* LIGAND DATABASE FILE (OPLS2005)
*
001     112   115    201    316     580
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02095    87.21217    44.79250
    3     1 S   H    _H1_     3     1.02123    33.19064   176.08033
    4     1 S   H    _H2_     4     1.02115    93.12854   -63.77231
    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     1.04690   118.93088     8.54895
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08448   106.42696   -11.15906
   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     1.08733   110.25787    59.09629
   26    24 S   HC   HB22    34     1.08755   109.66015   178.71915
   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   _C11    36     1.80555    98.15944  -158.21451
   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   _C10    37     1.52452   107.85518  -159.99031
   38    33 S   CM   _C15   108     1.50072   108.01978   -36.24770
   39    38 S   HC   _H14   109     1.08662   117.10447   -59.86432
   40    37 S   NIP  _N5_    38     1.39967   109.04794  -104.45678
   41    40 S   H    _H9_    39     1.01853   122.91077   175.09743
   42    37 S   CM   _C9_    49     1.34083   126.99825    75.52179
   43    42 S   HC   _H7_    50     1.08726   117.31571     1.69420
   44    38 S   CM   _C16   110     1.33725   124.07186   120.08968
   45    44 S   HC   _H15   111     1.08403   120.49162  -179.97202
   46    44 S   HC   _H16   112     1.08512   121.48594     0.05935
   47    40 S   CG   _C13    40     1.27494   110.84468    -5.16854
   48    42 S   C5A  _C8_    51     1.43055   124.44359  -179.97202
   49    33 S   CT   _C12    41     1.56310   109.40974    89.86728
   50    49 S   HC   _H8_    42     1.09652   112.80699  -141.05344
   51    47 S   OH   _O33    47     1.32321   120.53693   178.13764
   52    51 S   HO   _H10    48     0.98313   112.97612    -1.71578
   53    48 S   C5BC _C5_    52     1.37799   134.23482   121.67231
   54    49 S   CT   _C14    43     1.52953   116.04254   -15.65257
   55    54 S   HC   _H11    44     1.08806   109.76983    52.21877
   56    54 S   HC   _H12    45     1.08826   109.70100   -67.87281
   57    54 S   HC   _H13    46     1.08858   109.66801   172.24637
   58    53 S   C5BC _C6_    53     1.41636   107.37739  -180.00000
   59    53 S   CT   _C4_   104     1.47822   126.29096     0.00000
   60    59 S   HC   _H3_   105     1.10172   111.01111   -89.95800
   61    59 S   HC   _H4_   106     1.10271   111.92908    30.53326
   62    59 S   HC   _H5_   107     1.10261   111.90688   149.55988
   63    58 S   C5A  _C7_    54     1.37765   107.38720     0.04846
   64    58 S   CT   _C34    95     1.47818   126.29662   179.96574
   65    64 S   HC   _H33    96     1.10525   110.64356    45.02827
   66    64 S   HC   _H34    97     1.10512   110.67624   160.50142
   67    48 S   NA   _N4_    55     1.36980   117.94268   -58.25276
   68    67 S   H    _H6_    56     1.01269   125.23270     0.10653
   69    63 S   CM   _C17    57     1.40406   134.19283   179.95577
   70    69 S   HC   _H17    58     1.10104   119.30847    29.96278
   71    64 S   CT   _C35    98     1.53592   113.11389   -77.20109
   72    71 S   HC   _H35    99     1.09748   109.27439   179.97202
   73    71 S   HC   _H36   100     1.09779   109.34033    63.46389
   74    69 S   CM   _C18    59     1.35425   125.48544  -148.27803
   75    71 S   CO3  _C36   101     1.53213   116.07970   -58.32202
   76    75 S   O2Z  _O38   102     1.26567   113.99734   -62.60057
   77    75 S   O2Z  _O37   103     1.26117   116.70923   117.33205
   78    74 S   CM   _C19    60     1.45234   127.39449  -179.96044
   79    78 S   CM   _C20    61     1.34183   109.86374  -179.97202
   80    78 S   CT   _C31    86     1.49058   122.51620    -0.03956
   81    80 S   HC   _H29    87     1.09569   109.17533    30.02120
