* LIGAND DATABASE FILE (OPLS2005)
*
001     106   110    203    333     611
    1     0 S   NP   _N1_     1    28.87290    93.87418   -19.60531
    2     1 S   H    _HN1     2     1.02946   106.20643    38.86546
    3     1 S   H    _H1_     3     1.02863    33.47627   135.75220
    4     1 S   H    _H2_     4     1.02801    76.64742   -66.46538
    5     1 S   CT   _CA1     5     1.50033   136.15759  -174.51774
    6     5 S   HC   _HA1     6     1.09587   105.35508    33.18164
    7     5 S   CO3  _C1_     7     1.53916   111.87617   -86.91535
    8     7 S   O2Z  _O11     8     1.26370   115.29656   -61.72946
    9     7 S   O2Z  _O12     9     1.26214   114.86978   117.60219
   10     5 S   CT   _CB1    10     1.53103   107.43855   150.76721
   11    10 S   HC   HB11    11     1.09818   109.71819   -51.49926
   12    10 S   HC   HB12    12     1.09831   110.32863    65.02363
   13    10 S   CT   _CG1    13     1.53044   112.40962  -172.57012
   14    13 S   HC   HG11    14     1.09502   110.36081   -51.98890
   15    13 S   HC   HG12    15     1.09586   110.34333    67.05756
   16    13 S   C    _CD1    16     1.51693   111.57751  -172.72808
   17    16 S   O    _OE1    17     1.22761   122.89351   -22.86786
   18    16 S   N    _N2_    18     1.38550   111.96993   157.63954
   19    18 S   H    _HN2    19     1.01573   119.23074     3.01051
   20    18 S   CT1  _CA2    20     1.46214   123.24523  -175.08068
   21    20 S   HC   _HA2    21     1.09727   109.39166   -15.10364
   22    20 S   C    _C2_    22     1.53356   108.37899  -131.03090
   23    22 S   O    _O2_    23     1.23001   122.27508  -145.43512
   24    20 S   CT   _CB2    32     1.53572   111.14843   106.79705
   25    24 S   HC   HB21    33     1.09419   109.46623    57.21334
   26    24 S   HC   HB22    34     1.09511   110.21408   175.72035
   27    22 S   N    _N3_    24     1.38521   113.30992    41.87324
   28    27 S   H    _HN3    25     1.01534   118.91016    -0.46772
   29    24 S   S    _SG2    35     1.83066   111.56404   -64.78371
   30    27 S   CT   _CA3    26     1.45458   123.45670   175.21914
   31    30 S   HC   HA31    27     1.09522   109.24614    23.92261
   32    30 S   HC   HA32    28     1.09495   107.10638   140.92433
   33    29 S   CT   _C22    36     1.89553   101.01460   162.86656
   34    30 S   CO3  _C3_    29     1.52930   113.16228   -99.57020
   35    34 S   O2Z  _O31    30     1.26400   115.43069   -43.69024
   36    34 S   O2Z  _O32    31     1.26360   114.96908   137.27446
   37    33 S   CT   _C13    37     1.56056   108.22971   -77.73114
   38    37 S   HC   _H3_    38     1.09714   107.95795    54.50286
   39    33 S   CT   _C21    67     1.56886   108.17807   160.11023
   40    33 S   OH   _O35   105     1.43013   105.90755    41.65667
   41    40 S   HO   _H15   106     0.97434   108.23566   180.00000
   42    37 S   CO4  _C12    39     1.53499   113.36463   167.52149
   43    42 S   O    _O33    40     1.22956   121.35018   -32.95763
   44    39 S   OH   _O36    68     1.44104   108.15342   -53.28915
   45    44 S   HO   _H16    69     0.97388   107.37587   -48.14156
   46    42 S   CA   _C11    41     1.49322   119.94028   151.44924
   47    46 S   CA   _C6_    42     1.40712   120.00898     2.42479
   48    47 S   CA   _C7_    43     1.40950   118.77531   178.42021
   49    48 S   HA   _H10    44     1.08807   120.36352  -179.00574
   50    47 S   CT   _C5_    52     1.51844   121.47939     0.02798
   51    48 S   CA   _C8_    45     1.39319   121.30947     0.89460
   52    51 S   HA   _H11    46     1.08598   120.09223   179.59074
   53    37 S   CT   _C14    53     1.53983   111.92612   -65.65453
   54    53 S   HC   _H4_    54     1.09825   109.42192    62.47639
   55    50 S   CT   _C4_    99     1.53803   108.94233    95.36093
   56    55 S   HC   _H7_   100     1.09490   110.80143  -176.21271
   57    55 S   HC   _H8_   101     1.09692   110.90642    66.12660
   58    55 S   HC   _H9_   102     1.09458   112.80669   -54.65648
   59    50 S   OH   _O40   103     1.43276   109.35413  -147.90268
   60    59 S   HO   _H35   104     0.97618   108.39326  -173.32688
   61    51 S   CA   _C9_    47     1.38797   119.75283    -0.53741
   62    61 S   HA   _H12    48     1.08663   119.72305   179.93744
   63    53 S   CT   _C15    55     1.54447   111.39018   -53.84171
   64    63 S   HC   _H13    56     1.09791   109.14510   172.88049
