* LIGAND DATABASE FILE (OPLS2005)
*
001     114   115    206    306     597
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02089    79.83854   -84.00193
    3     1 S   H    _H1_     3     1.02099    98.80980    23.49758
    4     1 S   H    _H2_     4     1.02108    36.15819   133.27015
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08583   110.55165    58.73304
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C15    36     1.84333    97.44081  -178.17062
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C16    37     1.51122   108.05463  -160.02678
   38    33 S   OH   _O36   113     1.42972   109.02036   -40.99180
   39    38 S   HO   _H20   114     0.96926   106.22325    61.92063
   40    37 S   CO4  _C24    38     1.49631   117.65493   -73.13737
   41    40 S   O    _O35    39     1.23117   120.39296   145.88541
   42    37 S   CMA  _C17   100     1.34252   126.19457   108.47191
   43    42 S   OM   _O34   101     1.26904   128.89777   178.49026
   44    40 S   CT   _C12    40     1.53182   117.55348   -37.13319
   45    42 S   CA   _C18   102     1.49468   111.36642    -1.59152
   46    44 S   CO4  _C13    41     1.53494   113.87330    27.99934
   47    46 S   O    _O33    42     1.23238   121.46556   148.35821
   48    44 S   CT   _C30    59     1.53473   107.96835   -92.01093
   49    48 S   HC   _H30    60     1.08347   107.16832   -59.96214
   50    48 S   HC   _H31    61     1.08622   106.71189    54.16146
   51    44 S   CT   _C11    73     1.53881   108.57202   149.39425
   52    51 S   HC   _H12    74     1.09561   109.08275   179.98022
   53    51 S   HC   _H13    75     1.09197   108.44499    63.83550
   54    45 S   CA   _C19   103     1.39477   119.98087    90.05315
   55    54 S   HA   _H15   104     1.08751   120.88677    -0.04846
   56    33 S   CT   _C14    43     1.54493   112.81372    78.33324
   57    56 S   HC   _H14    44     1.09830   108.40866  -178.47980
   58    48 S   CM   _C31    62     1.48843   113.13327   174.52138
   59    58 S   HC   _H32    63     1.08928   114.46084   -60.64670
   60    51 S   CM   _C10    76     1.50221   111.21632   -60.38283
   61    60 S   HC   _H11    77     1.08984   114.18184    29.79678
   62    54 S   CA   _C20   105     1.39478   120.00917  -179.98022
   63    62 S   HA   _H16   106     1.08575   120.01797   179.92598
   64    56 S   CT   _C25    45     1.53384   114.13981   -61.31780
   65    64 S   HC   _H21    46     1.08420   107.27419   -33.64426
   66    64 S   HC   _H22    47     1.08644   106.79349    80.54021
   67    58 S   CM   _C32    64     1.34688   127.30567   122.19838
   68    60 S   CM   _C9_    78     1.34831   128.12173  -150.01406
   69    62 S   CA   _C21   107     1.39528   119.98165    -0.05234
   70    69 S   HA   _H17   108     1.08632   120.02044   179.90513
   71    64 S   CM   _C26    48     1.48953   113.11427  -159.12952
   72    71 S   HC   _H23    49     1.08938   114.42988   -90.73845
   73    67 S   CT   _C33    65     1.50268   124.98176  -180.00000
   74    73 S   HC   _H33    66     1.09453   110.08734    90.00371
   75    73 S   HC   _H34    67     1.09536   110.08835  -150.66207
   76    73 S   HC   _H35    68     1.09221   113.44535   -31.08285
   77    67 S   CT   _C34    69     1.50457   120.50210     0.63674
   78    77 S   HC   _H36    70     1.09521   112.40993    89.98180
   79    77 S   HC   _H37    71     1.09505   110.29763  -149.89117
   80    77 S   HC   _H38    72     1.09491   110.22541   -29.99433
   81    68 S   CT   _C35    79     1.50793   119.81407     0.05234
   82    81 S   HC   _H39    80     1.09343   110.70299    90.00335
   83    81 S   HC   _H40    81     1.09507   110.21952  -149.91215
   84    81 S   HC   _H41    82     1.09541   112.37567   -30.14281