   82    80 S   HC   _H30    88     1.09663   108.30143   146.21024
   83    79 S   CD   _C21    62     1.47398   101.15151    -0.03956
   84    79 S   CT   _C30    82     1.47902   132.35151   179.94065
   85    84 S   HC   _H26    83     1.09565   110.48199    89.98110
   86    84 S   HC   _H27    84     1.09438   110.56963   -30.19997
   87    84 S   HC   _H28    85     1.09536   110.49947  -149.87825
   88    80 S   CT   _C32    89     1.52629   112.82977   -93.00317
   89    88 S   HC   _H31    90     1.09704   108.35445   -60.02597
   90    88 S   HC   _H32    91     1.09707   109.72163    56.13989
   91    74 S   NI   _N6_    63     1.37500   123.95024     0.00000
   92    83 S   CM   _C22    64     1.46596   120.14152  -179.97202
   93    92 S   HC   _H18    65     1.07947   118.56020   -60.01070
   94    88 S   CO3  _C33    92     1.53420   116.89346  -179.97202
   95    94 S   O2Z  _O36    93     1.26586   114.06881  -178.93320
   96    94 S   O2Z  _O35    94     1.26149   116.59891     1.54167
   97    92 S   CM   _C23    66     1.33175   118.64884   120.04482
   98    97 S   CM   _C24    67     1.44822   129.52313  -179.93147
   99    98 S   CM   _C25    68     1.34686   110.09163   179.94766
  100    98 S   CT   _C29    78     1.49322   121.84043    -0.03956
  101   100 S   HC   _H23    79     1.09040   109.85143   -90.01480
  102   100 S   HC   _H24    80     1.09001   109.89720   149.78220
  103   100 S   HC   _H25    81     1.09095   109.80742    30.09866
  104    99 S   C    _C26    69     1.49310   106.51619    -0.04423
  105   104 S   O    _O34    70     1.21918   125.85951  -179.94405
  106    99 S   CM   _C27    73     1.42765   130.24929   179.98022
  107   106 S   HC   _H20    74     1.09897   120.30563   139.98030
  108    97 S   N    _N7_    71     1.36362   124.15368    -0.06256
  109   108 S   H    _H19    72     1.01452   124.34340     0.04846
  110   106 S   CM   _C28    75     1.35069   120.12904   -39.99044
  111   110 S   HC   _H21    76     1.08429   121.09197   179.94766
  112   110 S   HC   _H22    77     1.08546   121.24642    -0.03956
  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
  19   2   1   1  15  10   4  10   4  10   3   3   1   1   8  11
   7   5   2   1  13   3   2   1   1  17   6   2   1   1  11  10
   5   4   4   1   7   3   5   4   3  10   2   1   1  15  13  11
   5   4  10   5   2   1   1   5   4   3   3   8   3   2   1   1
  11  12  13   6   2   1   1   6   3   5   3   1   1   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    49    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    47    49    50    54    42    38    39    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    47    49    50    54    55    56    57    51    42    43    48    38    39    44    45    46  
   35    36  
   36  
    0  
   40    41    47    49    50    54    51    42    43    48    53    67    38    39    44  
   39    44    45    46    40    42    47    49    50    54  
   44    45    46    49  
   41    47    49    50    54    51    52    42    43    48  
   47    49    51    42  
   43    48    53    58    63    67    68    59    47    49  
   48    53    67  
   45    46    49  
   46  
    0  
   49    50    54    55    56    57    51    52  
   53    58    63    67    68    69    64    59    60    61    62  
   50    54    55    56    57    51    52  
   54    55    56    57    51  
   52    54  
    0  
   58    63    67    68    69    64    65    66    71    59    60    61    62  
   55    56    57  
   56    57  
   57  
    0  
   63    67    68    69    70    74    64    65    66    71    72    73    75    59    60    61    62  
   60    61    62    63    64    67  
   61    62  
   62  
    0  
   67    68    69    70    74    78    91    64    65    66    71  