   65    63 S   HC   _H14    57     1.09364   109.04248   -72.33839
   66    46 S   CA   _C10    49     1.40790   120.70537  -178.40406
   67    63 S   CT   _C16    58     1.55283   114.25225    52.38724
   68    67 S   HC   _H5_    59     1.09541   105.26554    68.49953
   69    66 S   OH   _O39    50     1.37019   123.70978     1.17136
   70    69 S   HO   _H34    51     0.97349   108.91352     1.29331
   71    67 S   CT   _C17    60     1.57172   110.23545  -175.60649
   72    71 S   HC   _H6_    61     1.10321   105.69326   -52.06748
   73    71 S   CMA  _C18    62     1.55738   107.52686    64.59973
   74    73 S   OM   _O38    63     1.26743   111.06060  -138.13219
   75    71 S   NT   _N6_    90     1.50019   113.25602  -169.01914
   76    73 S   CM   _C19    64     1.35682   118.56047    39.02753
   77    75 S   CT   _C29    91     1.46798   113.08430  -176.58866
   78    77 S   HC   _H28    92     1.09682   110.65990  -177.02218
   79    77 S   HC   _H29    93     1.09437   111.53269    66.60700
   80    77 S   HC   _H30    94     1.09587   112.17927   -56.46585
   81    75 S   CT   _C30    95     1.46945   111.98267    61.06031
   82    81 S   HC   _H31    96     1.09671   110.71542   176.79155
   83    81 S   HC   _H32    97     1.09584   112.00826    56.15379
   84    81 S   HC   _H33    98     1.09312   112.00270   -66.45229
   85    76 S   CO4  _C20    65     1.49443   121.94553     0.45067
   86    85 S   O    _O34    66     1.23342   119.00528   159.16507
   87    76 S   C    _C23    70     1.49785   119.46870   179.58646
   88    87 S   O    _O37    71     1.22707   121.36904  -118.09980
   89    87 S   N    _N4_    72     1.38057   112.96275    64.69104
   90    89 S   H    _H17    73     1.01449   119.66489    -2.17879
   91    89 S   CT   _C24    74     1.44386   122.45974   178.96959
   92    91 S   HC   _H18    75     1.09635   106.60135   -62.17466
   93    91 S   HC   _H19    76     1.09666   109.08764    54.03738
   94    91 S   NT   _N5_    77     1.45499   109.16791   178.14027
   95    94 S   CT   _C25    78     1.46298   111.99443   170.37633
   96    95 S   HC   _H20    79     1.09766   111.64768    48.42237
   97    95 S   HC   _H21    80     1.09463   112.17834   -73.76133
   98    95 S   CT   _C26    81     1.52078   102.96939   166.22427
   99    98 S   HC   _H22    82     1.09463   111.54648  -146.82457
  100    98 S   HC   _H23    83     1.09641   110.80574    92.97376
  101    98 S   CT   _C27    84     1.52482   105.09212   -25.51108
  102   101 S   HC   _H24    85     1.09643   109.73917   119.44888
  103   101 S   HC   _H25    86     1.09466   111.76335  -120.91335
  104    94 S   CT   _C28    87     1.46468   113.62447   -71.15012
  105   104 S   HC   _H26    88     1.09445   112.67147    75.24303
  106   104 S   HC   _H27    89     1.09753   111.67572   -47.30233
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  11   5   4   3
  20   2   1   1  20   9  19   6   1  11   4   8   2  13  17  10
   4  14   5   3  13   6   6   3   2   1   2   1   4   2   9   4
   3   2  11   5   1   1  15   6  10   4   9   7   7   3   2   1
   3   2   1   1   4   1   7   3   7   4  11   4   3  12  11   6
   5   8   5   4   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    53    67    85    39    44    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    46    50    53    54    63    67    68    71    76    85    86    39    44    45    40    41  
   35    36  
   36  
    0  
   38    42    43    46    47    66    50    53    54    63    64    65    67    85    39    44    55    59    40    41  
   42    43    46    50    53    54    63    39    40  
   44    45    87    75    40    41    42    53    63    64    65    67    68    71    72    73    76    85    86  
   41    42    44    53    67    85  
    0  
   43    46    47    48    61    66    69    50    53    54    63  
   46    47    66    53  
   45    63    67    68    71    76    85    86  
   67    85  
   47    48    49    51    61    62    66    69    70    50    53    55    59  
   48    49    51    52    61    66    69    50    53    54    63    55    56    57    58    59    60  
   49    51    52    61    62    66    50    53    55    59  
   51    52    61    50  
   53    54    63    64    65    67    55    56    57    58    59    60    51    66  
   52    61    62    66    69  
   61    62    66  