   85    68 S   CT   _C8_    83     1.51343   124.97518  -177.83698
   86    85 S   HC   _H9_    84     1.09884   108.13355   120.07194
   87    85 S   HC   _H10    85     1.09535   111.60227     5.68093
   88    69 S   CA   _C22   109     1.39570   119.96550     0.06256
   89    88 S   HA   _H18   110     1.08638   119.94971   179.92087
   90    71 S   CM   _C27    50     1.34648   127.33374    92.18520
   91    85 S   CT   _C7_    86     1.53506   114.07124  -119.30847
   92    91 S   HC   _H7_    87     1.09283   110.45952   -67.29596
   93    91 S   HC   _H8_    88     1.09714   108.20850   177.91813
   94    45 S   CA   _C23   111     1.39390   119.99895   -89.98538
   95    94 S   HA   _H19   112     1.08780   120.84969     0.02798
   96    90 S   CT   _C28    51     1.50163   125.01754  -179.97202
   97    96 S   HC   _H24    52     1.09468   110.14034    89.97089
   98    96 S   HC   _H25    53     1.09624   110.07288  -150.65185
   99    96 S   HC   _H26    54     1.09299   113.47448   -31.11407
  100    90 S   CT   _C29    55     1.50508   120.48041     0.67840
  101   100 S   HC   _H27    56     1.09450   112.43263    89.94739
  102   100 S   HC   _H28    57     1.09479   110.32696  -149.86613
  103   100 S   HC   _H29    58     1.09584   110.22519   -30.04117
  104    91 S   CM   _C6_    89     1.50414   112.67452    59.54090
  105   104 S   HC   _H6_    90     1.08956   113.96539    55.05675
  106   104 S   CM   _C5_    91     1.34628   128.13168  -125.74788
  107   106 S   CT   _C4_    92     1.50230   125.42260   179.98022
  108   107 S   HC   _H3_    93     1.09531   109.99836    90.01853
  109   107 S   HC   _H4_    94     1.09517   110.00086   -29.20639
  110   107 S   HC   _H5_    95     1.09146   113.77156  -149.27508
  111   106 S   CT   _C36    96     1.50647   120.33736    -0.42290
  112   111 S   HC   _H42    97     1.09499   110.30005    89.98722
  113   111 S   HC   _H43    98     1.09518   112.44059  -149.91935
  114   111 S   HC   _H44    99     1.09493   110.18185   -29.83217
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  17   2   1   1  16   7   1  16   5  10   3  17   9  15   5  12
   5   4   9   4   3   8   4   7   4  10   3  10   3   6   3   7
   4   3   8  11   5   3  10   3   7   3   2   1   3   2   1   1
   7   3   2   1   8   5   4   3   2   8   7   4   3   1   1   7
   3   2   1   3   2   1   1  10   3   8   7   3   2   1   3   2
   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    56    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    46    56    57    64    42    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    44    46    47    56    57    64    65    66    71    42    43    45    38    39  
   35    36  
   36  
    0  
   40    41    44    46    56    57    64    48    51    42    43    45    54    94    38    39  
   39    40    42    46    56    57    64  
   56  
   41    44    46    47    56    48    49    50    58    51    52    53    60    42    43    45  
   44    46    48    51    42  
   43    45    54    55    62    88    94    95    44    56  
   45    54    94  
   46    47    56    57    64    48    49    50    58    59    67    51    52    53    60    61    68  
   54    55    62    63    69    88    89    94    95  
   47    56    57    64    65    66    71    48    49    50    58    51    52    53    60  
   56    57    64    48    51  
   49    50    58    59    67    73    77    51    52    53    60    56  
   50    58    59    67    51  
   58    59    67    51  
   52    53    60    61    68    81    85    56    58  
   53    60    61    68  
   60    61    68  
   55    62    63    69    70    88    94    95  
   62    63    69    94  
   57    64    65    66    71    72    90  
   64    65    66    71  
   59    67    73    74    75    76    77    78    79    80  
