   98   101   100   108  15.00000 -1.0 2.0
  109   110   108   100  15.00000 -1.0 2.0
   95    87    94    96  10.50000 -1.0 2.0
   75    70    74    76  10.50000 -1.0 2.0
   37    45    44    48  15.00000 -1.0 2.0
   49    50    48    44  15.00000 -1.0 2.0
END
