* LIGAND DATABASE FILE (OPLS2005)
*
001      96   100    193    316     579
    1     0 S   NP   _N1_     1    28.70487    98.62403   -18.48769
    2     1 S   H    _HN1     2     1.02778    80.10212  -101.85189
    3     1 S   H    _H1_     3     1.02958    69.96910    11.96851
    4     1 S   H    _H2_     4     1.02833    57.20411   139.21383
    5     1 S   CT   _CA1     5     1.50112   165.89866   105.93928
    6     5 S   HC   _HA1     6     1.09572   105.22405    88.59658
    7     5 S   CO3  _C1_     7     1.53759   112.55767   -31.61711
    8     7 S   O2Z  _O11     8     1.26345   114.97656   -40.03974
    9     7 S   O2Z  _O12     9     1.26250   114.92123   139.15581
   10     5 S   CT   _CB1    10     1.53074   107.45245  -153.40308
   11    10 S   HC   HB11    11     1.09820   109.32620   -50.53864
   12    10 S   HC   HB12    12     1.09821   110.40271    66.04267
   13    10 S   CT   _CG1    13     1.52973   112.64640  -171.66308
   14    13 S   HC   HG11    14     1.09616   110.42150   -64.51900
   15    13 S   HC   HG12    15     1.09652   109.99763    54.70230
   16    13 S   C    _CD1    16     1.51791   112.41311   175.07578
   17    16 S   O    _OE1    17     1.22718   123.33287    -2.56674
   18    16 S   N    _N2_    18     1.38483   111.50183   177.29376
   19    18 S   H    _HN2    19     1.01562   118.95031     5.20300
   20    18 S   CT1  _CA2    20     1.45899   123.28754   179.19838
   21    20 S   HC   _HA2    21     1.09703   109.25838    14.37443
   22    20 S   C    _C2_    22     1.52797   106.85055  -102.87340
   23    22 S   O    _O2_    23     1.22993   122.94855   -27.58526
   24    20 S   CT   _CB2    32     1.53140   111.64647   137.40941
   25    24 S   HC   HB21    33     1.09584   109.85091    54.32886
   26    24 S   HC   HB22    34     1.09481   110.53928   173.40626
   27    22 S   N    _N3_    24     1.38470   112.65903   155.16172
   28    27 S   H    _HN3    25     1.01664   120.39307    -2.05309
   29    24 S   S    _SG2    35     1.82743   110.57708   -66.39049
   30    27 S   CT   _CA3    26     1.45361   122.39956   178.60549
   31    30 S   HC   HA31    27     1.09571   107.66549   -58.17083
   32    30 S   HC   HA32    28     1.09565   107.72977    58.12708
   33    29 S   CT   _C21    36     1.85853    99.98346   163.02697
   34    33 S   HC   _H7_    37     1.09635   106.01845   -37.35345
   35    30 S   CO3  _C3_    29     1.52872   114.39815   179.90721
   36    35 S   O2Z  _O31    30     1.26320   116.08191    -3.23319
   37    35 S   O2Z  _O32    31     1.26442   114.39955   176.80929
   38    33 S   CM   _C20    38     1.51052   104.77354    77.30640
   39    38 S   HC   _H20    39     1.08853   117.24456   -78.99595
   40    38 S   CMA  _C19    40     1.34691   123.43161    99.21429
   41    40 S   OM   _O34    41     1.25928   130.79464  -177.95751
   42    40 S   CM   _C18    42     1.46196   117.69117     2.75172
   43    42 S   HC   _H19    43     1.09014   117.83026  -170.95187
   44    42 S   CM   _C17    44     1.35015   123.15707    16.23532
   45    44 S   CT   _C16    45     1.50792   119.47529   166.71332
   46    45 S   HC   _H17    46     1.09784   108.06599   -94.41268
   47    45 S   HC   _H18    47     1.09705   111.04665    21.81802
   48    45 S   CT   _C15    48     1.51939   113.99265   144.78043
   49    48 S   HC   _H15    49     1.09635   108.32338   173.16471
   50    48 S   HC   _H16    50     1.09773   109.43306   -71.08150
   51    48 S   CT   _C14    51     1.53783   111.93106    51.58524
   52    51 S   HC   _H6_    52     1.09382   108.21584    61.83961
   53    51 S   CT   _C9_    53     1.53772   109.87104  -178.57866
   54    53 S   HC   _H4_    54     1.10069   106.02870    61.08907
   55    51 S   CT   _C13    67     1.56137   109.41354   -58.78545
   56    55 S   F    F1__    68     1.38350   103.39883   -57.61513
   57    53 S   CT   _C8_    55     1.52711   118.60852   -57.57531
   58    57 S   HC   _H11    56     1.09583   110.22272   -44.66968
   59    57 S   HC   _H12    57     1.09468   111.95492    75.89161
   60    33 S   CT   _C22    69     1.59353   117.28783  -156.83686
   61    57 S   CT   _C7_    58     1.54072   103.94066  -162.76451
   62    61 S   HC   _H3_    59     1.09417   109.31267   136.00596
   63    60 S   CT   _C23    70     1.56138   106.76276   162.13913
   64    63 S   HC   _H21    71     1.09370   112.14734   -48.44805
   65    63 S   HC   _H22    72     1.09392   112.51472  -170.25069
   66    63 S   HC   _H23    73     1.09741   111.89136    69.89624
   67    61 S   CT   _C6_    60     1.54081   107.25594    10.77090
   68    53 S   CT   _C10    61     1.54733   113.75479  -180.00000
   69    67 S   OS   _O37    80     1.42590   104.25394   -99.39933
   70    67 S   CO4  _C5_    91     1.53706   113.00338   142.61538