   67    73    77  
   61    68    81    82    83    84    85    86    87    91  
   68    81    85  
   63    69    70    88    89    94  
   69    70    88  
   65    66    71    72    90    96   100  
   66    71    72    90  
   71    72    90  
   73    74    75    76    77    78    79    80  
   81    82    83    84    85    86    87    91    92    93   104  
   70    88    89    94    95  
   88    89    94  
   72    90    96    97    98    99   100   101   102   103  
   90    96   100  
   74    75    76    77    78    79    80  
   75    76    77  
   76    77  
   77  
   78    79    80  
   79    80  
   80  
    0  
   82    83    84    85    86    87    91  
   83    84    85  
   84    85  
   85  
   86    87    91    92    93   104   105   106  
   87    91    92    93   104  
   91    92    93   104  
   89    94    95  
   94    95  
   96    97    98    99   100   101   102   103  
   92    93   104   105   106   107   111  
   93   104   105   106  
  104   105   106  
   95  
    0  
   97    98    99   100   101   102   103  
   98    99   100  
   99   100  
  100  
  101   102   103  
  102   103  
  103  
    0  
  105   106   107   108   109   110   111   112   113   114  
  106   107   111  
  107   108   109   110   111   112   113   114  
  108   109   110   111   112   113   114  
  109   110   111  
  110   111  
  111  
  112   113   114  
  113   114  
  114  
    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   0.432500   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   39   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   68   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   69   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   70   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   89   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   90   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   95   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   96   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  105   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    56   268.000  1.529
   33    38   320.000  1.410
   37    40   320.000  1.462
   37    42   465.000  1.376
   40    41   570.000  1.229
   40    44   317.000  1.522
   44    46   317.000  1.522
   44    48   268.000  1.529
   44    51   268.000  1.529
   46    47   570.000  1.229
   46    56   317.000  1.522
   56    57   340.000  1.090
   56    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    71   317.000  1.510
   71    72   340.000  1.080
   71    90   549.000  1.340
   90    96   317.000  1.510
   90   100   317.000  1.510
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   340.000  1.090
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    58   317.000  1.510
   58    59   340.000  1.080
   58    67   549.000  1.340
   67    73   317.000  1.510
   67    77   317.000  1.510
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    60   317.000  1.510
   60    61   340.000  1.080
   60    68   549.000  1.340
   68    81   317.000  1.510
   68    85   317.000  1.510
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    91   268.000  1.529
   91    92   340.000  1.090
   91    93   340.000  1.090
   91   104   317.000  1.510
  104   105   340.000  1.080
  104   106   549.000  1.340
  106   107   317.000  1.510
  106   111   317.000  1.510
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   42    43   745.000  1.250
   42    45   320.000  1.460
   45    54   469.000  1.400
   45    94   469.000  1.400
   54    55   367.000  1.080
   54    62   469.000  1.400
   62    63   367.000  1.080
   62    69   469.000  1.400
   69    70   367.000  1.080
   69    88   469.000  1.400
   88    89   367.000  1.080
   88    94   469.000  1.400
