* LIGAND DATABASE FILE (OPLS2005)
*
001     101   104    197    312     591
    1     0 S   NP   _N1_     1    28.32845    96.03619   -20.57488
    2     1 S   H    _HN1     2     1.02761    89.42322   -90.74695
    3     1 S   H    _H1_     3     1.03197    77.68894    17.68205
    4     1 S   H    _H2_     4     1.02803    41.74949   151.16342
    5     1 S   CT   _CA1     5     1.50008   151.17777   129.11341
    6     5 S   HC   _HA1     6     1.09583   104.97643    75.68565
    7     5 S   CO3  _C1_     7     1.53818   112.56934   -44.23472
    8     7 S   O2Z  _O11     8     1.26349   115.11360   -42.82484
    9     7 S   O2Z  _O12     9     1.26258   114.92395   135.96088
   10     5 S   CT   _CB1    10     1.53128   107.61122  -166.44504
   11    10 S   HC   HB11    11     1.09815   109.49544   -46.84517
   12    10 S   HC   HB12    12     1.09810   110.55618    69.97480
   13    10 S   CT   _CG1    13     1.53009   112.27350  -167.67488
   14    13 S   HC   HG11    14     1.09464   110.56481   -64.16908
   15    13 S   HC   HG12    15     1.09694   109.75968    54.63916
   16    13 S   C    _CD1    16     1.51888   112.65445   174.64580
   17    16 S   O    _OE1    17     1.22717   123.35910    -1.71863
   18    16 S   N    _N2_    18     1.38670   111.51564   179.23972
   19    18 S   H    _HN2    19     1.01597   118.73848    -0.86592
   20    18 S   CT1  _CA2    20     1.46278   123.70236   175.56306
   21    20 S   HC   _HA2    21     1.09741   109.38772    -5.57615
   22    20 S   C    _C2_    22     1.53512   108.12613  -120.77251
   23    22 S   O    _O2_    23     1.23037   122.42383  -147.29514
   24    20 S   CT   _CB2    32     1.53312   111.57925   116.87205
   25    24 S   HC   HB21    33     1.09596   110.06013    51.43834
   26    24 S   HC   HB22    34     1.09497   110.74654   170.82168
   27    22 S   N    _N3_    24     1.38390   113.52541    40.23418
   28    27 S   H    _HN3    25     1.01628   119.52666    -3.60027
   29    24 S   S    _SG2    35     1.82450   111.43821   -69.71220
   30    27 S   CT   _CA3    26     1.45284   123.11542   176.97988
   31    30 S   HC   HA31    27     1.09552   107.54724   -63.48335
   32    30 S   HC   HA32    28     1.09560   107.91817    52.91399
   33    29 S   CT   _C25    36     1.82445    98.86119   170.13632
   34    33 S   HC   _H3_    37     1.09504   109.93443   -55.87652
   35    33 S   HC   _H4_    38     1.09596   107.91262    60.39641
   36    30 S   CO3  _C3_    29     1.52931   114.16089   174.91465
   37    36 S   O2Z  _O31    30     1.26359   116.08290     0.28186
   38    36 S   O2Z  _O32    31     1.26431   114.40377  -179.68102
   39    33 S   CT   _C10    39     1.52661   111.17979  -179.44715
   40    39 S   HC   _H41    40     1.10021   108.86343   -62.25695
   41    39 S   CO4  _C5_    41     1.50444   112.55647  -178.49572
   42    41 S   O    _O25    42     1.22065   126.38719    29.95162
   43    41 S   OS   _O27    43     1.36515   109.22692  -152.62878
   44    43 S   CT   _C14    44     1.44556   110.71258     4.05608
   45    44 S   HC   _H45    45     1.09703   106.92570   -98.49438
   46    44 S   CT   _C9_    46     1.53387   106.39944   144.45262
   47    46 S   HC   _H39    47     1.09925   108.18415    60.17247
   48    46 S   HC   _H40    48     1.09654   108.88121   -50.67071
   49    39 S   CT   _C11    64     1.53600   118.59351    62.70131
   50    49 S   HC   _H42    65     1.09510   107.23814   -85.93925
   51    46 S   CT   _C13    49     1.54275   117.14785  -175.63237
   52    51 S   HC   _H44    50     1.09803   107.09003   164.50177
   53    51 S   CT   _C12    51     1.54211   112.62781    45.00800
   54    53 S   HC   _H43    52     1.09848   106.34629   -77.33232
   55    51 S   CT   _C23    98     1.53430   109.32917   -80.29323
   56    55 S   HC   _H55    99     1.09486   111.54900    71.04537
   57    55 S   HC   _H56   100     1.09556   110.94665   -49.27046
   58    55 S   HC   _H57   101     1.09272   111.34167  -167.68687
   59    53 S   CT   _C15    53     1.54557   116.90227   167.25587
   60    59 S   HC   _H46    54     1.09648   110.47263   -51.11508
   61    59 S   CT   _C7_    55     1.53440   102.83316  -170.53490
   62    61 S   HC   _H35    56     1.09400   112.38539   -90.21878
   63    61 S   HC   _H36    57     1.09268   111.05539   145.49917
   64    59 S   OS   _O35    70     1.42500   109.94848    70.08221
   65    61 S   CO4  _C4_    58     1.50823   103.57170    27.01287
   66    65 S   O    _O24    59     1.22494   122.95973   175.79257
   67    64 S   CO   _C20    71     1.43467   114.12245  -176.80635
