* LIGAND DATABASE FILE (OPLS2005)
*
001     111   117    227    380     688
    1     0 S   NP   _N1_     1    28.15354    98.32468   -22.04271
    2     1 S   H    _HN1     2     1.02956    68.86298     2.03144
    3     1 S   H    _H1_     3     1.02834    44.66728   149.00468
    4     1 S   H    _H2_     4     1.02773    98.75403  -104.34221
    5     1 S   CT   _CA1     5     1.50133   146.60634    97.30949
    6     5 S   HC   _HA1     6     1.09574   105.21139    95.35324
    7     5 S   CO3  _C1_     7     1.53803   112.32620   -24.82273
    8     7 S   O2Z  _O11     8     1.26368   114.98800   -43.93324
    9     7 S   O2Z  _O12     9     1.26223   114.91807   135.09593
   10     5 S   CT   _CB1    10     1.53096   107.41641  -146.73528
   11    10 S   HC   HB11    11     1.09826   109.36326   -50.20459
   12    10 S   HC   HB12    12     1.09816   110.41382    66.36349
   13    10 S   CT   _CG1    13     1.53010   112.66668  -171.26702
   14    13 S   HC   HG11    14     1.09604   110.46496   -63.85565
   15    13 S   HC   HG12    15     1.09653   109.94651    55.33434
   16    13 S   C    _CD1    16     1.51860   112.32274   175.70997
   17    16 S   O    _OE1    17     1.22746   123.30653    -0.74019
   18    16 S   N    _N2_    18     1.38524   111.66800   179.15281
   19    18 S   H    _HN2    19     1.01565   118.99614     4.90528
   20    18 S   CT1  _CA2    20     1.45904   123.05768   178.89252
   21    20 S   HC   _HA2    21     1.09727   108.98864    21.43683
   22    20 S   C    _C2_    22     1.52868   107.07091   -95.66976
   23    22 S   O    _O2_    23     1.22979   123.04257   -26.45646
   24    20 S   CT   _CB2    32     1.53163   111.90148   144.42793
   25    24 S   HC   HB21    33     1.09491   109.95949    55.51306
   26    24 S   HC   HB22    34     1.09523   110.54343   174.35066
   27    22 S   N    _N3_    24     1.38492   112.57116   156.21602
   28    27 S   H    _HN3    25     1.01659   120.36782    -2.02458
   29    24 S   S    _SG2    35     1.82620   110.72707   -65.94600
   30    27 S   CT   _CA3    26     1.45355   122.45953   178.64925
   31    30 S   HC   HA31    27     1.09568   107.75794   -56.74434
   32    30 S   HC   HA32    28     1.09564   107.65314    59.57727
   33    29 S   CT   _C14    36     1.85195    99.93292   169.10800
   34    33 S   HC   _H7_    37     1.09958   104.81517    30.55873
   35    30 S   CO3  _C3_    29     1.52886   114.35089  -178.64088
   36    35 S   O2Z  _O31    30     1.26331   116.06999    -0.77228
   37    35 S   O2Z  _O32    31     1.26441   114.40488   179.21217
   38    33 S   CT   _C13    38     1.55485   106.26751   -83.52007
   39    38 S   HC   _H19    39     1.09615   109.85658   163.19381
   40    38 S   HC   _H20    40     1.09716   110.53831    48.49938
   41    33 S   CT   _C15    79     1.59159   116.04380   150.80935
   42    41 S   OM   _O42    80     1.33233   104.19515  -165.75496
   43    38 S   CT   _C12    41     1.53576   112.02117   -73.99149
   44    43 S   HC   _H6_    42     1.09922   107.06618    55.93498
   45    43 S   CT   _C11    43     1.53680   112.18479   170.20606
   46    45 S   HC   _H17    44     1.09765   110.22311   -52.92904
   47    45 S   HC   _H18    45     1.09576   112.05395    63.93353
   48    45 S   CT   _C10    46     1.52778   109.50067  -172.46514
   49    48 S   HC   _H5_    47     1.09866   108.23685    64.45573
   50    48 S   CT   _C19    48     1.52645   111.67409   -56.71927
   51    50 S   HC   _H9_    49     1.09593   110.50357   -66.86210
   52    48 S   OS   _O35   105     1.43076   109.96761  -177.73108
   53    50 S   CT   _C18    50     1.53406   111.58624    55.08637
   54    53 S   HC   _H21    51     1.09878   108.62536    67.93459
   55    53 S   HC   _H22    52     1.09697   108.45461  -178.20856
   56    50 S   OS   _O36    93     1.43384   108.72327   175.84758
   57    43 S   CT   _C17    53     1.56067   112.43760   -61.00435