   65    66    71    72    73    75    76    77    67    69  
   66    71    72    73    75  
   71    72    73    75  
   68    69    70    74  
   69  
   70    74    78    79    83    91    80  
   74    78    91  
   72    73    75    76    77  
   73    75    76    77  
   75    76    77  
   78    79    83    91    92    84    80    81    82    88  
   76    77  
   77  
    0  
   79    83    91    92    84    85    86    87    80    81    82    88    89    90    94  
   83    91    92    93    97    84    85    86    87    80    81    82    88  
   81    82    88    89    90    94    95    96    83    84    91  
   82    88    89    90    94  
   88    89    90    94  
   91    92    93    97    98   108    84    85    86    87  
   85    86    87    91    92  
   86    87  
   87  
    0  
   89    90    94    95    96  
   90    94    95    96  
   94    95    96  
   92    93    97  
   93    97    98    99   104   108   109   100  
   97    98   108  
   95    96  
   96  
    0  
   98    99   104   105   108   109   106   100   101   102   103  
   99   104   105   108   109   106   107   110   100   101   102   103  
  104   105   108   109   106   107   110   111   112   100   101   102   103  
  101   102   103   104   106   108  
  102   103  
  103  
    0  
  105   108   109   106   107   110  
  108   109   106  
  107   110   111   112   108  
  110   111   112  
  109  
    0  
  111   112  
  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   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.2500   0.1700  -0.139000   2.2900   2.0360   0.003973653   1.685851020
   41   0.5000   0.0300   0.480000   0.9960   0.8600   0.030040813  -0.651083722
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.7500   0.1050   0.285800   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660   0.275700   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.503000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   59   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   64   3.5000   0.0660  -0.005000   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   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   68   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   70   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   74   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   75   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   77   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   78   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   79   3.5500   0.0760  -0.003300   2.0020   1.7750   0.023028004  -0.852763146
   80   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.7500   0.1050   0.396300   2.0020   1.7750   0.023028004  -0.852763146
   84   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   91   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   92   3.5500   0.0760  -0.118300   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   3.5000   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   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
  105   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  106   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  107   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  108   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
  109   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
  110   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
  111   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  112   2.4200   0.0300   0.115000   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    49   268.000  1.529
   33    38   317.000  1.510
   37    40   335.000  1.413
   37    42   549.000  1.340
   40    41   490.000  1.015
   40    47   635.000  1.286
   47    49   290.000  1.488
   47    51   440.000  1.374