   94    95   367.000  1.080
   38    39   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  112.20000
   29    33    56    75.00000  111.63000
   29    33    38    85.00000  114.68000
   33    37    40    65.00000  116.34900
   33    37    42    70.00000  124.00000
   33    56    46    63.00000  111.10000
   33    56    57    37.50000  110.70000
   33    56    64    58.35000  112.70000
   33    38    39    55.00000  108.50000
   37    40    41    80.00000  123.72100
   37    40    44    65.00000  118.62400
   37    42    43    65.00000  137.10300
   37    42    45    60.00000  123.20500
   40    44    46    75.00000  107.99600
   40    44    48    63.00000  111.10000
   40    44    51    63.00000  111.10000
   44    40    41    80.00000  120.40000
   44    46    47    80.00000  120.40000
   44    46    56    70.00000  116.00000
   44    48    49    37.50000  110.70000
   44    48    50    37.50000  110.70000
   44    48    58    70.00000  112.02700
   44    51    52    37.50000  110.70000
   44    51    53    37.50000  110.70000
   44    51    60    70.00000  112.02700
   46    56    57    35.00000  109.50000
   46    56    64    63.00000  111.10000
   56    33    37    70.00000  112.02700
   56    46    47    80.00000  120.40000
   56    64    65    37.50000  110.70000
   56    64    66    37.50000  110.70000
   56    64    71    70.00000  112.02700
   64    56    57    37.50000  110.70000
   64    71    72    35.00000  117.00000
   64    71    90    70.00000  124.00000
   66    64    65    33.00000  107.80000
   71    64    65    35.00000  109.50000
   71    64    66    35.00000  109.50000
   71    90    96    70.00000  124.00000
   71    90   100    70.00000  124.00000
   90    71    72    35.00000  120.00000
   90    96    97    35.00000  109.50000
   90    96    98    35.00000  109.50000
   90    96    99    35.00000  109.50000
   90   100   101    35.00000  109.50000
   90   100   102    35.00000  109.50000
   90   100   103    35.00000  109.50000
   98    96    97    33.00000  107.80000
   99    96    97    33.00000  107.80000
   99    96    98    33.00000  107.80000
  100    90    96    65.00000  117.92700
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
   48    44    46    63.00000  111.10000
   48    58    59    35.00000  117.00000
   48    58    67    70.00000  124.00000
   50    48    49    33.00000  107.80000
   58    48    49    35.00000  109.50000
   58    48    50    35.00000  109.50000
   58    67    73    70.00000  124.00000
   58    67    77    70.00000  124.00000
   67    58    59    35.00000  120.00000
   67    73    74    35.00000  109.50000
   67    73    75    35.00000  109.50000
   67    73    76    35.00000  109.50000
   67    77    78    35.00000  109.50000
   67    77    79    35.00000  109.50000
   67    77    80    35.00000  109.50000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   77    67    73    65.00000  117.92700
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   51    44    46    63.00000  111.10000
   51    44    48    58.35000  112.70000
   51    60    61    35.00000  117.00000
   51    60    68    70.00000  124.00000
   53    51    52    33.00000  107.80000
   60    51    52    35.00000  109.50000
   60    51    53    35.00000  109.50000
   60    68    81    70.00000  124.00000
   60    68    85    70.00000  124.00000
   68    60    61    35.00000  120.00000
   68    81    82    35.00000  109.50000
   68    81    83    35.00000  109.50000
   68    81    84    35.00000  109.50000
   68    85    86    35.00000  109.50000
   68    85    87    35.00000  109.50000
   68    85    91    70.00000  112.02700
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   85    68    81    65.00000  117.92700
   85    91    92    37.50000  110.70000