   58    56 S   CO   _C8_    94     1.43133   111.32302    59.71002
   59    57 S   CT   _C16    54     1.59926   107.83264    57.14149
   60    59 S   HC   _H8_    55     1.10023   102.65313    62.30257
   61    57 S   CT   _C20    89     1.55545   111.34502   -67.20007
   62    61 S   HC   _H23    90     1.09029   113.44397    59.56189
   63    61 S   HC   _H24    91     1.09330   112.41570   -59.49967
   64    61 S   HC   _H25    92     1.09344   112.03923  -178.54815
   65    58 S   CO4  _C7_    95     1.52431   105.82938  -174.08484
   66    65 S   O    _O33    96     1.23097   122.22832  -100.69019
   67    58 S   OH   _O43   110     1.42219   111.63169    67.57741
   68    67 S   HO   _H38   111     0.97306   107.15545    75.01723
   69    59 S   CT   _C21    56     1.54959   113.05189   175.29647
   70    69 S   HC   _H10    57     1.09278   110.39488    18.77522
   71    65 S   CT   _C6_    97     1.50767   116.23030    76.31764
   72    71 S   HC   _H15    98     1.09473   109.43070   171.35791
   73    71 S   HC   _H16    99     1.09566   107.58421   -70.53246
   74    69 S   CO4  _C22    58     1.52290   116.75130   139.60102
   75    74 S   O    _O37    59     1.23645   118.58276  -147.44276
   76    69 S   OH   _O41    87     1.42414   109.40895   -97.97797
   77    76 S   HO   _H37    88     0.97296   107.31827   168.40177
   78    71 S   CT   _C5_   100     1.52203   108.22303    50.35223
   79    78 S   HC   _H3_   101     1.09754   110.88272    61.56137
   80    74 S   CT   _C23    60     1.53838   120.04937    38.04325
   81    78 S   OS   _O34   102     1.42846   109.40853   -58.59334
   82    78 S   CT   _C4_   106     1.52198   110.93236  -177.26691
   83    82 S   HC   _H12   107     1.09562   111.02810    60.79976
   84    82 S   HC   _H13   108     1.09416   111.34694   -60.53662
   85    82 S   HC   _H14   109     1.09532   110.33862   178.83031
   86    80 S   CT   _C27    61     1.57141   107.84906    85.50992
   87    86 S   HC   _H11    62     1.09894   108.84430   -28.92370
   88    80 S   CT   _C32    83     1.54846   108.49899  -153.36086
   89    88 S   HC   _H34    84     1.09550   111.68698  -174.57234
   90    88 S   HC   _H35    85     1.09512   111.41413    64.49464
   91    88 S   HC   _H36    86     1.09506   112.33147   -54.11031
   92    58 S   CO   _C9_   103     1.54435   111.43113   -55.03886
   93    92 S   HC   _H4_   104     1.09691   110.17864   168.63174
   94    86 S   CM   _C28    63     1.50562   118.44691    90.62496
   95    86 S   CT   _C26    72     1.52442   103.52344  -140.87248
   96    95 S   HC   _H28    73     1.09660   112.17557   -77.12605
   97    95 S   HC   _H29    74     1.09512   112.35891   160.74876
   98    94 S   CM   _C29    64     1.33290   128.51975   109.35786
   99    98 S   HC   _H30    65     1.07599   128.90895    -1.98672
  100    95 S   CT   _C25    75     1.52058   102.47345    40.95587
  101   100 S   HC   _H26    76     1.09359   108.96573    74.60608
  102   100 S   HC   _H27    77     1.09305   107.44023  -166.97764
  103    98 S   CO4  _C30    66     1.46263   107.20375   177.27236
  104   103 S   O    _O38    67     1.21859   125.04404   179.42699
  105    80 S   CT   _C24    78     1.59881   111.77193   -30.29150
  106   103 S   OS   _O39    68     1.36180   109.05123    -0.96975
  107   105 S   OH   _O40    81     1.44578   110.05114  -138.78493
  108   107 S   HO   _H33    82     0.97433   105.98161    83.52591
  109    94 S   CT   _C31    69     1.48304   121.22512   -74.18780
  110   109 S   HC   _H31    70     1.09398   112.18746   -59.20892
  111   109 S   HC   _H32    71     1.09172   113.00295    65.67115
  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   8   2   1   1  15   6   5  21   8  19   8  13   6   5  13
   6  13   7   9  12   5   4  10  11  11  15   6   4   2   1   1
  12   6   5   1   9   5  10   5   4  15   5   2   1   8   6  18
   6   4   2   1   1  21   9   8   3   2   1   1   1  13   9   5