   71    70 S   O    _O33    92     1.23279   121.96678   -23.23895
   72    68 S   CT   _C11    62     1.54358   106.41081   -62.40978
   73    72 S   HC   _H13    63     1.09726   109.97112   -64.57265
   74    72 S   HC   _H14    64     1.09518   109.68095   178.33188
   75    68 S   CT   _C24    76     1.55145   113.10416    59.74639
   76    75 S   HC   _H25    77     1.09513   112.35204    67.62674
   77    75 S   HC   _H26    78     1.09140   113.36824   -52.55017
   78    75 S   HC   _H27    79     1.09606   110.56189  -172.78417
   79    69 S   CO   _C25    81     1.42830   107.26421   -21.07820
   80    70 S   CT   _C4_    93     1.50772   118.07513   158.51682
   81    80 S   HC   _H8_    94     1.08995   110.34379    63.44521
   82    80 S   HC   _H9_    95     1.09152   110.14521   -58.97172
   83    80 S   HC   _H10    96     1.09418   109.31732  -177.50715
   84    72 S   CT   _C12    65     1.54742   113.20929    56.08535
   85    84 S   HC   _H5_    66     1.09477   106.54936  -170.71511
   86    61 S   OS   _O36    82     1.42561   110.47912  -105.08431
   87    79 S   CT   _C26    83     1.52621   109.63630  -102.99202
   88    87 S   HC   _H28    84     1.09526   110.98549    62.69269
   89    87 S   HC   _H29    85     1.09461   111.34427   -56.71081
   90    87 S   HC   _H30    86     1.09528   111.18818  -178.65433
   91    79 S   CT   _C27    87     1.52341   108.75379   136.16566
   92    91 S   HC   _H31    88     1.09528   110.72493   -61.07339
   93    91 S   HC   _H32    89     1.09511   111.32782  -179.87489
   94    91 S   HC   _H33    90     1.09510   111.30658    57.99981
   95    84 S   OH   _O35    74     1.42021   109.03038    75.02819
   96    95 S   HO   _H24    75     0.97250   107.84460    57.22860
  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   9   5   4   3
  17   7   2   1   1   9   4   6   3   9   3  15  11   6   5  12
   5   4  18   8  22   9  15   6  12   6   5   8  13   6   4   2
   1   1  20  16  15   9   4  10   5   4   4   2   1   1   9   3
   2   1   1   3   2   8   7   3   2   1   3   2   1   1   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    60    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    55    60    63  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    44    45    51    84    55    56    60    63    64    65    66  
   38    39    40    44    55    60    63  
   36    37  
   37  
    0  
   39    40    41    42    43    44    55    60    63  
   40    41    42    60  
   41    42    43    44    45    60  
   42    43    44  
   43    44    45    46    47    48    55    60    63  
   44    45    60  
   45    46    47    48    49    50    51    84    55    56    60    63    64    65    66  
   46    47    48    49    50    51    52    53    55    60    63  
   47    48    49    50    51    60  
   48    49    50    51    60  
   49    50    51    52    53    54    57    68    84    55    56    60  
   50    51    52    53    55  
   51    52    53    55  
   52    53    54    57    58    59    61    67    68    72    84    85    55    56    60    63    95    75  
   53    54    57    68    84    55    56    60  
   54    57    58    59    61    62    67    68    72    73    74    84    55    56    60    75    76    77    78    69    86    70  
   57    58    59    61    67    68    72    55    75  
   56    60    63    64    65    66    95    96    57    68    72    73    74    84    85  
   60    63    95    72    84    85  
   58    59    61    62    67    68    72    75    69    79    86    70  
   59    61    62    67    68    86  
   61    62    67    68    86  
   63    64    65    66    95    72    84    85  
   62    67    68    72    75    69    79    86    87    91    70    71    80  
   67    68    69    79    86    70  
   64    65    66    84  
   65    66  
   66  
    0  
   68    72    73    74    84    75    76    77    78    69    79    86    87    91    70    71    80    81    82    83  
   72    73    74    84    85    95    75    76    77    78    69    79    86    70    71    80  
   79    86    87    88    89    90    91    92    93    94    70    71    80    72    75  
   71    80    81    82    83    72    75    79    86  
   80    81    82    83  
   73    74    84    85    95    96    75    76    77    78  
   74    84    85    95    75  
   84    85    95    75  
   76    77    78    84  
   77    78  
   78  
    0  
   86    87    88    89    90    91    92    93    94  
   81    82    83  
   82    83  
   83  
    0  
   85    95    96  
   95    96  
   87    88    89    90    91    92    93    94  
   88    89    90    91    92    93    94  
   89    90    91  
   90    91  
   91  
   92    93    94  
   93    94  
   94  
    0  
   96  
