* LIGAND DATABASE FILE (OPLS2005)
*
001      98   102    194    318     587
    1     0 S   NP   _N1_     1    28.59798    96.58098   -21.22418
    2     1 S   H    _HN1     2     1.02963    79.35688    32.93121
    3     1 S   H    _H1_     3     1.02830    41.83411   163.92113
    4     1 S   H    _H2_     4     1.02772    88.12347   -76.14895
    5     1 S   CT   _CA1     5     1.50151   151.65393   146.28049
    6     5 S   HC   _HA1     6     1.09578   105.18688    71.53854
    7     5 S   CO3  _C1_     7     1.53801   112.46681   -48.52500
    8     7 S   O2Z  _O11     8     1.26357   114.98444   -40.51580
    9     7 S   O2Z  _O12     9     1.26252   114.94102   138.55150
   10     5 S   CT   _CB1    10     1.53098   107.39190  -170.59640
   11    10 S   HC   HB11    11     1.09822   109.25462   -50.78629
   12    10 S   HC   HB12    12     1.09819   110.41626    65.75655
   13    10 S   CT   _CG1    13     1.52979   112.72032  -171.94378
   14    13 S   HC   HG11    14     1.09607   110.33942   -65.12371
   15    13 S   HC   HG12    15     1.09654   110.03348    54.07596
   16    13 S   C    _CD1    16     1.51829   112.42521   174.35611
   17    16 S   O    _OE1    17     1.22715   123.32176    -3.92940
   18    16 S   N    _N2_    18     1.38575   111.52510   176.43229
   19    18 S   H    _HN2    19     1.01588   118.95133     0.13988
   20    18 S   CT1  _CA2    20     1.46189   123.59398  -178.72605
   21    20 S   HC   _HA2    21     1.09729   109.43823   -10.24350
   22    20 S   C    _C2_    22     1.53420   108.46057  -125.98742
   23    22 S   O    _O2_    23     1.23025   122.20015  -146.63489
   24    20 S   CT   _CB2    32     1.53360   111.10859   111.85759
   25    24 S   HC   HB21    33     1.09524   109.68805    55.08036
   26    24 S   HC   HB22    34     1.09498   110.70977   173.53728
   27    22 S   N    _N3_    24     1.38501   113.42131    40.83636
   28    27 S   H    _HN3    25     1.01525   118.87604    -0.86705
   29    24 S   S    _SG2    35     1.82934   111.49630   -67.33192
   30    27 S   CT   _CA3    26     1.45452   123.53817   175.09040
   31    30 S   HC   HA31    27     1.09518   109.33208    22.45434
   32    30 S   HC   HA32    28     1.09499   107.09706   139.46732
   33    29 S   CT   _C21    36     1.85973   100.13030   151.58965
   34    33 S   HC   _H11    37     1.09614   104.71368    24.09759
   35    30 S   CO3  _C3_    29     1.52920   113.05523  -101.09054
   36    35 S   O2Z  _O31    30     1.26406   115.38681   -45.08821
   37    35 S   O2Z  _O32    31     1.26355   115.00102   135.84133
   38    33 S   CT   _C22    38     1.55040   110.60530   -88.71676
   39    38 S   HC   _H12    39     1.09713   109.02562   152.84448
   40    38 S   CO4  _C23    40     1.51667   109.96109   -90.50441
   41    40 S   O    _O38    41     1.22913   122.13906   118.37913
   42    38 S   OH   _O39    97     1.41535   113.44008    35.56428
   43    42 S   HO   _H23    98     0.97303   107.62530  -177.58232
   44    40 S   CT   _C5_    42     1.52417   114.90673   -65.97412
   45    44 S   HC   _H3_    43     1.09979   105.04494   -87.72878
   46    44 S   CT   _C6_    44     1.55855   109.78759    26.42492
   47    46 S   HC   _H4_    45     1.10154   104.62985   -79.48256
   48    44 S   CT   _C4_    93     1.52885   111.63119   157.80245
   49    48 S   HC   _H13    94     1.09150   112.86744   -66.18886
   50    48 S   HC   _H14    95     1.09420   111.42197   171.84390
   51    48 S   HC   _H15    96     1.09613   110.58637    53.40696
   52    46 S   CT   _C7_    46     1.54044   112.29724   166.66140
   53    52 S   HC   _H16    47     1.09384   111.79390   -68.41945
   54    52 S   HC   _H17    48     1.09814   108.33466    48.91182
   55    52 S   CT   _C8_    49     1.52373   111.86991   168.29206
   56    55 S   HC   _H5_    50     1.09760   107.99492   177.99143
   57    55 S   CT   _C9_    51     1.52559   113.52875    54.86889
   58    55 S   OS   _O35    63     1.45797   106.32635   -69.07884
   59    57 S   CT   _C10    52     1.53171   115.51611    81.81740