   85    91    93    37.50000  110.70000
   85    91   104    70.00000  112.02700
   87    85    86    33.00000  107.80000
   91    85    86    37.50000  110.70000
   91    85    87    37.50000  110.70000
   91   104   105    35.00000  117.00000
   91   104   106    70.00000  124.00000
   93    91    92    33.00000  107.80000
  104    91    92    35.00000  109.50000
  104    91    93    35.00000  109.50000
  104   106   107    70.00000  124.00000
  104   106   111    70.00000  124.00000
  106   104   105    35.00000  120.00000
  106   107   108    35.00000  109.50000
  106   107   109    35.00000  109.50000
  106   107   110    35.00000  109.50000
  106   111   112    35.00000  109.50000
  106   111   113    35.00000  109.50000
  106   111   114    35.00000  109.50000
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
  111   106   107    65.00000  117.92700
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   42    37    40    60.00000  125.92000
   42    45    54    60.00000  120.93500
   42    45    94    60.00000  120.93500
   45    42    43    85.00000  114.86500
   45    54    55    35.00000  120.00000
   45    54    62    63.00000  120.00000
   45    94    88    63.00000  120.00000
   45    94    95    35.00000  120.00000
   54    62    63    35.00000  120.00000
   54    62    69    63.00000  120.00000
   62    54    55    35.00000  120.00000
   62    69    70    35.00000  120.00000
   62    69    88    63.00000  120.00000
   69    62    63    35.00000  120.00000
   69    88    89    35.00000  120.00000
   69    88    94    63.00000  120.00000
   88    69    70    35.00000  120.00000
   88    94    95    35.00000  120.00000
   94    45    54    63.00000  120.00000
   94    88    89    35.00000  120.00000
   38    33    37    90.00000  110.39200
   38    33    56    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  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    56   0.01700  1.0 1.0
   24    29    33    56  -0.23550 -1.0 2.0
   24    29    33    56   0.21350  1.0 3.0
   24    29    33    38   0.13850  1.0 1.0
   24    29    33    38  -1.34450 -1.0 2.0
   24    29    33    38   0.57400  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    40   0.09700  1.0 1.0
   29    33    37    40   0.15600 -1.0 2.0
   29    33    37    40  -0.50800  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    56    46   0.56750  1.0 1.0
   29    33    56    46  -0.07550 -1.0 2.0
   29    33    56    46   0.20000  1.0 3.0
   29    33    56    57   0.15000  1.0 3.0
   29    33    56    64   0.44750  1.0 1.0
   29    33    56    64  -0.17800 -1.0 2.0
   29    33    56    64   0.20200  1.0 3.0
   29    33    38    39   0.35600  1.0 1.0
   29    33    38    39  -0.10750 -1.0 2.0
   29    33    38    39  -0.54400  1.0 3.0
   33    37    40    41  -0.64400  1.0 1.0
   33    37    40    41   0.26850 -1.0 2.0
   33    37    40    44   0.25700  1.0 1.0
   33    37    40    44   0.66200 -1.0 2.0
   33    37    40    44   0.04450  1.0 3.0
   33    37    42    43   7.00000 -1.0 2.0
   33    37    42    45   7.00000 -1.0 2.0
   33    56    64    65   0.15000  1.0 3.0
   33    56    64    66   0.15000  1.0 3.0
   33    56    64    71   0.34400  1.0 1.0
   33    56    64    71   0.09450 -1.0 2.0
   33    56    64    71   0.11100  1.0 3.0
   37    33    56    46  -0.98800  1.0 1.0
   37    33    56    46   0.48800 -1.0 2.0
   37    33    56    46   0.76800  1.0 3.0
   37    33    56    57   0.15000  1.0 3.0
   37    33    56    64   0.34400  1.0 1.0
   37    33    56    64   0.09450 -1.0 2.0
   37    33    56    64   0.11100  1.0 3.0
   37    33    38    39  -0.07800  1.0 1.0
   37    33    38    39  -0.21500 -1.0 2.0
   37    33    38    39  -0.03150  1.0 3.0
   37    40   -44    46   0.65300  1.0 1.0
   37    40   -44    46  -0.03850 -1.0 2.0