   68    67 S   HC   _H51    72     1.09821   109.03640    40.45176
   69    53 S   CT   _C21    60     1.55454   114.80686    44.50648
   70    67 S   CT   _C18    73     1.53458   107.39000   159.74795
   71    70 S   HC   _H49    74     1.09682   109.97367    51.53550
   72    69 S   CT   _C8_    61     1.55289   115.03601   -71.79554
   73    72 S   HC   _H37    62     1.09327   108.34359  -132.76218
   74    72 S   HC   _H38    63     1.09827   110.00591   113.32511
   75    69 S   CT   _C24    66     1.54179   114.66517    57.08727
   76    75 S   HC   _H58    67     1.09286   112.25492   -65.70136
   77    75 S   HC   _H59    68     1.09704   110.44234   174.48029
   78    75 S   HC   _H60    69     1.09514   112.56956    55.77064
   79    70 S   CT   _C16    75     1.53174   111.35214   173.56565
   80    79 S   HC   _H47    76     1.09663   110.29036    73.22148
   81    70 S   OH   _O33    96     1.42959   109.90848   -65.12101
   82    81 S   HO   _H67    97     0.97222   108.22271   -61.78019
   83    79 S   CT   _C17    77     1.53207   111.23174   -49.47321
   84    83 S   HC   _H48    78     1.09647   108.65306   -71.16010
   85    79 S   OH   _O29    94     1.42938   109.62449  -170.86316
   86    85 S   HO   _H65    95     0.97245   108.12967    60.95363
   87    83 S   CT   _C19    79     1.53280   110.36135    50.39348
   88    87 S   HC   _H50    80     1.09817   110.34281    64.08060
   89    83 S   OH   _O30    92     1.42568   109.93681   172.05678
   90    89 S   HO   _H66    93     0.97243   108.26309   -56.43921
   91    67 S   OS   _O28    81     1.42636   110.28679   -80.64027
   92    87 S   CT   _C26    82     1.53267   113.07118  -175.77636
   93    92 S   HC   _H63    83     1.09516   110.77967   -63.52543
   94    92 S   HC   _H64    84     1.09572   109.20205   175.86540
   95    92 S   OS   _O34    85     1.43933   109.53038    56.19626
   96    95 S   CO4  _C6_    86     1.36137   116.12519   163.61411
   97    96 S   O    _O26    87     1.22373   126.39138     0.70081
   98    96 S   CT   _C22    88     1.49825   109.56553  -179.13906
   99    98 S   HC   _H52    89     1.09288   109.84702   -60.71176
  100    98 S   HC   _H53    90     1.09381   109.35141  -179.75853
  101    98 S   HC   _H54    91     1.09291   109.81228    61.21003
  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   7   5   4   3
  11   5   4   2   1   1  13   7   8   3   9  14   7  15   6   5
   9   4  15   8  22   9   5   2   1   1  14   7   9   5   4  10
   9   3  13   6   7  12   7   6   2   1   3   2   1   1  13   7
   4   1  12   7   3   1   9   6   3   1   4   6   3   2   6   5
   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    49  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    72    49    50  
   35    39    40    41    49  
   39    40    41    49  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    69    72    73    74    49    50  
   41    42    43    44    72    49    50  
   42    43    44    45    46    72    49    50  
   43    44    49  
   44    45    46    47    48    51    72    49    50  
   45    46    47    48    51    52    53    69    72    73    74    49    50    55  
   46    47    48    51    72    49    50  
   47    48    51    52    53    54    59    69    72    49    50    55    56    57    58  
   48    51    52    53    49    55  
   51    52    53    49    55  
   50    75    51    53    65    69    72    73    74  
   69    72    73    74  
   52    53    54    59    60    61    65    69    72    75    64    55    56    57    58  
   53    54    59    69    55    56    57    58  
   54    59    60    61    62    63    65    66    69    72    73    74    75    76    77    78    64    67    55    56    57    58  
   59    60    61    65    69    72    75    64    55  
   56    57    58    59    69  
   57    58  
   58  
    0  
   60    61    62    63    65    66    69    72    75    64    67    68    70    91  
   61    62    63    65    69    64    67  
   62    63    65    66    69    72    75    64    67  
   63    65    66    69    64  
   65    66    69    64  
   67    68    70    71    79    87    91    81    65    69  
   66    69    72    73    74    75    76    77    78  
   69    72    75  
   68    70    71    79    80    83    87    88    91    92    85    81    82  
   70    71    79    87    91    81  
   72    73    74    75    76    77    78  
   71    79    80    83    84    87    91    89    85    86    81    82  
   79    80    83    91    85    81    82  
   73    74    75    76    77    78  
   74    75  
   75  
   76    77    78  
   77    78  
   78  
    0  
