* LIGAND DATABASE FILE (OPLS2005)
*
001     107   111    212    345     641
    1     0 S   NP   _N1_     1    29.69890    98.95684   -17.01945
    2     1 S   H    _HN1     2     1.02831    64.61542   156.69299
    3     1 S   H    _H1_     3     1.02775    53.93919   -63.23760
    4     1 S   H    _H2_     4     1.02969    91.43102    48.47288
    5     1 S   CT   _CA1     5     1.50113   157.73182  -120.34341
    6     5 S   HC   _HA1     6     1.09577   105.26512   -14.37446
    7     5 S   CO3  _C1_     7     1.53798   112.34629  -134.57661
    8     7 S   O2Z  _O11     8     1.26348   115.03332   -45.32391
    9     7 S   O2Z  _O12     9     1.26245   114.90769   133.92071
   10     5 S   CT   _CB1    10     1.53092   107.39580   103.45614
   11    10 S   HC   HB11    11     1.09820   109.30164   -51.72114
   12    10 S   HC   HB12    12     1.09827   110.39296    64.76950
   13    10 S   CT   _CG1    13     1.53014   112.73483  -172.93348
   14    13 S   HC   HG11    14     1.09598   110.29314   -62.18377
   15    13 S   HC   HG12    15     1.09631   110.16456    57.03678
   16    13 S   C    _CD1    16     1.51808   112.19803   177.26112
   17    16 S   O    _OE1    17     1.22730   123.20025   -10.26665
   18    16 S   N    _N2_    18     1.38618   111.70716   170.26647
   19    18 S   H    _HN2    19     1.01587   119.04924     1.37885
   20    18 S   CT1  _CA2    20     1.46237   123.35838  -178.28172
   21    20 S   HC   _HA2    21     1.09738   109.37157   -13.42562
   22    20 S   C    _C2_    22     1.53421   108.27823  -129.10534
   23    22 S   O    _O2_    23     1.23010   122.26524  -145.43359
   24    20 S   CT   _CB2    32     1.53658   111.42608   108.66280
   25    24 S   HC   HB21    33     1.09330   109.23916    55.95548
   26    24 S   HC   HB22    34     1.09446   109.76743   174.67446
   27    22 S   N    _N3_    24     1.38517   113.33856    41.90130
   28    27 S   H    _HN3    25     1.01529   118.91274    -0.55567
   29    24 S   S    _SG2    35     1.83032   111.27892   -66.04969
   30    27 S   CT   _CA3    26     1.45450   123.44555   175.12705
   31    30 S   HC   HA31    27     1.09524   109.23354    24.41536
   32    30 S   HC   HA32    28     1.09496   107.12013   141.42014
   33    29 S   CT   _C22    36     1.88954   103.10362   165.36383
   34    30 S   CO3  _C3_    29     1.52928   113.12474   -99.05961
   35    34 S   O2Z  _O31    30     1.26404   115.41279   -44.25684
   36    34 S   O2Z  _O32    31     1.26357   114.97726   136.68186
   37    33 S   CT   _C8_    37     1.53805   106.21888   -64.59537
   38    37 S   HC   _H39    38     1.09580   111.52360    78.69972
   39    37 S   HC   _H40    39     1.09785   111.90404   -41.55731
   40    33 S   CT   _C26   104     1.53626   107.36210    55.11855
   41    40 S   HC   _H62   105     1.09540   112.14490    56.49404
   42    40 S   HC   _H63   106     1.09535   111.92964   -64.39374
   43    40 S   HC   _H64   107     1.08869   112.64670   177.53725
   44    37 S   CO4  _C4_    40     1.50561   112.40500  -160.46811
   45    44 S   O    _O27    41     1.23067   121.16484  -129.20409
   46    44 S   CT   _C11    42     1.52118   116.10880    55.02293
   47    46 S   HC   _H45    43     1.09641   107.65503    62.21942
   48    46 S   CT   _C20    44     1.55847   110.68727   -59.10773
   49    46 S   OH   _O35   102     1.41919   107.87771   178.32450
   50    49 S   HO   _H71   103     0.97294   107.59875   -56.95827
   51    33 S   CT   _C13    45     1.57848   106.24744   177.44810
   52    51 S   HC   _H47    46     1.10256   103.83759    47.24067
   53    48 S   CT   _C24    98     1.54938   107.88636   -68.62238
   54    53 S   HC   _H56    99     1.08984   113.48627   168.38943
   55    53 S   HC   _H57   100     1.09191   111.78278    47.58902
   56    53 S   HC   _H58   101     1.08931   113.20592   -69.05544
   57    51 S   CT   _C9_    47     1.54902   113.83371   -68.14688
   58    57 S   HC   _H41    48     1.09329   111.62422   -74.17939
   59    57 S   HC   _H42    49     1.09536   110.21453    43.18775
   60    57 S   CT   _C16    50     1.52662   111.30071   162.42175
   61    60 S   HC   _H50    51     1.09744   107.95580   178.17019
   62    60 S   CT   _C19    52     1.52811   114.01088    54.90852
   63    60 S   OS   _O33    64     1.46242   105.84769   -69.47801
   64    62 S   CT   _C10    53     1.53725   115.38446    84.25501
   65    64 S   HC   _H43    54     1.08841   115.62664   -92.30420
   66    64 S   HC   _H44    55     1.09615   111.98391    31.22175
   67    48 S   CT   _C15    88     1.61152   109.65353   167.59302
   68    67 S   HC   _H49    89     1.09889   102.71926   -56.08756
   69    64 S   OS   _O34    56     1.45183   106.20271   147.45467
   70    69 S   CT   _C21    57     1.45492   108.06303    -7.86696
   71    62 S   CT   _C14    58     1.53051   106.27016  -169.17865