   37    40   -44    46   0.33900  1.0 3.0
   37    40    44    48   0.65300  1.0 1.0
   37    40    44    48  -0.03850 -1.0 2.0
   37    40    44    48   0.33900  1.0 3.0
   37    40    44    51   0.65300  1.0 1.0
   37    40    44    51  -0.03850 -1.0 2.0
   37    40    44    51   0.33900  1.0 3.0
   37    42    45    54   0.15800  1.0 1.0
   37    42    45    54   1.85350 -1.0 2.0
   37    42    45    54  -0.48700  1.0 3.0
   37    42    45    94   0.15800  1.0 1.0
   37    42    45    94   1.85350 -1.0 2.0
   37    42    45    94  -0.48700  1.0 3.0
   40    37    42    43   7.00000 -1.0 2.0
   40    37    42    45   7.00000 -1.0 2.0
   40    44    46    47   0.30150 -1.0 2.0
   40    44    46    56   0.65300  1.0 1.0
   40    44    46    56  -0.03850 -1.0 2.0
   40    44    46    56   0.33900  1.0 3.0
   40    44    48    49  -0.11250  1.0 3.0
   40    44    48    50  -0.11250  1.0 3.0
   40    44    48    58  -0.98800  1.0 1.0
   40    44    48    58   0.48800 -1.0 2.0
   40    44    48    58   0.76800  1.0 3.0
   40    44    51    52  -0.11250  1.0 3.0
   40    44    51    53  -0.11250  1.0 3.0
   40    44    51    60  -0.98800  1.0 1.0
   40    44    51    60   0.48800 -1.0 2.0
   40    44    51    60   0.76800  1.0 3.0
   41    40    44    46   0.30150 -1.0 2.0
   41    40    44    48   0.30150 -1.0 2.0
   41    40    44    51   0.30150 -1.0 2.0
   44    46   -56    33   0.60050  1.0 1.0
   44    46   -56    33   0.05600 -1.0 2.0
   44    46   -56    33   0.26150  1.0 3.0
   44    46    56    57   0.00000  1.0 1.0
   44    46    56    64   0.60050  1.0 1.0
   44    46    56    64   0.05600 -1.0 2.0
   44    46    56    64   0.26150  1.0 3.0
   44    48    58    59   0.00000  1.0 1.0
   44    48    58    67   0.09850  1.0 1.0
   44    48    58    67   0.15250 -1.0 2.0
   44    48    58    67  -0.50650  1.0 3.0
   44    51    60    61   0.00000  1.0 1.0
   44    51    60    68   0.09850  1.0 1.0
   44    51    60    68   0.15250 -1.0 2.0
   44    51    60    68  -0.50650  1.0 3.0
   46    44    48    49  -0.11250  1.0 3.0
   46    44    48    50  -0.11250  1.0 3.0
   46    44    48    58  -0.98800  1.0 1.0
   46    44    48    58   0.48800 -1.0 2.0
   46    44    48    58   0.76800  1.0 3.0
   46    44    51    52  -0.11250  1.0 3.0
   46    44    51    53  -0.11250  1.0 3.0
   46    44    51    60  -0.98800  1.0 1.0
   46    44    51    60   0.48800 -1.0 2.0
   46    44    51    60   0.76800  1.0 3.0
   46    56    64    65  -0.11250  1.0 3.0
   46    56    64    66  -0.11250  1.0 3.0
   46    56    64    71  -0.98800  1.0 1.0
   46    56    64    71   0.48800 -1.0 2.0
   46    56    64    71   0.76800  1.0 3.0
   47    46    56    33   0.30150 -1.0 2.0
   47    46    56    57   0.00000  1.0 1.0
   47    46    56    64   0.30150 -1.0 2.0
   56    33   -37    40   0.09700  1.0 1.0
   56    33   -37    40   0.15600 -1.0 2.0
   56    33   -37    40  -0.50800  1.0 3.0
   56    33    37    42   0.09850  1.0 1.0
   56    33    37    42   0.15250 -1.0 2.0
   56    33    37    42  -0.50650  1.0 3.0
   56    33    38    39  -0.11600  1.0 1.0
   56    33    38    39  -0.09450 -1.0 2.0
   56    33    38    39   0.21250  1.0 3.0
   56    64    71    72   0.00000  1.0 1.0
   56    64    71    90   0.09850  1.0 1.0
   56    64    71    90   0.15250 -1.0 2.0
   56    64    71    90  -0.50650  1.0 3.0
   57    56    64    65   0.15000  1.0 3.0
   57    56    64    66   0.15000  1.0 3.0
   57    56    64    71   0.15000  1.0 3.0
   64    71    90    96   7.00000 -1.0 2.0
   64    71    90   100   7.00000 -1.0 2.0
   65    64    71    72   0.33100  1.0 3.0
   65    64    71    90   0.00000  1.0 1.0
   66    64    71    72   0.33100  1.0 3.0
   66    64    71    90   0.00000  1.0 1.0
   71    90    96    97   0.00000  1.0 1.0