   4   7   4   5   3   2   5   2   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    59   105    41    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    44    45    57    59    60    69    80   100   105    41    42   107  
   38    39    40    43    59   105    41    42  
   36    37  
   37  
    0  
   39    40    43    44    45    46    47    48    53    57    59   105    41    42    61  
   40    43    44    45    57    41  
   43    44    45    57    41  
   42   107   108    88    76    61    43    53    57    59    60    69    70    74    80    86    95   100   101   102   105  
  107    57    59    60    69    80   100   105  
   44    45    46    47    48    49    50    53    54    55    57    59    60    69    61    62    63    64    52  
   45    46    47    48    53    57    59    61  
   46    47    48    49    50    51    53    57    59    61    56    92    52  
   47    48    49    50    57    52  
   48    49    50    57    52  
   49    50    51    53    54    55    57    56    58    81    92    93    52  
   50    51    53    56    92    52  
   51    53    54    55    57    59    61    56    58    65    92    52    67  
   53    54    55    57    56    58    52  
   67    53    56    58    65    78    81    92    93  
   54    55    57    59    60    69    61    62    63    64    56    58  
   55    57    59    61    56  
   57    59    61    56  
   58    65    66    71    81    92    93    67    68    57  
   59    60    69    70    74   105    76    61    62    63    64  
   65    66    71    72    73    78    81    92    93    67    68  
   60    69    70    74    75    80   100   105   107    76    77    61    62    63    64  
   69    70    74   105    76    61  
   62    63    64    69  
   63    64  
   64  
    0  
   66    71    72    73    78    79    81    92    93    82    67    68  
   71    72    73    78    92    67  
   68    71    81    92    93  
   92  
   70    74    75    80    86   105    88    76    77  
   74    75    80    76    77  
   72    73    78    79    81    92    82    83    84    85  
   73    78    79    81    82  
   78    79    81    82  
   75    80    86    87    94    95   100   105   107    88    89    90    91    76    77  
   80    86   105    88    76  
   77    80  
    0  
   79    81    92    93    82    83    84    85  
   81    92    82    83    84    85  
   86    87    94    98   109    95    96    97   100   101   102   105   107   108    88    89    90    91  
   92    93    82    83    84    85  
   83    84    85    92  
   84    85  
   85  
    0  
   87    94    98    99   103   106   109   110   111    95    96    97   100   101   102   105   107    88    89    90    91  
   94    98   109    95    96    97   100   105    88  
   89    90    91    94    95   100   105   107  
   90    91   105  
   91   105  
  105  
   93  
    0  
   98    99   103   104   106   109   110   111    95    96    97   100   105  
   96    97   100   101   102   105   107    98   109  
   97   100   101   102   105  
  100   101   102   105  
   99   103   104   106   109   110   111  
  103   104   106   109  
  101   102   105   107   108  
  102   105   107  
  105   107  
  104   106   109   110   111  
  106   109  
  107   108  
  109   110   111  
  108  
    0  
  110   111  
  111  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   57   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   58   3.5000   0.0660   0.364700   1.9750   1.7500   0.005000000  -0.741685710
   59   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   67   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   73   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   74   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   76   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   77   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   78   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   82   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   95   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   99   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660  -0.120000   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  104   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  105   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