   49    50   340.000  1.090
   49    54   268.000  1.529
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   51    52   553.000  0.945
   42    43   340.000  1.080
   42    48   375.000  1.423
   48    53   546.000  1.367
   48    67   427.000  1.381
   53    58   469.000  1.424
   53    59   285.000  1.502
   58    63   546.000  1.367
   58    64   285.000  1.502
   63    67   427.000  1.381
   63    69   375.000  1.423
   67    68   434.000  1.010
   69    70   340.000  1.080
   69    74   549.000  1.340
   74    78   380.000  1.444
   74    91   405.000  1.380
   78    79   549.000  1.340
   78    80   317.000  1.510
   79    83   320.000  1.464
   79    84   317.000  1.510
   83    91   500.000  1.261
   83    92   320.000  1.464
   92    93   340.000  1.080
   92    97   549.000  1.340
   97    98   380.000  1.444
   97   108   400.000  1.384
   98    99   549.000  1.340
   98   100   317.000  1.510
   99   104   410.000  1.444
   99   106   380.000  1.444
  104   105   570.000  1.229
  104   108   490.000  1.335
  108   109   434.000  1.010
  106   107   340.000  1.080
  106   110   549.000  1.340
  110   111   340.000  1.080
  110   112   340.000  1.080
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    87   340.000  1.090
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    94   317.000  1.522
   94    95   656.000  1.250
   94    96   656.000  1.250
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    75   317.000  1.522
   75    76   656.000  1.250
   75    77   656.000  1.250
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   38    39   340.000  1.080
   38    44   549.000  1.340
   44    45   340.000  1.080
   44    46   340.000  1.080
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    49    75.00000  111.63000
   29    33    38    75.00000  112.20000
   33    37    40    70.00000  115.00000
   33    37    42    70.00000  124.00000
   33    49    47    70.00000  109.02000
   33    49    50    37.50000  110.70000
   33    49    54    58.35000  112.70000
   33    38    39    35.00000  117.00000
   33    38    44    70.00000  124.00000
   37    40    41    45.00000  118.00000
   37    40    47    70.00000  118.46000
   37    42    43    35.00000  120.00000
   37    42    48    55.00000  128.24000
   40    47    49    70.00000  120.65200
   40    47    51   100.00000  117.62000
   47    40    41    45.00000  118.89500
   47    49    50    45.00000  109.33400
   47    49    54    70.00000  109.02000
   47    51    52    70.00000  105.55000
   49    33    37    70.00000  112.02700
   49    54    55    37.50000  110.70000
   49    54    56    37.50000  110.70000
   49    54    57    37.50000  110.70000
   54    49    50    37.50000  110.70000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   51    47    49    85.00000  110.80600
   42    37    40    70.00000  113.56000
   42    48    53    50.00000  133.16000
   42    48    67    70.00000  120.38000
   48    42    43    40.00000  117.26300
   48    53    58    70.00000  107.30000
   48    53    59    60.00000  130.00000
   48    67    63    70.00000  109.80000
   48    67    68    35.00000  120.00000
   53    58    63    70.00000  107.30000
   53    58    64    60.00000  130.00000
   53    59    60    35.00000  109.50000
   53    59    61    35.00000  109.50000
   53    59    62    35.00000  109.50000
   58    63    67    70.00000  107.70000
   58    63    69    50.00000  133.16000
   58    64    65    35.00000  109.50000
   58    64    66    35.00000  109.50000
   58    64    71    70.00000  112.17500
   63    67    68    35.00000  120.00000
   63    69    70    40.00000  117.26300
   63    69    74    55.00000  128.24000
   67    48    53    70.00000  107.70000
   69    63    67    70.00000  120.38000
   69    74    78    70.00000  123.01800