   71    90    96    98   0.00000  1.0 1.0
   71    90    96    99   0.00000  1.0 1.0
   71    90   100   101   0.00000  1.0 1.0
   71    90   100   102   0.00000  1.0 1.0
   71    90   100   103   0.00000  1.0 1.0
   72    71    90    96   7.00000 -1.0 2.0
   72    71    90   100   7.00000 -1.0 2.0
   96    90   100   101   0.34800  1.0 3.0
   96    90   100   102   0.34800  1.0 3.0
   96    90   100   103   0.34800  1.0 3.0
  100    90    96    97   0.34800  1.0 3.0
  100    90    96    98   0.34800  1.0 3.0
  100    90    96    99   0.34800  1.0 3.0
   48    44    46    47   0.30150 -1.0 2.0
   48    44    46    56   0.60050  1.0 1.0
   48    44    46    56   0.05600 -1.0 2.0
   48    44    46    56   0.26150  1.0 3.0
   48    44    51    52   0.15000  1.0 3.0
   48    44    51    53   0.15000  1.0 3.0
   48    44    51    60   0.34400  1.0 1.0
   48    44    51    60   0.09450 -1.0 2.0
   48    44    51    60   0.11100  1.0 3.0
   48    58    67    73   7.00000 -1.0 2.0
   48    58    67    77   7.00000 -1.0 2.0
   49    48    58    59   0.33100  1.0 3.0
   49    48    58    67   0.00000  1.0 1.0
   50    48    58    59   0.33100  1.0 3.0
   50    48    58    67   0.00000  1.0 1.0
   58    67    73    74   0.00000  1.0 1.0
   58    67    73    75   0.00000  1.0 1.0
   58    67    73    76   0.00000  1.0 1.0
   58    67    77    78   0.00000  1.0 1.0
   58    67    77    79   0.00000  1.0 1.0
   58    67    77    80   0.00000  1.0 1.0
   59    58    67    73   7.00000 -1.0 2.0
   59    58    67    77   7.00000 -1.0 2.0
   73    67    77    78   0.34800  1.0 3.0
   73    67    77    79   0.34800  1.0 3.0
   73    67    77    80   0.34800  1.0 3.0
   77    67    73    74   0.34800  1.0 3.0
   77    67    73    75   0.34800  1.0 3.0
   77    67    73    76   0.34800  1.0 3.0
   51    44    46    47   0.30150 -1.0 2.0
   51    44    46    56   0.60050  1.0 1.0
   51    44    46    56   0.05600 -1.0 2.0
   51    44    46    56   0.26150  1.0 3.0
   51    44    48    49   0.15000  1.0 3.0
   51    44    48    50   0.15000  1.0 3.0
   51    44    48    58   0.34400  1.0 1.0
   51    44    48    58   0.09450 -1.0 2.0
   51    44    48    58   0.11100  1.0 3.0
   51    60    68    81   7.00000 -1.0 2.0
   51    60    68    85   7.00000 -1.0 2.0
   52    51    60    61   0.33100  1.0 3.0
   52    51    60    68   0.00000  1.0 1.0
   53    51    60    61   0.33100  1.0 3.0
   53    51    60    68   0.00000  1.0 1.0
   60    68    81    82   0.00000  1.0 1.0
   60    68    81    83   0.00000  1.0 1.0
   60    68    81    84   0.00000  1.0 1.0
   60    68    85    86   0.00000  1.0 1.0
   60    68    85    87   0.00000  1.0 1.0
   60    68    85    91   0.09850  1.0 1.0
   60    68    85    91   0.15250 -1.0 2.0
   60    68    85    91  -0.50650  1.0 3.0
   61    60    68    81   7.00000 -1.0 2.0
   61    60    68    85   7.00000 -1.0 2.0
   68    85    91    92   0.15000  1.0 3.0
   68    85    91    93   0.15000  1.0 3.0
   68    85    91   104   0.31000  1.0 1.0
   68    85    91   104   0.14700 -1.0 2.0
   68    85    91   104   0.07550  1.0 3.0
   81    68    85    86   0.34800  1.0 3.0
   81    68    85    87   0.34800  1.0 3.0
   81    68    85    91   0.46850  1.0 1.0
   81    68    85    91   0.08550 -1.0 2.0
   81    68    85    91   0.09800  1.0 3.0
   85    68    81    82   0.34800  1.0 3.0
   85    68    81    83   0.34800  1.0 3.0
   85    68    81    84   0.34800  1.0 3.0
   85    91   104   105   0.00000  1.0 1.0
   85    91   104   106   0.09850  1.0 1.0
   85    91   104   106   0.15250 -1.0 2.0
   85    91   104   106  -0.50650  1.0 3.0
   86    85    91    92   0.15000  1.0 3.0
   86    85    91    93   0.15000  1.0 3.0
   86    85    91   104   0.15000  1.0 3.0
   87    85    91    92   0.15000  1.0 3.0