  106   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
  107   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  108   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  109   3.5000   0.0660   0.259000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
  111   2.4200   0.0150   0.030000   1.3810   1.2100   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    34   340.000  1.090
   33    38   268.000  1.529
   33    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   268.000  1.529
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    57   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    52   320.000  1.410
   50    51   340.000  1.090
   50    53   268.000  1.529
   50    56   320.000  1.410
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    57   268.000  1.529
   57    59   268.000  1.529
   57    61   268.000  1.529
   59    60   340.000  1.090
   59    69   268.000  1.529
   59    41   268.000  1.529
   69    70   340.000  1.090
   69    74   317.000  1.522
   69    76   320.000  1.410
   74    75   570.000  1.229
   74    80   317.000  1.522
   80    86   268.000  1.529
   80   105   268.000  1.529
   80    88   268.000  1.529
   86    87   340.000  1.090
   86    94   317.000  1.510
   86    95   268.000  1.529
   94    98   549.000  1.340
   94   109   317.000  1.510
   98    99   340.000  1.080
   98   103   320.000  1.462
  103   104   570.000  1.229
  103   106   214.000  1.327
  106   109   320.000  1.410
  109   110   340.000  1.090
  109   111   340.000  1.090
   95    96   340.000  1.090
   95    97   340.000  1.090
   95   100   268.000  1.529
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   105   268.000  1.529
  105    41   268.000  1.529
  105   107   320.000  1.410
   41    42   570.000  1.307
  107   108   553.000  0.945
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   340.000  1.090
   76    77   553.000  0.945
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   56    58   320.000  1.380
   58    65   235.000  1.518
   58    92   250.000  1.527
   58    67   380.000  1.407
   65    66   570.000  1.229
   65    71   317.000  1.522
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    78   268.000  1.529
   78    79   340.000  1.090
   78    81   320.000  1.410
   78    82   268.000  1.529
   81    92   320.000  1.380
   92    93   340.000  1.090
   92    52   320.000  1.380
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   67    68   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    58.35000  112.70000
   33    41    59    58.35000  112.70000
   33    41   105    58.35000  112.70000
   33    41    42    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    43    44    37.50000  110.70000
   38    43    45    58.35000  112.70000
   38    43    57    58.35000  112.70000
   40    38    39    33.00000  107.80000
   43    38    39    37.50000  110.70000
   43    38    40    37.50000  110.70000
   43    45    46    37.50000  110.70000
   43    45    47    37.50000  110.70000
   43    45    48    58.35000  112.70000
   43    57    53    58.35000  112.70000
   43    57    59    58.35000  112.70000
   43    57    61    58.35000  112.70000
   45    43    44    37.50000  110.70000
   45    48    49    37.50000  110.70000
   45    48    50    58.35000  112.70000
   45    48    52    50.00000  109.50000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    50    51    37.50000  110.70000
   48    50    53    58.35000  112.70000
   48    50    56    50.00000  109.50000
   48    52    92    60.00000  109.50000
   50    48    49    37.50000  110.70000
   50    53    54    37.50000  110.70000