   60    59 S   HC   _H18    53     1.08841   115.66886   -90.00043
   61    59 S   HC   _H19    54     1.09624   112.11821    33.75767
   62    57 S   CT   _C19    75     1.58407   112.73935   -48.46269
   63    62 S   HC   _H10    76     1.09896   104.52862   -64.61566
   64    59 S   OS   _O33    55     1.44803   105.57506   149.98332
   65    33 S   CT   _C20    77     1.61066   114.22228   141.83270
   66    64 S   CT   _C11    56     1.46175   108.39065   -10.77167
   67    65 S   CT   _C24    78     1.55188   111.40448    26.87886
   68    67 S   HC   _H24    79     1.08879   114.12448   -70.41455
   69    67 S   HC   _H25    80     1.09076   112.98722   167.95816
   70    67 S   HC   _H26    81     1.09443   111.20931    48.53939
   71    57 S   CT   _C12    57     1.53379   106.43169  -171.37616
   72    71 S   HC   _H6_    58     1.10484   108.83618   -57.43452
   73    66 S   CT   _C17    71     1.54195   106.88418    98.79777
   74    73 S   HC   _H8_    72     1.09762   109.15634    67.16182
   75    66 S   CO4  _C25    86     1.52569   104.34304  -139.53526
   76    75 S   O    _O42    87     1.22561   124.26443    20.65252
   77    71 S   CT   _C13    59     1.51784   112.86853    59.67714
   78    77 S   HC   _H7_    60     1.09170   112.81675    64.58408
   79    73 S   CT   _C18    73     1.54489   111.64986   -53.29204
   80    79 S   HC   _H9_    74     1.09510   108.60914  -159.95414
   81    73 S   OH   _O41    84     1.42473   112.08083  -174.47036
   82    81 S   HO   _H28    85     0.97340   107.68460   -59.43837
   83    75 S   OS   _O43    88     1.36403   110.90518  -160.43200
   84    77 S   CO4  _C14    61     1.52187   109.87136   -54.43138
   85    84 S   O    _O34    62     1.22751   123.04796  -145.03472
   86    77 S   OS   _O36    64     1.43768   108.69376  -172.97155
   87    79 S   OH   _O40    82     1.42141   107.85788    84.57973
   88    87 S   HO   _H27    83     0.97244   107.93201    64.40753
   89    83 S   CT   _C26    89     1.43108   115.27890   179.23664
   90    89 S   HC   _H29    90     1.09323   108.06400  -177.23020
   91    89 S   HC   _H30    91     1.09411   110.15178    64.10024
   92    89 S   HC   _H31    92     1.09426   110.43038   -58.58644
   93    86 S   CO4  _C15    65     1.36411   117.30834  -153.24407
   94    93 S   O    _O37    66     1.22325   126.41708     2.84579
   95    93 S   CT   _C16    67     1.49825   109.67885  -177.71475
   96    95 S   HC   _H20    68     1.09148   109.89027   -72.66440
   97    95 S   HC   _H21    69     1.09381   109.28127   167.71399
   98    95 S   HC   _H22    70     1.09328   110.01356    49.30529
  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
  20   8   2   1   1  12   6  13   5   3   1  14   8  20   8   5
   2   1   1  12   6   5  17   6  21   8  13   5   4  18   7  11
   9  17   4   2   1   1  14   6  11   6   9   2   7   4   5   3
   2   1   4   3   1   6   1   1   3   2   1   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    65    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    46    62    65    67    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    46    47    52    57    79    62    63    65    67    68    69    70    42    43  
   38    39    40    46    62    65    67    42  
   36    37  
   37  
    0  
   39    40    41    44    45    46    62    65    67    48    42    43  
   40    41    44    65    42    43  
   41    44    45    46    47    52    65    48    49    50    51    42    43  
   44    45    46    48    42  
   43    44    65  
    0  
   45    46    47    52    53    54    55    62    65    67    48    49    50    51  
   46    47    52    65    48    49    50    51  
   47    52    53    54    55    56    57    58    79    62    63    65    67    68    69    70    48    49    50    51  
   52    53    54    55    62    65    67    48  
   49    50    51    52    65  
   50    51  
   51  
    0  
   53    54    55    56    57    59    71    84    58    62    65    67  
   54    55    56    57    58    65  
   55    56    57    58    65  