    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   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.060000   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   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.9400   0.0610  -0.220000   2.4980   2.2250   0.001000000   0.985400000
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660   0.248000   1.9750   1.7500   0.005000000  -0.741685710
   68   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   70   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   71   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   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   0.400000   1.9750   1.7500   0.005000000  -0.741685710
   80   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   82   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   83   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   84   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   87   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   3.1200   0.1700  -0.683000   1.8380   1.6250   0.021068034  -0.322181743
   96   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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   317.000  1.510
   33    60   268.000  1.529
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   465.000  1.376
   42    43   340.000  1.080
   42    44   549.000  1.340
   44    45   317.000  1.510
   44    60   317.000  1.510
   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   340.000  1.090
   48    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    57   268.000  1.529
   53    68   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    61   268.000  1.529
   61    62   340.000  1.090
   61    67   268.000  1.529
   61    86   320.000  1.410
   67    68   268.000  1.529
   67    69   320.000  1.410
   67    70   317.000  1.522
   68    72   268.000  1.529
   68    75   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    84   268.000  1.529
   84    85   340.000  1.090
   84    55   268.000  1.529
   84    95   320.000  1.410
   55    56   367.000  1.332
   55    60   268.000  1.529
   60    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   95    96   553.000  0.945
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   340.000  1.090
   69    79   320.000  1.380
   79    86   320.000  1.380
   79    87   250.000  1.527
   79    91   250.000  1.527
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    90   340.000  1.090
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   340.000  1.090
   70    71   570.000  1.229
   70    80   317.000  1.522
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   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    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  112.20000
   29    33    60    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    60    44    70.00000  112.02700
   33    60    55    58.35000  112.70000
   33    60    63    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    70.00000  123.01800
   40    38    39    40.00000  120.50800
   40    42    43    40.00000  120.50800
   40    42    44    70.00000  117.34000
   42    40    41    65.00000  137.10300
   42    44    45    70.00000  124.00000
   42    44    60    70.00000  124.00000
   44    42    43    35.00000  120.00000
   44    45    46    35.00000  109.50000
   44    45    47    35.00000  109.50000
   44    45    48    70.00000  112.02700
   44    60    55    70.00000  112.02700
   44    60    63    70.00000  112.02700
   45    48    49    37.50000  110.70000
   45    48    50    37.50000  110.70000
   45    48    51    58.35000  112.70000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    53    58.35000  112.70000
   48    51    55    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    53    54    37.50000  110.70000
   51    53    57    58.35000  112.70000
   51    53    68    58.35000  112.70000
   51    55    84    58.35000  112.70000
   51    55    56    50.00000  109.50000
   51    55    60    58.35000  112.70000
   53    51    52    37.50000  110.70000
   53    57    58    37.50000  110.70000
   53    57    59    37.50000  110.70000
   53    57    61    58.35000  112.70000
   53    68    67    58.35000  112.70000
   53    68    72    58.35000  112.70000
   53    68    75    58.35000  112.70000
   57    53    54    37.50000  110.70000
   57    61    62    37.50000  110.70000
   57    61    67    58.35000  112.70000
   57    61    86    50.00000  109.50000
   59    57    58    33.00000  107.80000
   61    57    58    37.50000  110.70000
   61    57    59    37.50000  110.70000
   61    67    68    58.35000  112.70000
   61    67    69    50.00000  109.50000
   61    67    70    63.00000  111.10000
   61    86    79    60.00000  109.50000
   67    61    62    37.50000  110.70000