   50    53    55    37.50000  110.70000
   50    53    57    58.35000  112.70000
   50    56    58    60.00000  109.50000
   53    50    51    37.50000  110.70000
   53    57    59    58.35000  112.70000
   53    57    61    58.35000  112.70000
   55    53    54    33.00000  107.80000
   57    43    44    37.50000  110.70000
   57    43    45    58.35000  112.70000
   57    53    54    37.50000  110.70000
   57    53    55    37.50000  110.70000
   57    59    60    37.50000  110.70000
   57    59    69    58.35000  112.70000
   57    59    41    58.35000  112.70000
   57    61    62    37.50000  110.70000
   57    61    63    37.50000  110.70000
   57    61    64    37.50000  110.70000
   59    69    70    37.50000  110.70000
   59    69    74    63.00000  111.10000
   59    69    76    50.00000  109.50000
   59    41   105    58.35000  112.70000
   59    41    42    50.00000  109.50000
   69    59    60    37.50000  110.70000
   69    74    75    80.00000  120.40000
   69    74    80    70.00000  116.00000
   69    76    77    55.00000  108.50000
   74    69    70    35.00000  109.50000
   74    80    86    63.00000  111.10000
   74    80   105    63.00000  111.10000
   74    80    88    63.00000  111.10000
   80    74    75    80.00000  120.40000
   80    86    87    37.50000  110.70000
   80    86    94    70.00000  112.02700
   80    86    95    58.35000  112.70000
   80   105   100    58.35000  112.70000
   80   105    41    58.35000  112.70000
   80   105   107    50.00000  109.50000
   80    88    89    37.50000  110.70000
   80    88    90    37.50000  110.70000
   80    88    91    37.50000  110.70000
   86    94    98    70.00000  124.00000
   86    94   109    65.00000  117.92700
   86    95    96    37.50000  110.70000
   86    95    97    37.50000  110.70000
   86    95   100    58.35000  112.70000
   94    86    87    35.00000  109.50000
   94    98    99    35.00000  120.00000
   94    98   103    65.00000  118.96000
   94   109   106    85.00000  110.90400
   94   109   110    35.00000  109.50000
   94   109   111    35.00000  109.50000
   98   103   104    80.00000  123.72100
   98   103   106    90.00000  111.29400
  103    98    99    40.00000  117.72500
  103   106   109    83.00000  116.90000
  106   103   104    83.00000  123.40000
  106   109   110    35.00000  109.50000
  106   109   111    35.00000  109.50000
  109    94    98    70.00000  124.00000
  111   109   110    33.00000  107.80000
   95    86    87    37.50000  110.70000
   95    86    94    70.00000  112.02700
   95   100   101    37.50000  110.70000
   95   100   102    37.50000  110.70000
   95   100   105    58.35000  112.70000
   97    95    96    33.00000  107.80000
  100    95    96    37.50000  110.70000
  100    95    97    37.50000  110.70000
  100   105    41    58.35000  112.70000
  100   105   107    50.00000  109.50000
  102   100   101    33.00000  107.80000
  105    80    86    58.35000  112.70000
  105   100   101    37.50000  110.70000
  105   100   102    37.50000  110.70000
  105    41    42    50.00000  109.50000
  105   107   108    55.00000  108.50000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41    59    60    37.50000  110.70000
   41    59    69    58.35000  112.70000
  107   105    41    50.00000  109.50000
   88    80    86    58.35000  112.70000
   88    80   105    58.35000  112.70000
   90    88    89    33.00000  107.80000
   91    88    89    33.00000  107.80000
   91    88    90    33.00000  107.80000
   76    69    70    35.00000  109.50000
   76    69    74    90.00000  109.61100
   61    57    59    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   56    50    51    35.00000  109.50000
   56    50    53    50.00000  109.50000
   56    58    65    90.00000  107.81500
   56    58    92    90.00000  108.56700
   56    58    67   110.00000  112.08000
   58    65    66    75.00000  120.68000
   58    65    71    70.00000  116.00000