   69    74    91    70.00000  120.83400
   74    69    70    35.00000  120.00000
   74    78    79    70.00000  123.01800
   74    78    80    70.00000  124.00000
   74    91    83    75.00000  115.77100
   78    79    83    60.00000  120.31500
   78    79    84    70.00000  124.00000
   78    80    81    35.00000  109.50000
   78    80    82    35.00000  109.50000
   78    80    88    70.00000  112.02700
   79    83    91    70.00000  121.86000
   79    83    92    65.00000  123.36000
   79    84    85    35.00000  109.50000
   79    84    86    35.00000  109.50000
   79    84    87    35.00000  109.50000
   83    92    93    40.00000  114.85300
   83    92    97    60.00000  120.31500
   91    74    78    70.00000  120.83400
   92    83    91    70.00000  121.86000
   92    97    98    70.00000  123.01800
   92    97   108    75.00000  120.83300
   97    92    93    35.00000  120.00000
   97    98    99    70.00000  123.01800
   97    98   100    70.00000  124.00000
   97   108   104    70.00000  120.89900
   97   108   109    45.00000  117.55000
   98    99   104    70.00000  118.70000
   98    99   106    70.00000  123.01800
   98   100   101    35.00000  109.50000
   98   100   102    35.00000  109.50000
   98   100   103    35.00000  109.50000
   99   104   105    80.00000  125.30000
   99   104   108    80.00000  111.56200
   99   106   107    35.00000  120.00000
   99   106   110    70.00000  123.01800
  104   108   109    35.00000  119.80000
  108    97    98    75.00000  120.83300
  108   104   105    80.00000  122.90000
  106    99   104    70.00000  118.70000
  106   110   111    35.00000  120.00000
  106   110   112    35.00000  120.00000
  110   106   107    35.00000  120.00000
  112   110   111    35.00000  117.00000
  100    98    99    70.00000  124.00000
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
   84    79    83    65.00000  117.22000
   86    84    85    33.00000  107.80000
   87    84    85    33.00000  107.80000
   87    84    86    33.00000  107.80000
   80    78    79    70.00000  124.00000
   80    88    89    37.50000  110.70000
   80    88    90    37.50000  110.70000
   80    88    94    70.00000  109.69300
   82    80    81    33.00000  107.80000
   88    80    81    37.50000  110.70000
   88    80    82    37.50000  110.70000
   88    94    95    70.00000  117.00000
   88    94    96    70.00000  117.00000
   90    88    89    33.00000  107.80000
   94    88    89    35.00000  109.50000
   94    88    90    35.00000  109.50000
   96    94    95    80.00000  126.00000
   64    58    63    60.00000  130.00000
   64    71    72    37.50000  110.70000
   64    71    73    37.50000  110.70000
   64    71    75    70.00000  109.69300
   66    64    65    33.00000  107.80000
   71    64    65    37.50000  110.70000
   71    64    66    37.50000  110.70000
   71    75    76    70.00000  117.00000
   71    75    77    70.00000  117.00000
   73    71    72    33.00000  107.80000
   75    71    72    35.00000  109.50000
   75    71    73    35.00000  109.50000
   77    75    76    80.00000  126.00000
   59    53    58    60.00000  130.00000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   38    33    37    70.00000  110.12100
   38    33    49    70.00000  112.02700
   38    44    45    35.00000  120.00000
   38    44    46    35.00000  120.00000
   44    38    39    35.00000  120.00000
   46    44    45    35.00000  117.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  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    49    47   0.56750  1.0 1.0
   29    33    49    47  -0.07550 -1.0 2.0
   29    33    49    47   0.20000  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    54   0.44750  1.0 1.0
   29    33    49    54  -0.17800 -1.0 2.0
   29    33    49    54   0.20200  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    44   0.42700  1.0 1.0