   67    68    72    58.35000  112.70000
   67    68    75    58.35000  112.70000
   67    69    79    60.00000  109.50000
   67    70    71    80.00000  120.40000
   67    70    80    70.00000  116.00000
   68    53    54    37.50000  110.70000
   68    53    57    58.35000  112.70000
   68    72    73    37.50000  110.70000
   68    72    74    37.50000  110.70000
   68    72    84    58.35000  112.70000
   68    75    76    37.50000  110.70000
   68    75    77    37.50000  110.70000
   68    75    78    37.50000  110.70000
   72    84    85    37.50000  110.70000
   72    84    55    58.35000  112.70000
   72    84    95    50.00000  109.50000
   74    72    73    33.00000  107.80000
   84    72    73    37.50000  110.70000
   84    72    74    37.50000  110.70000
   84    55    56    50.00000  109.50000
   84    55    60    58.35000  112.70000
   84    95    96    55.00000  108.50000
   55    51    52    37.50000  110.70000
   55    51    53    58.35000  112.70000
   55    84    85    37.50000  110.70000
   55    60    63    58.35000  112.70000
   60    33    34    37.50000  110.70000
   60    33    38    70.00000  112.02700
   60    44    45    65.00000  117.92700
   60    55    56    50.00000  109.50000
   60    63    64    37.50000  110.70000
   60    63    65    37.50000  110.70000
   60    63    66    37.50000  110.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   95    84    85    35.00000  109.50000
   95    84    55    50.00000  109.50000
   75    68    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
   69    67    68    50.00000  109.50000
   69    79    86    92.60000  111.55000
   69    79    87    90.00000  108.56700
   69    79    91    90.00000  108.56700
   79    87    88    45.00000  108.72000
   79    87    89    45.00000  108.72000
   79    87    90    45.00000  108.72000
   79    91    92    45.00000  108.72000
   79    91    93    45.00000  108.72000
   79    91    94    45.00000  108.72000
   86    61    62    35.00000  109.50000
   86    61    67    50.00000  109.50000
   87    79    86    90.00000  108.56700
   89    87    88    33.00000  107.80000
   90    87    88    33.00000  107.80000
   90    87    89    33.00000  107.80000
   91    79    86    90.00000  108.56700
   91    79    87    65.00000  112.71400
   93    91    92    33.00000  107.80000
   94    91    92    33.00000  107.80000
   94    91    93    33.00000  107.80000
   70    67    68    63.00000  111.10000
   70    67    69    90.00000  108.74100
   70    80    81    35.00000  109.50000
   70    80    82    35.00000  109.50000
   70    80    83    35.00000  109.50000
   80    70    71    80.00000  120.40000
   82    80    81    33.00000  107.80000
   83    80    81    33.00000  107.80000
   83    80    82    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    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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    60   0.01700  1.0 1.0
   24    29    33    60  -0.23550 -1.0 2.0
   24    29    33    60   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   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    60    44   0.56750  1.0 1.0
   29    33    60    44  -0.07550 -1.0 2.0
   29    33    60    44   0.20000  1.0 3.0
   29    33    60    55   0.44750  1.0 1.0
   29    33    60    55  -0.17800 -1.0 2.0
   29    33    60    55   0.20200  1.0 3.0
   29    33    60    63   0.44750  1.0 1.0
   29    33    60    63  -0.17800 -1.0 2.0
   29    33    60    63   0.20200  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
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   87    79    91    94   0.15000  1.0 3.0
   91    79    86    61   0.06250  1.0 1.0
   91    79    86    61  -0.01100 -1.0 2.0
   91    79    86    61   0.28050  1.0 3.0
   91    79    87    88   0.15000  1.0 3.0
   91    79    87    89   0.15000  1.0 3.0
   91    79    87    90   0.15000  1.0 3.0
   70    67    68    53  -0.95700  1.0 1.0
   70    67    68    53  -0.18200 -1.0 2.0
   70    67    68    53   0.29450  1.0 3.0
   70    67    68    72  -0.95700  1.0 1.0
   70    67    68    72  -0.18200 -1.0 2.0
   70    67    68    72   0.29450  1.0 3.0
   70    67    68    75  -0.95700  1.0 1.0
   70    67    68    75  -0.18200 -1.0 2.0
   70    67    68    75   0.29450  1.0 3.0
   70    67    69    79  -1.11000  1.0 1.0
   70    67    69    79   0.50250 -1.0 2.0
   70    67    69    79   0.47450  1.0 3.0
   71    70    80    81   0.00000  1.0 1.0
   71    70    80    82   0.00000  1.0 1.0
   71    70    80    83   0.00000  1.0 1.0
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
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   40    43    42    44   1.10000 -1.0 2.0
   45    60    44    42   1.10000 -1.0 2.0
   67    80    70    71  10.50000 -1.0 2.0
END