   72    71 S   HC   _H48    59     1.10497   108.31085   -56.55867
   73    70 S   CT   _C18    84     1.54435   107.71472    95.91757
   74    73 S   HC   _H52    85     1.09806   108.16353    65.15980
   75    70 S   CT   _C25    94     1.52655   108.08428  -143.56902
   76    75 S   HC   _H59    95     1.09607   110.51903   -57.48943
   77    75 S   HC   _H60    96     1.09331   112.41774  -178.42294
   78    75 S   HC   _H61    97     1.09581   110.90829    59.90889
   79    71 S   CT   _C12    60     1.51535   113.06656    60.60254
   80    79 S   HC   _H46    61     1.09182   112.79888    63.54198
   81    73 S   CT   _C17    86     1.54431   112.57990   -54.80000
   82    81 S   HC   _H51    87     1.09553   108.60911  -158.89988
   83    73 S   OH   _O37    92     1.42373   110.25902  -178.35004
   84    83 S   HO   _H73    93     0.97253   107.84664  -173.68801
   85    79 S   CO4  _C5_    62     1.51826   109.79380   -55.59918
   86    85 S   O    _O28    63     1.22796   122.76642  -146.49643
   87    79 S   OS   _O38    65     1.43651   108.52821  -173.77417
   88    81 S   OH   _O36    90     1.42218   107.42631    85.52666
   89    88 S   HO   _H72    91     0.97223   107.93410    65.88094
   90    87 S   CO4  _C7_    66     1.36572   117.61414  -148.65516
   91    90 S   O    _O30    67     1.22375   125.97541    -0.43205
   92    90 S   CT   _C29    68     1.52082   109.28322   179.12688
   93    92 S   HC   _H70    69     1.09711   109.27923   -49.42809
   94    92 S   CT   _C28    70     1.53115   109.85156    71.92208
   95    94 S   HC   _H68    71     1.09725   109.81458    61.87306
   96    94 S   HC   _H69    72     1.09629   110.35325   -55.85608
   97    92 S   OS   _O39    77     1.43732   109.10772  -169.55709
   98    94 S   CT   _C27    73     1.52261   112.17981  -177.49931
   99    98 S   HC   _H65    74     1.09463   110.90822    58.89592
  100    98 S   HC   _H66    75     1.09444   111.40878   -61.89465
  101    98 S   HC   _H67    76     1.09462   110.13391   178.46367
  102    97 S   CO4  _C6_    78     1.36356   116.73422    80.77658
  103   102 S   O    _O29    79     1.22326   126.34216     0.10087
  104   102 S   CT   _C23    80     1.49822   109.51790  -179.77883
  105   104 S   HC   _H53    81     1.09291   109.83582   -60.45984
  106   104 S   HC   _H54    82     1.09378   109.35997  -179.47998
  107   104 S   HC   _H55    83     1.09288   109.81400    61.45295
  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  13   5   4   3
  19   2   1   1  15   6   5   8   3   2   1   9   4  15   6  21
   4   1  15   6   8   3   2   1  10   5   4  16   6  19   8  12
   5   4  13   5  12  17  15   6  12   6   6   2   1   1   7   4
   5   3   2   1   3   1   6   1   1   9   4  12   6   8   6   5
   7   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    44    48    51    52    57    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    44    45    46    48    51    52    57    58    59    60    67    53    40    41    42    43  
   35    36  
   36  
    0  
   38    39    44    45    46    47    48    51    52    57    49    40    41    42    43  
   39    44    45    46    51    40  
   44    45    46    51    40  
   41    42    43    44    48    51    52    57  
   42    43    51  
   43    51  
   51  
   45    46    47    48    51    67    53    49    50  
   46    47    48    49  
   47    48    51    52    57    62    81    67    68    53    54    55    56    49    50  
   48    51    67    53    49    50  
   51    52    57    58    59    60    62    64    71    73    81    82    67    68    88    53    54    55    56    49    50  
   50    51    53    67  
    0  
   52    57    58    59    60    61    62    63    81    67    68    53    54    55    56  
   57    58    59    60    67    53  
   54    55    56    57    62    67    68    81  
   55    56    67  
   56    67  
   67  
   58    59    60    61    62    64    71    85    63    67  
   59    60    61    62    63  
   60    61    62    63  
   61    62    64    65    66    69    70    71    72    79    85    86    63    81    67    68  
   62    64    71    85    63    67  
   64    65    66    69    70    71    72    79    80    85    63    87    73    81    82    67    68    88    75  
   87    67    64    71    79    80    85    86  
   65    66    69    70    71    72    79    73    81    67    68    75  
   66    69    70    71    67  
   69    70    71    67  
   68    88    89    83    69    70    71    72    73    74    79    81    82  
   88    71    73    81    82  
   70    71    72    79    73    74    81    83    75    76    77    78  
   71    72    79    80    85    87    73    74    81    82    88    83    84    75    76    77    78  
   72    79    80    85    86    87    90    73    74    81    83    75    76    77    78  
   79    80    85    87    73    75  