   54    63    64    65    67    68    71    55    56    57    58    59    60  
   63    64    65    67    55    59  
   56    57    58    59    60    63  
   57    58    59  
   58    59  
   59  
   60    63  
    0  
   62    66    69    70  
   66    69  
   64    65    67    68    71    72    73    85    75  
   65    67    68    71  
   67    68    71  
   69    70  
   68    71    72    73    74    76    85    86    75    77    81  
   71    72    73    85    75  
   70  
    0  
   72    73    74    76    85    87    75    77    78    79    80    81    82    83    84  
   73    74    76    75    77    81  
   74    76    85    86    87    88    89    75    77    81  
   76    85    87    75  
   77    78    79    80    81    82    83    84    76  
   85    86    87    88    89    90    91  
   78    79    80    81    82    83    84  
   79    80    81  
   80    81  
   81  
   82    83    84  
   83    84  
   84  
    0  
   86    87    88    89  
   87  
   88    89    90    91    92    93    94  
   89    90    91  
   90    91    92    93    94    95   104  
   91    92    93    94  
   92    93    94    95    96    97    98   101   104   105   106  
   93    94    95   104  
   94    95   104  
   95    96    97    98    99   100   101   102   103   104   105   106  
   96    97    98    99   100   101   102   103   104   105   106  
   97    98    99   100   101   104  
   98    99   100   101   104  
   99   100   101   102   103   104   105   106  
  100   101   102   103   104  
  101   102   103   104  
  102   103   104   105   106  
  103   104   105   106  
  104   105   106  
  105   106  
  106  
    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   0.432500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   41   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   42   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5000   0.0660   0.380000   1.9750   1.7500   0.005000000  -0.741685710
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5000   0.0660  -0.120000   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   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   67   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   74   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   75   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   76   3.5500   0.0760  -0.657900   2.0020   1.7750   0.023028004  -0.852763146
   77   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   86   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   87   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   88   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   89   3.2500   0.1700  -0.500000   2.1120   1.8750   0.051222218  -2.220205820
   90   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   91   3.5000   0.0660   0.290000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   94   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   95   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    39   268.000  1.529
   33    40   320.000  1.410
   37    38   340.000  1.090
   37    42   317.000  1.522
   37    53   268.000  1.529
   42    43   570.000  1.229
   42    46   310.000  1.470
   46    47   469.000  1.400
   46    66   469.000  1.400
   47    48   469.000  1.400
   47    50   317.000  1.510
   48    49   367.000  1.080
   48    51   469.000  1.400
   51    52   367.000  1.080
   51    61   469.000  1.400
   61    62   367.000  1.080
   61    66   469.000  1.400
   66    69   450.000  1.364
   69    70   553.000  0.945
   50    53   268.000  1.529
   50    55   268.000  1.529
   50    59   320.000  1.410
   53    54   340.000  1.090
   53    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    67   268.000  1.529
   67    68   340.000  1.090
   67    71   268.000  1.529
   67    39   268.000  1.529
   71    72   340.000  1.090
   71    73   270.000  1.512
   71    75   382.000  1.448
   73    74   745.000  1.250
   73    76   465.000  1.376
   76    85   320.000  1.462
   76    87   410.000  1.444
   85    86   570.000  1.229
   85    39   317.000  1.522
   39    44   320.000  1.410
   44    45   553.000  0.945
   87    88   570.000  1.229
   87    89   490.000  1.335
   89    90   434.000  1.010
   89    91   337.000  1.449
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   382.000  1.448
   94    95   382.000  1.448
   94   104   382.000  1.448
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   268.000  1.529