   80    83    84    87    88    91    92    89    90    85    86    81    82  
   83    84    87    89    85    86    81  
   82    83    85    91  
    0  
   84    87    88    91    92    93    94    95    89    90    85    86  
   87    88    91    92    89    90    85  
   86    87    89  
    0  
   88    91    92    93    94    95    96    89    90  
   91    92    93    94    95    89  
   90    91    92  
    0  
   92    93    94    95  
   93    94    95    96    97    98  
   94    95    96  
   95    96  
   96    97    98    99   100   101  
   97    98    99   100   101  
   98    99   100   101  
   99   100   101  
  100   101  
  101  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   44   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   63   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   64   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   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   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   70   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   82   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   83   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   86   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   87   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   89   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   90   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   91   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   92   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   94   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   95   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   96   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   97   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   98   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  100   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  101   2.4200   0.0150   0.060000   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    49   268.000  1.529
   41    42   570.000  1.229
   41    43   214.000  1.327
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    49   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    51   268.000  1.529
   51    52   340.000  1.090
   51    53   268.000  1.529
   51    55   268.000  1.529
   53    54   340.000  1.090
   53    59   268.000  1.529
   53    69   268.000  1.529
   59    60   340.000  1.090
   59    61   268.000  1.529
   59    64   320.000  1.410
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    65   317.000  1.522
   65    66   570.000  1.229
   65    69   317.000  1.522
   69    72   268.000  1.529
   69    75   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    49   268.000  1.529
   49    50   340.000  1.090
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   340.000  1.090
   64    67   320.000  1.380
   67    68   340.000  1.090
   67    70   250.000  1.527
   67    91   320.000  1.380
   70    71   340.000  1.090
   70    79   268.000  1.529
   70    81   320.000  1.410
   79    80   340.000  1.090
   79    83   268.000  1.529
   79    85   320.000  1.410
   83    84   340.000  1.090
   83    87   268.000  1.529
   83    89   320.000  1.410
   87    88   340.000  1.090
   87    91   320.000  1.410
   87    92   268.000  1.529
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   320.000  1.410
   95    96   214.000  1.327
   96    97   570.000  1.229
   96    98   317.000  1.522
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
   89    90   553.000  0.945
   85    86   553.000  0.945
   81    82   553.000  0.945
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    63.00000  111.10000
   33    39    49    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    80.00000  120.40000
   39    41    43    81.00000  111.40000
   39    49    44    58.35000  112.70000
   39    49    72    58.35000  112.70000
   39    49    50    37.50000  110.70000
   41    39    40    35.00000  109.50000
   41    43    44    83.00000  116.90000
   43    41    42    83.00000  123.40000
   43    44    45    35.00000  109.50000
   43    44    46    50.00000  109.50000
   43    44    49    50.00000  109.50000
   44    46    47    37.50000  110.70000
   44    46    48    37.50000  110.70000
   44    46    51    58.35000  112.70000
   44    49    72    58.35000  112.70000
   44    49    50    37.50000  110.70000
   46    44    45    37.50000  110.70000
   46    51    52    37.50000  110.70000
   46    51    53    58.35000  112.70000
   46    51    55    58.35000  112.70000
   48    46    47    33.00000  107.80000
   51    46    47    37.50000  110.70000