   29    33    38    44  -0.70350 -1.0 2.0
   29    33    38    44  -0.43150  1.0 3.0
   33    37    40    41   5.00000 -1.0 2.0
   33    37   -40    47   5.00000 -1.0 2.0
   33    37    42    43   7.00000 -1.0 2.0
   33    37    42    48   7.00000 -1.0 2.0
   33    49    54    55   0.15000  1.0 3.0
   33    49    54    56   0.15000  1.0 3.0
   33    49    54    57   0.15000  1.0 3.0
   33    38    44    45   7.00000 -1.0 2.0
   33    38    44    46   7.00000 -1.0 2.0
   37    33   -49    47   0.31000  1.0 1.0
   37    33   -49    47   0.14700 -1.0 2.0
   37    33   -49    47   0.07550  1.0 3.0
   37    33    49    50   0.15000  1.0 3.0
   37    33    49    54   0.34400  1.0 1.0
   37    33    49    54   0.09450 -1.0 2.0
   37    33    49    54   0.11100  1.0 3.0
   37    33    38    39   0.00000  1.0 1.0
   37    33    38    44  -0.28300  1.0 1.0
   37    33    38    44   0.26700 -1.0 2.0
   37    33    38    44  -0.63300  1.0 3.0
   37    40   -47    49   2.00000 -1.0 2.0
   37    40    47    51   2.00000 -1.0 2.0
   37    42    48    53   0.15800  1.0 1.0
   37    42    48    53   1.85350 -1.0 2.0
   37    42    48    53  -0.48700  1.0 3.0
   37    42    48    67   0.11450  1.0 1.0
   37    42    48    67   1.85100 -1.0 2.0
   37    42    48    67  -0.49050  1.0 3.0
   40    37    42    43   7.00000 -1.0 2.0
   40    37    42    48   7.00000 -1.0 2.0
   40    47   -49    33   0.00000  1.0 1.0
   40    47    49    50   0.00000  1.0 1.0
   40    47    49    54   0.00000  1.0 1.0
   40    47    51    52   1.50000 -1.0 2.0
   41    40    47    49   2.00000 -1.0 2.0
   41    40    47    51   2.00000 -1.0 2.0
   47    49    54    55   0.15000  1.0 3.0
   47    49    54    56   0.15000  1.0 3.0
   47    49    54    57   0.15000  1.0 3.0
   49    33   -37    40   0.09700  1.0 1.0
   49    33   -37    40   0.15600 -1.0 2.0
   49    33   -37    40  -0.50800  1.0 3.0
   49    33    37    42   0.09850  1.0 1.0
   49    33    37    42   0.15250 -1.0 2.0
   49    33    37    42  -0.50650  1.0 3.0
   49    33    38    39   0.00000  1.0 1.0
   49    33    38    44   0.09850  1.0 1.0
   49    33    38    44   0.15250 -1.0 2.0
   49    33    38    44  -0.50650  1.0 3.0
   49    47    51    52   1.50000 -1.0 2.0
   50    49    54    55   0.15000  1.0 3.0
   50    49    54    56   0.15000  1.0 3.0
   50    49    54    57   0.15000  1.0 3.0
   51    47    49    33   0.00000  1.0 1.0
   51    47    49    50   0.00000  1.0 1.0
   51    47    49    54   0.00000  1.0 1.0
   42    37    40    41   5.00000 -1.0 2.0
   42    37    40    47   5.00000 -1.0 2.0
   42    48    53    58   3.62500 -1.0 2.0
   42    48    53    59   3.62500 -1.0 2.0
   42    48    67    63   3.62500 -1.0 2.0
   42    48    67    68   2.00000 -1.0 2.0
   43    42    48    53   0.56550  1.0 3.0
   43    42    48    67   0.54250  1.0 3.0
   48    53   -58    63   3.62500 -1.0 2.0
   48    53    58    64   3.62500 -1.0 2.0
   48    53    59    60   0.00000  1.0 1.0
   48    53    59    61   0.00000  1.0 1.0
   48    53    59    62   0.00000  1.0 1.0
   53    48   -67    63   3.62500 -1.0 2.0
   53    48    67    68   2.00000 -1.0 2.0
   53    58   -63    67   3.62500 -1.0 2.0
   53    58    63    69   3.62500 -1.0 2.0
   53    58    64    65   0.00000  1.0 1.0
   53    58    64    66   0.00000  1.0 1.0
   53    58    64    71   0.04150 -1.0 2.0
   58    53    59    60   0.00000  1.0 1.0
   58    53    59    61   0.00000  1.0 1.0
   58    53    59    62   0.00000  1.0 1.0
   58    63   -67    48   3.62500 -1.0 2.0
   58    63    67    68   2.00000 -1.0 2.0
   58    63    69    70   0.56550  1.0 3.0
   58    63    69    74   0.15800  1.0 1.0
   58    63    69    74   1.85350 -1.0 2.0
   58    63    69    74  -0.48700  1.0 3.0