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   268.000  1.529
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   268.000  1.529
  104   105   340.000  1.090
  104   106   340.000  1.090
   75    77   382.000  1.448
   75    81   382.000  1.448
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   59    60   553.000  0.945
   40    41   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    39    75.00000  111.63000
   29    33    40    85.00000  114.68000
   33    37    38    37.50000  110.70000
   33    37    42    63.00000  111.10000
   33    37    53    58.35000  112.70000
   33    39    67    58.35000  112.70000
   33    39    85    63.00000  111.10000
   33    39    44    50.00000  109.50000
   33    40    41    55.00000  108.50000
   37    42    43    80.00000  120.40000
   37    42    46    65.00000  115.47100
   37    53    50    58.35000  112.70000
   37    53    54    37.50000  110.70000
   37    53    63    58.35000  112.70000
   42    37    38    35.00000  109.50000
   42    46    47    60.00000  119.52600
   42    46    66    60.00000  119.52600
   46    42    43    75.00000  123.78400
   46    47    48    63.00000  120.00000
   46    47    50    70.00000  120.00000
   46    66    61    63.00000  120.00000
   46    66    69    70.00000  120.00000
   47    48    49    35.00000  120.00000
   47    48    51    63.00000  120.00000
   47    50    53    70.00000  112.17500
   47    50    55    70.00000  112.17500
   47    50    59    90.00000  112.51600
   48    51    52    35.00000  120.00000
   48    51    61    63.00000  120.00000
   51    48    49    35.00000  120.00000
   51    61    62    35.00000  120.00000
   51    61    66    63.00000  120.00000
   61    51    52    35.00000  120.00000
   61    66    69    70.00000  120.00000
   66    46    47    63.00000  120.00000
   66    61    62    35.00000  120.00000
   66    69    70    35.00000  113.00000
   50    47    48    70.00000  120.00000
   50    53    54    37.50000  110.70000
   50    53    63    58.35000  112.70000
   50    55    56    37.50000  110.70000
   50    55    57    37.50000  110.70000
   50    55    58    37.50000  110.70000
   50    59    60    55.00000  108.50000
   53    37    38    37.50000  110.70000
   53    37    42    63.00000  111.10000
   53    63    64    37.50000  110.70000
   53    63    65    37.50000  110.70000
   53    63    67    58.35000  112.70000
   63    53    54    37.50000  110.70000
   63    67    68    37.50000  110.70000
   63    67    71    58.35000  112.70000
   63    67    39    58.35000  112.70000
   65    63    64    33.00000  107.80000
   67    63    64    37.50000  110.70000
   67    63    65    37.50000  110.70000
   67    71    72    37.50000  110.70000
   67    71    73    70.00000  112.02700
   67    71    75    56.20000  109.47000
   67    39    85    63.00000  111.10000
   67    39    44    50.00000  109.50000
   71    67    68    37.50000  110.70000
   71    73    74    85.00000  112.85300
   71    73    76    65.00000  122.18000
   71    75    77    51.80000  107.20000
   71    75    81    51.80000  107.20000
   73    71    72    45.00000  110.52000
   73    76    85    60.00000  125.92000
   73    76    87    60.00000  120.04000
   76    73    74    65.00000  137.10300
   76    85    86    80.00000  123.72100
   76    85    39    65.00000  118.62400
   76    87    88    80.00000  125.30000
   76    87    89    80.00000  111.56200
   85    39    44    90.00000  109.61100
   39    33    37    58.35000  112.70000
   39    67    68    37.50000  110.70000
   39    67    71    58.35000  112.70000
   39    85    86    80.00000  120.40000
   39    44    45    55.00000  108.50000
   87    76    85    55.00000  123.68000
   87    89    90    35.00000  119.80000
   87    89    91    50.00000  121.90000
   89    87    88    80.00000  122.90000
   89    91    92    35.00000  109.50000
   89    91    93    35.00000  109.50000
   89    91    94    80.00000  116.76000
   91    89    90    38.00000  118.40000
   91    94    95    51.80000  107.20000
   91    94   104    51.80000  107.20000
   93    91    92    33.00000  107.80000
   94    91    92    35.00000  109.50000
   94    91    93    35.00000  109.50000
   94    95    96    35.00000  109.50000
   94    95    97    35.00000  109.50000
   94    95    98    56.20000  109.47000
   94   104   101    56.20000  109.47000