   51    46    48    37.50000  110.70000
   51    53    54    37.50000  110.70000
   51    53    59    58.35000  112.70000
   51    53    69    58.35000  112.70000
   51    55    56    37.50000  110.70000
   51    55    57    37.50000  110.70000
   51    55    58    37.50000  110.70000
   53    51    52    37.50000  110.70000
   53    59    60    37.50000  110.70000
   53    59    61    58.35000  112.70000
   53    59    64    50.00000  109.50000
   53    69    65    63.00000  111.10000
   53    69    72    58.35000  112.70000
   53    69    75    58.35000  112.70000
   59    53    54    37.50000  110.70000
   59    61    62    37.50000  110.70000
   59    61    63    37.50000  110.70000
   59    61    65    63.00000  111.10000
   59    64    67    60.00000  109.50000
   61    59    60    37.50000  110.70000
   61    65    66    80.00000  120.40000
   61    65    69    70.00000  116.00000
   63    61    62    33.00000  107.80000
   65    61    62    35.00000  109.50000
   65    61    63    35.00000  109.50000
   65    69    72    63.00000  111.10000
   65    69    75    63.00000  111.10000
   69    53    54    37.50000  110.70000
   69    53    59    58.35000  112.70000
   69    65    66    80.00000  120.40000
   69    72    73    37.50000  110.70000
   69    72    74    37.50000  110.70000
   69    72    49    58.35000  112.70000
   69    75    76    37.50000  110.70000
   69    75    77    37.50000  110.70000
   69    75    78    37.50000  110.70000
   72    49    50    37.50000  110.70000
   74    72    73    33.00000  107.80000
   49    39    40    37.50000  110.70000
   49    39    41    63.00000  111.10000
   49    44    45    37.50000  110.70000
   49    44    46    58.35000  112.70000
   49    72    73    37.50000  110.70000
   49    72    74    37.50000  110.70000
   75    69    72    58.35000  112.70000
   77    75    76    33.00000  107.80000
   78    75    76    33.00000  107.80000
   78    75    77    33.00000  107.80000
   64    59    60    35.00000  109.50000
   64    59    61    50.00000  109.50000
   64    67    68    35.00000  109.50000
   64    67    70    90.00000  108.56700
   64    67    91    92.60000  111.55000
   67    70    71    45.00000  108.72000
   67    70    79    75.00000  109.43000
   67    70    81    90.00000  111.58700
   67    91    87    60.00000  109.50000
   70    67    68    45.00000  112.01100
   70    79    80    37.50000  110.70000
   70    79    83    58.35000  112.70000
   70    79    85    50.00000  109.50000
   70    81    82    55.00000  108.50000
   79    70    71    37.50000  110.70000
   79    83    84    37.50000  110.70000
   79    83    87    58.35000  112.70000
   79    83    89    50.00000  109.50000
   79    85    86    55.00000  108.50000
   83    79    80    37.50000  110.70000
   83    87    88    37.50000  110.70000
   83    87    91    50.00000  109.50000
   83    87    92    58.35000  112.70000
   83    89    90    55.00000  108.50000
   87    83    84    37.50000  110.70000
   87    92    93    37.50000  110.70000
   87    92    94    37.50000  110.70000
   87    92    95    50.00000  109.50000
   91    67    68    35.00000  109.50000
   91    67    70    90.00000  108.56700
   91    87    88    35.00000  109.50000
   92    87    88    37.50000  110.70000
   92    87    91    50.00000  109.50000
   92    95    96    83.00000  116.90000
   94    92    93    33.00000  107.80000
   95    92    93    35.00000  109.50000
   95    92    94    35.00000  109.50000
   95    96    97    83.00000  123.40000
   95    96    98    81.00000  111.40000
   96    98    99    35.00000  109.50000
   96    98   100    35.00000  109.50000
   96    98   101    35.00000  109.50000
   98    96    97    80.00000  120.40000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
   89    83    84    35.00000  109.50000
   89    83    87    50.00000  109.50000
   85    79    80    35.00000  109.50000
   85    79    83    50.00000  109.50000
   81    70    71    35.00000  109.50000
   81    70    79    50.00000  109.50000
   55    51    52    37.50000  110.70000
   55    51    53    58.35000  112.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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
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   55    51    53    69   0.56750  1.0 1.0
   55    51    53    69  -0.07550 -1.0 2.0
   55    51    53    69   0.20000  1.0 3.0
IPHI
    9     5     7     8  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
   38    30    36    37  10.50000 -1.0 2.0
   39    43    41    42  10.50000 -1.0 2.0
   61    69    65    66  10.50000 -1.0 2.0
   95    98    96    97  10.50000 -1.0 2.0
END