   58    64    71    72   0.43200  1.0 3.0
   58    64    71    73   0.43200  1.0 3.0
   58    64    71    75  -2.95950  1.0 1.0
   58    64    71    75   0.02300  1.0 3.0
   63    58    64    65   0.00000  1.0 1.0
   63    58    64    66   0.00000  1.0 1.0
   63    58    64    71   0.04150 -1.0 2.0
   63    69    74    78   7.00000 -1.0 2.0
   63    69    74    91   7.00000 -1.0 2.0
   67    48   -53    58   3.62500 -1.0 2.0
   67    48    53    59   3.62500 -1.0 2.0
   67    63    69    70   0.54250  1.0 3.0
   67    63    69    74   0.11450  1.0 1.0
   67    63    69    74   1.85100 -1.0 2.0
   67    63    69    74  -0.49050  1.0 3.0
   69    63    67    48   3.62500 -1.0 2.0
   69    63    67    68   2.00000 -1.0 2.0
   69    74    78    79   0.28850  1.0 1.0
   69    74    78    79   2.61350 -1.0 2.0
   69    74    78    79   0.78400  1.0 3.0
   69    74    78    80  -0.18600  1.0 3.0
   69    74    91    83   1.00000 -1.0 2.0
   70    69    74    78   7.00000 -1.0 2.0
   70    69    74    91   7.00000 -1.0 2.0
   74    78   -79    83   7.00000 -1.0 2.0
   74    78    79    84   7.00000 -1.0 2.0
   74    78    80    81   0.00000  1.0 1.0
   74    78    80    82   0.00000  1.0 1.0
   74    78    80    88   0.98200  1.0 1.0
   74    78    80    88  -0.11900 -1.0 2.0
   74    78    80    88   0.24250  1.0 3.0
   78    74   -91    83   1.00000 -1.0 2.0
   78    79   -83    91   1.09650  1.0 1.0
   78    79   -83    91   0.48950 -1.0 2.0
   78    79   -83    91   0.49400  1.0 3.0
   78    79    83    92   0.69550 -1.0 2.0
   78    79    84    85   0.00000  1.0 1.0
   78    79    84    86   0.00000  1.0 1.0
   78    79    84    87   0.00000  1.0 1.0
   78    80    88    89   0.15000  1.0 3.0
   78    80    88    90   0.15000  1.0 3.0
   78    80    88    94  -0.98800  1.0 1.0
   78    80    88    94   0.48800 -1.0 2.0
   78    80    88    94   0.76800  1.0 3.0
   79    78    80    81   0.00000  1.0 1.0
   79    78    80    82   0.00000  1.0 1.0
   79    78    80    88   0.09850  1.0 1.0
   79    78    80    88   0.15250 -1.0 2.0
   79    78    80    88  -0.50650  1.0 3.0
   79    83   -91    74   6.00000 -1.0 2.0
   79    83    92    93   0.00000  1.0 1.0
   79    83    92    97   0.69550 -1.0 2.0
   83    79    84    85   0.00000  1.0 1.0
   83    79    84    86   0.00000  1.0 1.0
   83    79    84    87   0.00000  1.0 1.0
   83    92    97    98   7.00000 -1.0 2.0
   83    92    97   108   7.00000 -1.0 2.0
   91    74   -78    79  -0.18600  1.0 3.0
   91    74    78    80   1.08500 -1.0 2.0
   91    83    92    93   1.00600 -1.0 2.0
   91    83    92    97   1.09650  1.0 1.0
   91    83    92    97   0.48950 -1.0 2.0
   91    83    92    97   0.49400  1.0 3.0
   92    83    91    74   6.00000 -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  -0.18600  1.0 3.0
   92    97   108   104  -0.18900  1.0 1.0
   92    97   108   104   1.70900 -1.0 2.0
   92    97   108   109   0.78350 -1.0 2.0
   93    92    97    98   7.00000 -1.0 2.0
   93    92    97   108   7.00000 -1.0 2.0
   97    98   -99   104   7.00000 -1.0 2.0
   97    98    99   106   7.00000 -1.0 2.0
   97    98   100   101   0.00000  1.0 1.0
   97    98   100   102   0.00000  1.0 1.0
   97    98   100   103   0.00000  1.0 1.0
   98    97  -108   104  -0.18900  1.0 1.0
   98    97  -108   104   1.70900 -1.0 2.0
   98    97   108   109   0.78350 -1.0 2.0
   98    99   104   105   1.00000 -1.0 2.0
   98    99  -104   108   0.49500  1.0 1.0
   98    99  -104   108   1.31600 -1.0 2.0
   98    99  -104   108  -0.02300  1.0 3.0
   98    99   106   107  -0.18600  1.0 3.0
   98    99   106   110   0.28850  1.0 1.0
   98    99   106   110   2.61350 -1.0 2.0
   98    99   106   110   0.78400  1.0 3.0
   99    98   100   101   0.00000  1.0 1.0
   99    98   100   102   0.00000  1.0 1.0
   99    98   100   103   0.00000  1.0 1.0