   58    92    81    90.00000  108.56700
   58    92    93    45.00000  112.01100
   58    92    52    90.00000  108.56700
   58    67    68    70.00000  107.92000
   65    71    72    35.00000  109.50000
   65    71    73    35.00000  109.50000
   65    71    78    63.00000  111.10000
   71    65    66    80.00000  120.40000
   71    78    79    37.50000  110.70000
   71    78    81    50.00000  109.50000
   71    78    82    58.35000  112.70000
   73    71    72    33.00000  107.80000
   78    71    72    37.50000  110.70000
   78    71    73    37.50000  110.70000
   78    81    92    60.00000  109.50000
   78    82    83    37.50000  110.70000
   78    82    84    37.50000  110.70000
   78    82    85    37.50000  110.70000
   81    78    79    35.00000  109.50000
   81    92    93    35.00000  109.50000
   81    92    52    92.60000  111.55000
   92    58    65    65.00000  114.32000
   52    48    49    35.00000  109.50000
   52    48    50    50.00000  109.50000
   52    92    93    35.00000  109.50000
   82    78    79    37.50000  110.70000
   82    78    81    50.00000  109.50000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   67    58    65    90.00000  109.61100
   67    58    92    90.00000  110.19100
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
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   86    94   109   106   0.15600 -1.0 2.0
   86    94   109   106  -0.50800  1.0 3.0
   86    94   109   110   0.34800  1.0 3.0
   86    94   109   111   0.34800  1.0 3.0
   86    95   100   101   0.15000  1.0 3.0
   86    95   100   102   0.15000  1.0 3.0
   86    95  -100   105   0.56750  1.0 1.0
   86    95  -100   105  -0.07550 -1.0 2.0
   86    95  -100   105   0.20000  1.0 3.0
   87    86    94    98   0.00000  1.0 1.0
   87    86    94   109   0.34800  1.0 3.0
   87    86    95    96   0.15000  1.0 3.0
   87    86    95    97   0.15000  1.0 3.0
   87    86    95   100   0.15000  1.0 3.0
   94    86    95    96   0.15000  1.0 3.0
   94    86    95    97   0.15000  1.0 3.0
   94    86    95   100   0.34400  1.0 1.0
   94    86    95   100   0.09450 -1.0 2.0
   94    86    95   100   0.11100  1.0 3.0
   94    98   103   104   1.00000 -1.0 2.0
   94    98  -103   106  -0.56150  1.0 1.0
   94    98  -103   106   2.19150 -1.0 2.0
   98    94  -109   106   0.39000  1.0 1.0
   98    94  -109   106  -0.05800 -1.0 2.0
   98    94  -109   106  -0.55150  1.0 3.0
   98    94   109   110   0.00000  1.0 1.0
   98    94   109   111   0.00000  1.0 1.0
   98   103  -106   109   2.00000 -1.0 2.0
   99    98   103   104   0.00000  1.0 1.0
   99    98   103   106   1.63100 -1.0 2.0
  103   106  -109    94  -0.82050  1.0 1.0
  103   106  -109    94   0.00600 -1.0 2.0
  103   106  -109    94   0.04400  1.0 3.0
  103   106   109   110   0.08050  1.0 3.0
  103   106   109   111   0.08050  1.0 3.0
  104   103   106   109   3.00000 -1.0 2.0
  109    94    98    99   7.00000 -1.0 2.0
  109    94   -98   103   7.00000 -1.0 2.0
   95    86    94    98   0.09850  1.0 1.0
   95    86    94    98   0.15250 -1.0 2.0
   95    86    94    98  -0.50650  1.0 3.0
   95    86    94   109   0.46850  1.0 1.0
   95    86    94   109   0.08550 -1.0 2.0
   95    86    94   109   0.09800  1.0 3.0
   95   100  -105    80   0.56750  1.0 1.0
   95   100  -105    80  -0.07550 -1.0 2.0
   95   100  -105    80   0.20000  1.0 3.0
   95   100   105    41   0.56750  1.0 1.0
   95   100   105    41  -0.07550 -1.0 2.0
   95   100   105    41   0.20000  1.0 3.0
   95   100   105   107   0.86500  1.0 1.0
   95   100   105   107  -0.17500 -1.0 2.0
   95   100   105   107   0.20800  1.0 3.0
   96    95   100   101   0.15000  1.0 3.0
   96    95   100   102   0.15000  1.0 3.0
   96    95   100   105   0.15000  1.0 3.0
   97    95   100   101   0.15000  1.0 3.0
   97    95   100   102   0.15000  1.0 3.0
   97    95   100   105   0.15000  1.0 3.0
  100   105    41    33   0.56750  1.0 1.0
  100   105    41    33  -0.07550 -1.0 2.0