   94   104   105    35.00000  109.50000
   94   104   106    35.00000  109.50000
   95    98    99    37.50000  110.70000
   95    98   100    37.50000  110.70000
   95    98   101    58.35000  112.70000
   97    95    96    33.00000  107.80000
   98    95    96    37.50000  110.70000
   98    95    97    37.50000  110.70000
   98   101   102    37.50000  110.70000
   98   101   103    37.50000  110.70000
   98   101   104    58.35000  112.70000
  100    98    99    33.00000  107.80000
  101    98    99    37.50000  110.70000
  101    98   100    37.50000  110.70000
  101   104   105    37.50000  110.70000
  101   104   106    37.50000  110.70000
  103   101   102    33.00000  107.80000
  104    94    95    51.80000  107.20000
  104   101   102    37.50000  110.70000
  104   101   103    37.50000  110.70000
  106   104   105    33.00000  107.80000
   75    71    72    35.00000  109.50000
   75    71    73    75.00000  110.70900
   75    77    78    35.00000  109.50000
   75    77    79    35.00000  109.50000
   75    77    80    35.00000  109.50000
   75    81    82    35.00000  109.50000
   75    81    83    35.00000  109.50000
   75    81    84    35.00000  109.50000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   81    75    77    51.80000  107.20000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   55    50    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
   59    50    53    50.00000  109.50000
   59    50    55    50.00000  109.50000
   40    33    37    50.00000  109.50000
   40    33    39    50.00000  109.50000
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
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  104    94    95    97   0.28000  1.0 3.0
  104    94   -95    98   0.23450  1.0 1.0
  104    94   -95    98   0.02050 -1.0 2.0
  104    94   -95    98   0.25250  1.0 3.0
   75    71    73    74   0.09700  1.0 1.0
   75    71    73    74   0.15600 -1.0 2.0
   75    71    73    74  -0.50800  1.0 3.0
   75    71    73    76   0.90200  1.0 1.0
   75    71    73    76   0.57900 -1.0 2.0
   75    71    73    76  -0.62100  1.0 3.0
   77    75    81    82   0.28000  1.0 3.0
   77    75    81    83   0.28000  1.0 3.0
   77    75    81    84   0.28000  1.0 3.0
   81    75    77    78   0.28000  1.0 3.0
   81    75    77    79   0.28000  1.0 3.0
   81    75    77    80   0.28000  1.0 3.0
   55    50    53    37   0.56750  1.0 1.0
   55    50    53    37  -0.07550 -1.0 2.0
   55    50    53    37   0.20000  1.0 3.0
   55    50    53    54   0.15000  1.0 3.0
   55    50    53    63   0.56750  1.0 1.0
   55    50    53    63  -0.07550 -1.0 2.0
   55    50    53    63   0.20000  1.0 3.0
   55    50    59    60  -0.11600  1.0 1.0
   55    50    59    60  -0.09450 -1.0 2.0
   55    50    59    60   0.21250  1.0 3.0
   59    50    53    37   0.86500  1.0 1.0
   59    50    53    37  -0.17500 -1.0 2.0
   59    50    53    37   0.20800  1.0 3.0
   59    50    53    54   0.23400  1.0 3.0
   59    50    53    63   0.86500  1.0 1.0
   59    50    53    63  -0.17500 -1.0 2.0
   59    50    53    63   0.20800  1.0 3.0
   59    50    55    56   0.23400  1.0 3.0
   59    50    55    57   0.23400  1.0 3.0
   59    50    55    58   0.23400  1.0 3.0
   40    33    37    38   0.23400  1.0 3.0
   40    33    37    42  -0.09450  1.0 1.0
   40    33    37    42  -1.12950 -1.0 2.0
   40    33    37    42   0.54000  1.0 3.0
   40    33    37    53   0.86500  1.0 1.0
   40    33    37    53  -0.17500 -1.0 2.0
   40    33    37    53   0.20800  1.0 3.0
   40    33    39    67   0.86500  1.0 1.0
   40    33    39    67  -0.17500 -1.0 2.0
   40    33    39    67   0.20800  1.0 3.0
   40    33    39    85  -0.09450  1.0 1.0
   40    33    39    85  -1.12950 -1.0 2.0
   40    33    39    85   0.54000  1.0 3.0
   40    33    39    44   3.75450  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
   35    30    34    36  10.50000 -1.0 2.0
   37    46    42    43  10.50000 -1.0 2.0
   47    66    46    42   4.00000 -1.0 2.0
   48    50    47    46   4.00000 -1.0 2.0
   51    49    48    47   1.10000 -1.0 2.0
   61    52    51    48   1.10000 -1.0 2.0
   66    62    61    51   1.10000 -1.0 2.0
   61    69    66    46   4.00000 -1.0 2.0
   71    74    73    76   1.10000 -1.0 2.0
   85    87    76    73   1.10000 -1.0 2.0
   76    39    85    86  10.50000 -1.0 2.0
   76    89    87    88  10.50000 -1.0 2.0
   90    87    89    91   1.00000 -1.0 2.0
END