   99   104  -108    97   2.45000 -1.0 2.0
   99   104   108   109   2.56700 -1.0 2.0
   99   106   110   111   7.00000 -1.0 2.0
   99   106   110   112   7.00000 -1.0 2.0
  104    99   106   107   0.00000  1.0 1.0
  104    99   106   110  -0.18600  1.0 3.0
  105   104   108    97   2.67200 -1.0 2.0
  105   104   108   109   2.45000 -1.0 2.0
  108    97   -98    99  -0.18600  1.0 3.0
  108    97    98   100   1.08500 -1.0 2.0
  106    99   104   105   1.00000 -1.0 2.0
  106    99   104   108   0.49500  1.0 1.0
  106    99   104   108   1.31600 -1.0 2.0
  106    99   104   108  -0.02300  1.0 3.0
  107   106   110   111   7.00000 -1.0 2.0
  107   106   110   112   7.00000 -1.0 2.0
  100    98    99   104   7.00000 -1.0 2.0
  100    98    99   106   7.00000 -1.0 2.0
   84    79    83    91   7.00000 -1.0 2.0
   84    79    83    92   7.00000 -1.0 2.0
   80    78    79    83   7.00000 -1.0 2.0
   80    78    79    84   7.00000 -1.0 2.0
   80    88    94    95   0.41150 -1.0 2.0
   80    88    94    96   0.41150 -1.0 2.0
   81    80    88    89   0.15000  1.0 3.0
   81    80    88    90   0.15000  1.0 3.0
   81    80    88    94  -0.11250  1.0 3.0
   82    80    88    89   0.15000  1.0 3.0
   82    80    88    90   0.15000  1.0 3.0
   82    80    88    94  -0.11250  1.0 3.0
   89    88    94    95   0.00000  1.0 1.0
   89    88    94    96   0.00000  1.0 1.0
   90    88    94    95   0.00000  1.0 1.0
   90    88    94    96   0.00000  1.0 1.0
   64    58    63    67   3.62500 -1.0 2.0
   64    58    63    69   3.62500 -1.0 2.0
   64    71    75    76   0.41150 -1.0 2.0
   64    71    75    77   0.41150 -1.0 2.0
   65    64    71    72   0.15000  1.0 3.0
   65    64    71    73   0.15000  1.0 3.0
   65    64    71    75  -0.11250  1.0 3.0
   66    64    71    72   0.15000  1.0 3.0
   66    64    71    73   0.15000  1.0 3.0
   66    64    71    75  -0.11250  1.0 3.0
   72    71    75    76   0.00000  1.0 1.0
   72    71    75    77   0.00000  1.0 1.0
   73    71    75    76   0.00000  1.0 1.0
   73    71    75    77   0.00000  1.0 1.0
   59    53    58    63   3.62500 -1.0 2.0
   59    53    58    64   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  -0.28300  1.0 1.0
   38    33    37    42   0.26700 -1.0 2.0
   38    33    37    42  -0.63300  1.0 3.0
   38    33    49    47   0.31000  1.0 1.0
   38    33    49    47   0.14700 -1.0 2.0
   38    33    49    47   0.07550  1.0 3.0
   38    33    49    50   0.15000  1.0 3.0
   38    33    49    54   0.34400  1.0 1.0
   38    33    49    54   0.09450 -1.0 2.0
   38    33    49    54   0.11100  1.0 3.0
   39    38    44    45   7.00000 -1.0 2.0
   39    38    44    46   7.00000 -1.0 2.0
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    41    40    47   1.00000 -1.0 2.0
   49    51    47    40  10.50000 -1.0 2.0
   48    43    42    37   1.10000 -1.0 2.0
   53    67    48    42   4.00000 -1.0 2.0
   58    59    53    48   4.00000 -1.0 2.0
   63    64    58    53   4.00000 -1.0 2.0
   69    67    63    58   4.00000 -1.0 2.0
   68    48    67    63   1.00000 -1.0 2.0
   63    70    69    74   1.10000 -1.0 2.0
   78    91    74    69   1.10000 -1.0 2.0
   74    80    78    79   1.10000 -1.0 2.0
   83    84    79    78   1.10000 -1.0 2.0
   79    92    83    91  10.50000 -1.0 2.0
   83    93    92    97   1.10000 -1.0 2.0
   98   108    97    92   1.10000 -1.0 2.0
   97   100    98    99   1.10000 -1.0 2.0
  104   106    99    98   1.10000 -1.0 2.0
   99   108   104   105  10.50000 -1.0 2.0
  109   104   108    97   1.00000 -1.0 2.0
   99   107   106   110  15.00000 -1.0 2.0
  111   112   110   106  15.00000 -1.0 2.0
   95    88    94    96  10.50000 -1.0 2.0
   76    71    75    77  10.50000 -1.0 2.0
   33    39    38    44  15.00000 -1.0 2.0
   45    46    44    38  15.00000 -1.0 2.0
END