   87    85    91    93   0.15000  1.0 3.0
   87    85    91   104   0.15000  1.0 3.0
   91   104   106   107   7.00000 -1.0 2.0
   91   104   106   111   7.00000 -1.0 2.0
   92    91   104   105   0.33100  1.0 3.0
   92    91   104   106   0.00000  1.0 1.0
   93    91   104   105   0.33100  1.0 3.0
   93    91   104   106   0.00000  1.0 1.0
  104   106   107   108   0.00000  1.0 1.0
  104   106   107   109   0.00000  1.0 1.0
  104   106   107   110   0.00000  1.0 1.0
  104   106   111   112   0.00000  1.0 1.0
  104   106   111   113   0.00000  1.0 1.0
  104   106   111   114   0.00000  1.0 1.0
  105   104   106   107   7.00000 -1.0 2.0
  105   104   106   111   7.00000 -1.0 2.0
  107   106   111   112   0.34800  1.0 3.0
  107   106   111   113   0.34800  1.0 3.0
  107   106   111   114   0.34800  1.0 3.0
  111   106   107   108   0.34800  1.0 3.0
  111   106   107   109   0.34800  1.0 3.0
  111   106   107   110   0.34800  1.0 3.0
   42    37    40    41   1.00000 -1.0 2.0
   42    37    40    44  -0.33500  1.0 1.0
   42    37    40    44   1.06600 -1.0 2.0
   42    37    40    44  -0.14000  1.0 3.0
   42    45    54    55   3.62500 -1.0 2.0
   42    45    54    62   3.62500 -1.0 2.0
   42    45    94    88   3.62500 -1.0 2.0
   42    45    94    95   3.62500 -1.0 2.0
   43    42    45    54  -0.01750  1.0 1.0
   43    42    45    54  -0.32000 -1.0 2.0
   43    42    45    54   0.00600  1.0 3.0
   43    42    45    94  -0.01750  1.0 1.0
   43    42    45    94  -0.32000 -1.0 2.0
   43    42    45    94   0.00600  1.0 3.0
   45    54    62    63   3.62500 -1.0 2.0
   45    54    62    69   3.62500 -1.0 2.0
   54    45    94    88   3.62500 -1.0 2.0
   54    45    94    95   3.62500 -1.0 2.0
   54    62    69    70   3.62500 -1.0 2.0
   54    62   -69    88   3.62500 -1.0 2.0
   55    54    62    63   3.62500 -1.0 2.0
   55    54    62    69   3.62500 -1.0 2.0
   62    69    88    89   3.62500 -1.0 2.0
   62    69    88    94   3.62500 -1.0 2.0
   63    62    69    70   3.62500 -1.0 2.0
   63    62    69    88   3.62500 -1.0 2.0
   69    88   -94    45   3.62500 -1.0 2.0
   69    88    94    95   3.62500 -1.0 2.0
   70    69    88    89   3.62500 -1.0 2.0
   70    69    88    94   3.62500 -1.0 2.0
   89    88    94    45   3.62500 -1.0 2.0
   89    88    94    95   3.62500 -1.0 2.0
   94    45    54    55   3.62500 -1.0 2.0
   94    45   -54    62   3.62500 -1.0 2.0
   38    33    37    40   0.09700  1.0 1.0
   38    33    37    40   0.15600 -1.0 2.0
   38    33    37    40  -0.50800  1.0 3.0
   38    33    37    42   0.67800  1.0 1.0
   38    33    37    42   0.47050 -1.0 2.0
   38    33    37    42  -0.62500  1.0 3.0
   38    33    56    46  -0.09450  1.0 1.0
   38    33    56    46  -1.12950 -1.0 2.0
   38    33    56    46   0.54000  1.0 3.0
   38    33    56    57   0.23400  1.0 3.0
   38    33    56    64   0.86500  1.0 1.0
   38    33    56    64  -0.17500 -1.0 2.0
   38    33    56    64   0.20800  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    40    37    42   1.10000 -1.0 2.0
   37    44    40    41  10.50000 -1.0 2.0
   44    56    46    47  10.50000 -1.0 2.0
   64    72    71    90  15.00000 -1.0 2.0
   96   100    90    71  15.00000 -1.0 2.0
   48    59    58    67  15.00000 -1.0 2.0
   73    77    67    58  15.00000 -1.0 2.0
   51    61    60    68  15.00000 -1.0 2.0
   81    85    68    60  15.00000 -1.0 2.0
   91   105   104   106  15.00000 -1.0 2.0
  107   111   106   104  15.00000 -1.0 2.0
   45    43    42    37   1.10000 -1.0 2.0
   54    94    45    42   4.00000 -1.0 2.0
   62    55    54    45   1.10000 -1.0 2.0
   69    63    62    54   1.10000 -1.0 2.0
   88    70    69    62   1.10000 -1.0 2.0
   94    89    88    69   1.10000 -1.0 2.0
   88    95    94    45   1.10000 -1.0 2.0
END