   56    57    59    60    61    64    66    71    72    77    84    85    58    79    62    63    65  
   57    59    71    84    58    62  
   59    60    61    64    66    71    72    77    78    84    58    86    73    79    80    62    63    65    67    87    75  
   86    62    59    71    77    78    84    85  
   60    61    64    66    71    72    77    73    79    62    63    65    75  
   61    64    66    71    62  
   64    66    71    62  
   63    65    67    68    69    70    87    88    81    64    66    71    72    73    74    77    79    80  
   65    67    87    71    73    79    80  
   66    71    72    77    73    74    79    81    75    76    83  
   67    68    69    70    87    71    73    79    80  
   71    72    77    78    84    86    73    74    79    80    87    81    82    75    76    83    89  
   68    69    70    79  
   69    70  
   70  
    0  
   72    77    78    84    85    86    93    73    74    79    81    75    76    83  
   77    78    84    86    73    75  
   74    79    80    87    88    81    82    75    76    83    77  
   79    80    87    81    82    75  
   76    83    89    90    91    92    77    79    81  
   83    89  
   78    84    85    86    93    94    95  
   84    85    86    93  
   80    87    88    81    82  
   87    88    81  
   82    87  
    0  
   89    90    91    92  
   85    86    93  
   86  
   93    94    95    96    97    98  
   88  
    0  
   90    91    92  
   91    92  
   92  
    0  
   94    95    96    97    98  
   95    96    97    98  
   96    97    98  
   97    98  
   98  
    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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   43   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   57   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   58   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   59   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   65   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   66   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   77   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.4200   0.0150   0.030000   1.3810   1.2100   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   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   84   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   85   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   86   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   87   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   88   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   89   3.5000   0.0660   0.160000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   91   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   92   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   93   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   94   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   95   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   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    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    65   268.000  1.529
   38    39   340.000  1.090
   38    40   317.000  1.522
   38    42   320.000  1.410
   40    41   570.000  1.229
   40    44   317.000  1.522
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    48   268.000  1.529
   46    47   340.000  1.090
   46    52   268.000  1.529
   46    65   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   268.000  1.529
   55    56   340.000  1.090
   55    57   268.000  1.529
   55    58   320.000  1.410
   57    59   268.000  1.529
   57    71   268.000  1.529
   57    62   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    64   320.000  1.410
   64    66   320.000  1.410
   66    71   268.000  1.529
   66    73   268.000  1.529
   66    75   317.000  1.522
   71    72   340.000  1.090
   71    77   268.000  1.529
   77    78   340.000  1.090
   77    84   317.000  1.522
   77    86   320.000  1.410
   84    85   570.000  1.229
   84    58   214.000  1.327
   86    93   214.000  1.327
   93    94   570.000  1.229
   93    95   317.000  1.522