  100   105    41    33   0.20000  1.0 3.0
  100   105    41    59   0.56750  1.0 1.0
  100   105    41    59  -0.07550 -1.0 2.0
  100   105    41    59   0.20000  1.0 3.0
  100   105    41    42   0.62750  1.0 1.0
  100   105    41    42  -0.30950 -1.0 2.0
  100   105    41    42   0.27300  1.0 3.0
  100   105   107   108  -0.11600  1.0 1.0
  100   105   107   108  -0.09450 -1.0 2.0
  100   105   107   108   0.21250  1.0 3.0
  101   100   105    80   0.15000  1.0 3.0
  101   100   105    41   0.15000  1.0 3.0
  101   100   105   107   0.23400  1.0 3.0
  102   100   105    80   0.15000  1.0 3.0
  102   100   105    41   0.15000  1.0 3.0
  102   100   105   107   0.23400  1.0 3.0
  105    80    86    87   0.15000  1.0 3.0
  105    80    86    94   0.34400  1.0 1.0
  105    80    86    94   0.09450 -1.0 2.0
  105    80    86    94   0.11100  1.0 3.0
  105    80   -86    95   0.56750  1.0 1.0
  105    80   -86    95  -0.07550 -1.0 2.0
  105    80   -86    95   0.20000  1.0 3.0
  105    80    88    89   0.15000  1.0 3.0
  105    80    88    90   0.15000  1.0 3.0
  105    80    88    91   0.15000  1.0 3.0
   41    33    38    39   0.15000  1.0 3.0
   41    33    38    40   0.15000  1.0 3.0
   41    33   -38    43   0.56750  1.0 1.0
   41    33   -38    43  -0.07550 -1.0 2.0
   41    33   -38    43   0.20000  1.0 3.0
   41    59    69    70   0.15000  1.0 3.0
   41    59   -69    74  -0.95700  1.0 1.0
   41    59   -69    74  -0.18200 -1.0 2.0
   41    59   -69    74   0.29450  1.0 3.0
   41    59    69    76   0.86500  1.0 1.0
   41    59    69    76  -0.17500 -1.0 2.0
   41    59    69    76   0.20800  1.0 3.0
   41   105   107   108  -0.11600  1.0 1.0
   41   105   107   108  -0.09450 -1.0 2.0
   41   105   107   108   0.21250  1.0 3.0
  107   105    41    33   0.86500  1.0 1.0
  107   105    41    33  -0.17500 -1.0 2.0
  107   105    41    33   0.20800  1.0 3.0
  107   105    41    59   0.86500  1.0 1.0
  107   105    41    59  -0.17500 -1.0 2.0
  107   105    41    59   0.20800  1.0 3.0
  107   105    41    42   3.69350  1.0 1.0
  107   105    41    42  -1.82950 -1.0 2.0
   88    80    86    87   0.15000  1.0 3.0
   88    80    86    94   0.34400  1.0 1.0
   88    80    86    94   0.09450 -1.0 2.0
   88    80    86    94   0.11100  1.0 3.0
   88    80    86    95   0.56750  1.0 1.0
   88    80    86    95  -0.07550 -1.0 2.0
   88    80    86    95   0.20000  1.0 3.0
   88    80   105   100   0.56750  1.0 1.0
   88    80   105   100  -0.07550 -1.0 2.0
   88    80   105   100   0.20000  1.0 3.0
   88    80   105    41   0.56750  1.0 1.0
   88    80   105    41  -0.07550 -1.0 2.0
   88    80   105    41   0.20000  1.0 3.0
   88    80   105   107   0.86500  1.0 1.0
   88    80   105   107  -0.17500 -1.0 2.0
   88    80   105   107   0.20800  1.0 3.0
   76    69    74    75   0.30150 -1.0 2.0
   76    69    74    80   0.55300  1.0 1.0
   76    69    74    80   1.25850 -1.0 2.0
   76    69    74    80  -0.23600  1.0 3.0
   61    57    59    60   0.15000  1.0 3.0
   61    57    59    69   0.56750  1.0 1.0
   61    57    59    69  -0.07550 -1.0 2.0
   61    57    59    69   0.20000  1.0 3.0
   61    57    59    41   0.56750  1.0 1.0
   61    57    59    41  -0.07550 -1.0 2.0
   61    57    59    41   0.20000  1.0 3.0
   56    50    53    54   0.23400  1.0 3.0
   56    50    53    55   0.23400  1.0 3.0
   56    50    53    57   0.62750  1.0 1.0
   56    50    53    57  -0.30950 -1.0 2.0
   56    50    53    57   0.27300  1.0 3.0
   56    58    65    66   0.30150 -1.0 2.0
   56    58    65    71   0.55300  1.0 1.0
   56    58    65    71   1.25850 -1.0 2.0
   56    58    65    71  -0.23600  1.0 3.0
   56    58    92    81   1.11900  1.0 1.0
   56    58    92    81  -1.16350 -1.0 2.0
   56    58    92    81  -0.34150  1.0 3.0
   56    58    92    93   0.23400  1.0 3.0
   56    58    92    52   1.11900  1.0 1.0
   56    58    92    52  -1.16350 -1.0 2.0
   56    58    92    52  -0.34150  1.0 3.0
   56    58    67    68  -0.50000  1.0 1.0