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   340.000  1.090
   73    74   340.000  1.090
   73    79   268.000  1.529
   73    81   320.000  1.410
   79    80   340.000  1.090
   79    62   268.000  1.529
   79    87   320.000  1.410
   62    63   340.000  1.090
   62    65   268.000  1.529
   65    67   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   87    88   553.000  0.945
   81    82   553.000  0.945
   75    76   570.000  1.229
   75    83   214.000  1.327
   83    89   320.000  1.410
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   340.000  1.090
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   42    43   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    65    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    63.00000  111.10000
   33    38    42    50.00000  109.50000
   33    65    46    58.35000  112.70000
   33    65    62    58.35000  112.70000
   33    65    67    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    40    41    80.00000  120.40000
   38    40    44    70.00000  116.00000
   38    42    43    55.00000  108.50000
   40    38    39    35.00000  109.50000
   40    44    45    35.00000  109.50000
   40    44    46    63.00000  111.10000
   40    44    48    63.00000  111.10000
   44    40    41    80.00000  120.40000
   44    46    47    37.50000  110.70000
   44    46    52    58.35000  112.70000
   44    46    65    58.35000  112.70000
   44    48    49    37.50000  110.70000
   44    48    50    37.50000  110.70000
   44    48    51    37.50000  110.70000
   46    44    45    37.50000  110.70000
   46    52    53    37.50000  110.70000
   46    52    54    37.50000  110.70000
   46    52    55    58.35000  112.70000
   46    65    62    58.35000  112.70000
   46    65    67    58.35000  112.70000
   52    46    47    37.50000  110.70000
   52    55    56    37.50000  110.70000
   52    55    57    58.35000  112.70000
   52    55    58    50.00000  109.50000
   54    52    53    33.00000  107.80000
   55    52    53    37.50000  110.70000
   55    52    54    37.50000  110.70000
   55    57    59    58.35000  112.70000
   55    57    71    58.35000  112.70000
   55    57    62    58.35000  112.70000
   55    58    84    83.00000  116.90000
   57    55    56    37.50000  110.70000
   57    59    60    37.50000  110.70000
   57    59    61    37.50000  110.70000
   57    59    64    50.00000  109.50000
   57    71    66    58.35000  112.70000
   57    71    72    37.50000  110.70000
   57    71    77    58.35000  112.70000
   57    62    79    58.35000  112.70000
   57    62    63    37.50000  110.70000
   57    62    65    58.35000  112.70000
   59    64    66    60.00000  109.50000
   61    59    60    33.00000  107.80000
   64    59    60    35.00000  109.50000
   64    59    61    35.00000  109.50000
   64    66    71    50.00000  109.50000
   64    66    73    50.00000  109.50000
   64    66    75    90.00000  108.74100
   66    71    72    37.50000  110.70000
   66    71    77    58.35000  112.70000
   66    73    74    37.50000  110.70000
   66    73    79    58.35000  112.70000
   66    73    81    50.00000  109.50000
   66    75    76    80.00000  120.40000
   66    75    83    81.00000  111.40000
   71    57    59    58.35000  112.70000
   71    77    78    37.50000  110.70000
   71    77    84    63.00000  111.10000
   71    77    86    50.00000  109.50000
   77    71    72    37.50000  110.70000
   77    84    85    80.00000  120.40000
   77    84    58    81.00000  111.40000
   77    86    93    83.00000  116.90000
   84    77    78    35.00000  109.50000
   58    55    56    35.00000  109.50000
   58    55    57    50.00000  109.50000
   58    84    85    83.00000  123.40000
   86    77    78    35.00000  109.50000
   86    77    84    90.00000  108.74100
   86    93    94    83.00000  123.40000
   86    93    95    81.00000  111.40000
   93    95    96    35.00000  109.50000
   93    95    97    35.00000  109.50000
   93    95    98    35.00000  109.50000
   95    93    94    80.00000  120.40000
   97    95    96    33.00000  107.80000
   98    95    96    33.00000  107.80000
   98    95    97    33.00000  107.80000
   73    66    71    58.35000  112.70000
   73    79    80    37.50000  110.70000
   73    79    62    58.35000  112.70000
   73    79    87    50.00000  109.50000
   73    81    82    55.00000  108.50000
   79    73    74    37.50000  110.70000
   79    62    63    37.50000  110.70000
   79    62    65    58.35000  112.70000
   79    87    88    55.00000  108.50000
   62    57    59    58.35000  112.70000
   62    57    71    58.35000  112.70000
   62    79    80    37.50000  110.70000
   62    65    67    58.35000  112.70000
   65    33    34    37.50000  110.70000
   65    33    38    58.35000  112.70000
   65    46    47    37.50000  110.70000
   65    46    52    58.35000  112.70000
   65    62    63    37.50000  110.70000
   65    67    68    37.50000  110.70000
   65    67    69    37.50000  110.70000
   65    67    70    37.50000  110.70000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   87    79    80    35.00000  109.50000
   87    79    62    50.00000  109.50000
   81    73    74    35.00000  109.50000
   81    73    79    50.00000  109.50000
   75    66    71    63.00000  111.10000
   75    66    73    63.00000  111.10000
   75    83    89    83.00000  116.90000
   83    75    76    83.00000  123.40000
   83    89    90    35.00000  109.50000
   83    89    91    35.00000  109.50000
   83    89    92    35.00000  109.50000
   91    89    90    33.00000  107.80000
   92    89    90    33.00000  107.80000
   92    89    91    33.00000  107.80000
   48    44    45    37.50000  110.70000
   48    44    46    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   42    38    39    35.00000  109.50000
   42    38    40    90.00000  109.61100
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    65   0.01700  1.0 1.0
   24    29    33    65  -0.23550 -1.0 2.0
   24    29    33    65   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.56750  1.0 1.0
   29    33    38    40  -0.07550 -1.0 2.0
   29    33    38    40   0.20000  1.0 3.0
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   65    46   -52    55   0.20000  1.0 3.0
   87    79    62    57   0.86500  1.0 1.0
   87    79    62    57  -0.17500 -1.0 2.0
   87    79    62    57   0.20800  1.0 3.0
   87    79    62    63   0.23400  1.0 3.0
   87    79    62    65   0.86500  1.0 1.0
   87    79    62    65  -0.17500 -1.0 2.0
   87    79    62    65   0.20800  1.0 3.0
   81    73    79    80   0.23400  1.0 3.0
   81    73    79    62   0.86500  1.0 1.0
   81    73    79    62  -0.17500 -1.0 2.0
   81    73    79    62   0.20800  1.0 3.0
   81    73    79    87   3.75450  1.0 1.0
   75    66    71    57  -0.95700  1.0 1.0
   75    66    71    57  -0.18200 -1.0 2.0
   75    66    71    57   0.29450  1.0 3.0
   75    66    71    72  -0.11250  1.0 3.0
   75    66    71    77  -0.95700  1.0 1.0
   75    66    71    77  -0.18200 -1.0 2.0
   75    66    71    77   0.29450  1.0 3.0
   75    66    73    74  -0.11250  1.0 3.0
   75    66    73    79  -0.95700  1.0 1.0
   75    66    73    79  -0.18200 -1.0 2.0
   75    66    73    79   0.29450  1.0 3.0
   75    66    73    81  -0.09450  1.0 1.0
   75    66    73    81  -1.12950 -1.0 2.0
   75    66    73    81   0.54000  1.0 3.0
   75    83    89    90   0.08050  1.0 3.0
   75    83    89    91   0.08050  1.0 3.0
   75    83    89    92   0.08050  1.0 3.0
   76    75    83    89   3.00000 -1.0 2.0
   48    44    46    47   0.15000  1.0 3.0
   48    44    46    52   0.56750  1.0 1.0
   48    44    46    52  -0.07550 -1.0 2.0
   48    44    46    52   0.20000  1.0 3.0
   48    44    46    65   0.56750  1.0 1.0
   48    44    46    65  -0.07550 -1.0 2.0
   48    44    46    65   0.20000  1.0 3.0
   42    38    40    41   0.30150 -1.0 2.0
   42    38    40    44   0.55300  1.0 1.0
   42    38    40    44   1.25850 -1.0 2.0
   42    38    40    44  -0.23600  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    44    40    41  10.50000 -1.0 2.0
   77    58    84    85  10.50000 -1.0 2.0
   86    95    93    94  10.50000 -1.0 2.0
   66    83    75    76  10.50000 -1.0 2.0
END