   56    58    67    68  -0.73950 -1.0 2.0
   56    58    67    68   0.17150  1.0 3.0
   58    65    71    72   0.00000  1.0 1.0
   58    65    71    73   0.00000  1.0 1.0
   58    65    71    78   0.60050  1.0 1.0
   58    65    71    78   0.05600 -1.0 2.0
   58    65    71    78   0.26150  1.0 3.0
   58    92   -52    48   0.06250  1.0 1.0
   58    92   -52    48  -0.01100 -1.0 2.0
   58    92   -52    48   0.28050  1.0 3.0
   65    58    92    81  -0.09450  1.0 1.0
   65    58    92    81  -1.12950 -1.0 2.0
   65    58    92    81   0.54000  1.0 3.0
   65    58    92    93  -0.11250  1.0 3.0
   65    58    92    52  -0.09450  1.0 1.0
   65    58    92    52  -1.12950 -1.0 2.0
   65    58    92    52   0.54000  1.0 3.0
   65    58    67    68   0.91850  1.0 1.0
   65    58    67    68   0.57950  1.0 3.0
   65    71    78    79  -0.11250  1.0 3.0
   65    71   -78    81  -0.09450  1.0 1.0
   65    71   -78    81  -1.12950 -1.0 2.0
   65    71   -78    81   0.54000  1.0 3.0
   65    71    78    82  -0.95700  1.0 1.0
   65    71    78    82  -0.18200 -1.0 2.0
   65    71    78    82   0.29450  1.0 3.0
   66    65    71    72   0.00000  1.0 1.0
   66    65    71    73   0.00000  1.0 1.0
   66    65    71    78   0.30150 -1.0 2.0
   71    78    81    92   0.06250  1.0 1.0
   71    78    81    92  -0.01100 -1.0 2.0
   71    78    81    92   0.28050  1.0 3.0
   71    78    82    83   0.15000  1.0 3.0
   71    78    82    84   0.15000  1.0 3.0
   71    78    82    85   0.15000  1.0 3.0
   72    71    78    79   0.15000  1.0 3.0
   72    71    78    81   0.23400  1.0 3.0
   72    71    78    82   0.15000  1.0 3.0
   73    71    78    79   0.15000  1.0 3.0
   73    71    78    81   0.23400  1.0 3.0
   73    71    78    82   0.15000  1.0 3.0
   78    81   -92    58   0.06250  1.0 1.0
   78    81   -92    58  -0.01100 -1.0 2.0
   78    81   -92    58   0.28050  1.0 3.0
   78    81    92    93   0.37050  1.0 3.0
   78    81    92    52  -0.53350  1.0 1.0
   78    81    92    52  -0.78350 -1.0 2.0
   78    81    92    52   0.33750  1.0 3.0
   79    78    81    92   0.37050  1.0 3.0
   79    78    82    83   0.15000  1.0 3.0
   79    78    82    84   0.15000  1.0 3.0
   79    78    82    85   0.15000  1.0 3.0
   81    78    82    83   0.23400  1.0 3.0
   81    78    82    84   0.23400  1.0 3.0
   81    78    82    85   0.23400  1.0 3.0
   81    92    52    48  -0.53350  1.0 1.0
   81    92    52    48  -0.78350 -1.0 2.0
   81    92    52    48   0.33750  1.0 3.0
   92    58    65    66   0.30150 -1.0 2.0
   92    58   -65    71   0.60050  1.0 1.0
   92    58   -65    71   0.05600 -1.0 2.0
   92    58   -65    71   0.26150  1.0 3.0
   92    58    67    68  -0.11600  1.0 1.0
   92    58    67    68  -0.09450 -1.0 2.0
   92    58    67    68   0.21250  1.0 3.0
   93    92    52    48   0.37050  1.0 3.0
   52    48    50    51   0.23400  1.0 3.0
   52    48    50    53   0.62750  1.0 1.0
   52    48    50    53  -0.30950 -1.0 2.0
   52    48    50    53   0.27300  1.0 3.0
   52    48   -50    56   1.11900  1.0 1.0
   52    48   -50    56  -1.16350 -1.0 2.0
   52    48   -50    56  -0.34150  1.0 3.0
   82    78    81    92   0.06250  1.0 1.0
   82    78    81    92  -0.01100 -1.0 2.0
   82    78    81    92   0.28050  1.0 3.0
   67    58    65    66   0.30150 -1.0 2.0
   67    58    65    71   0.55300  1.0 1.0
   67    58    65    71   1.25850 -1.0 2.0
   67    58    65    71  -0.23600  1.0 3.0
   67    58    92    81   3.69350  1.0 1.0
   67    58    92    81  -1.82950 -1.0 2.0
   67    58    92    93   0.23400  1.0 3.0
   67    58    92    52   3.69350  1.0 1.0
   67    58    92    52  -1.82950 -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
   36    30    35    37  10.50000 -1.0 2.0
   69    80    74    75  10.50000 -1.0 2.0
   86   109    94    98   1.10000 -1.0 2.0
  103    99    98    94   1.10000 -1.0 2.0
   98   106   103   104  10.50000 -1.0 2.0
   58    71    65    66  10.50000 -1.0 2.0
END