   74    81    82    88    89    83    84    75    76    77    78    79  
   81    82    88    83    84    75  
   76    77    78    79    81    83  
   77    78  
   78  
    0  
   80    85    86    87    90    91    92  
   85    86    87    90  
   82    88    89    83    84  
   88    89    83  
   84    88  
    0  
   86    87    90  
   87  
   90    91    92    93    94    97  
   89  
    0  
   91    92    93    94    95    96    98    97   102  
   92    93    94    97  
   93    94    95    96    98    99   100   101    97   102   103   104  
   94    95    96    98    97   102  
   95    96    98    99   100   101    97   102  
   96    98    99   100   101    97  
   98    99   100   101    97  
  102   103   104   105   106   107    98  
   99   100   101  
  100   101  
  101  
    0  
  103   104   105   106   107  
  104   105   106   107  
  105   106   107  
  106   107  
  107  
    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   0.167500   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   49   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   50   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   62   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   63   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   64   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   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   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   70   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   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   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   81   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   84   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   85   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   86   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   87   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   88   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   89   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   90   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   91   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   92   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   94   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   98   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  103   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  104   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  106   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  107   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    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    51   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    44   317.000  1.522
   44    45   570.000  1.229
   44    46   317.000  1.522
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    49   320.000  1.410
   48    51   268.000  1.529
   48    67   268.000  1.529
   48    53   268.000  1.529
   51    52   340.000  1.090
   51    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   268.000  1.529
   60    61   340.000  1.090
   60    62   268.000  1.529
   60    63   320.000  1.410
   62    64   268.000  1.529
   62    71   268.000  1.529
   62    67   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    69   320.000  1.410
   69    70   320.000  1.410
   70    71   268.000  1.529
   70    73   268.000  1.529
   70    75   268.000  1.529
   71    72   340.000  1.090
   71    79   268.000  1.529
   79    80   340.000  1.090
   79    85   317.000  1.522
   79    87   320.000  1.410
   85    86   570.000  1.229
   85    63   214.000  1.327
   87    90   214.000  1.327
   90    91   570.000  1.229
   90    92   317.000  1.522
   92    93   340.000  1.090
   92    94   268.000  1.529
   92    97   320.000  1.410
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    98   268.000  1.529
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
   97   102   214.000  1.327
  102   103   570.000  1.229
  102   104   317.000  1.522
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   340.000  1.090
   73    74   340.000  1.090
   73    81   268.000  1.529
   73    83   320.000  1.410
   81    82   340.000  1.090
   81    67   268.000  1.529
   81    88   320.000  1.410
   67    68   340.000  1.090
   88    89   553.000  0.945
   83    84   553.000  0.945
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   49    50   553.000  0.945
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   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    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    51    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    44    63.00000  111.10000
   33    51    48    58.35000  112.70000
   33    51    52    37.50000  110.70000
   33    51    57    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    80.00000  120.40000
   37    44    46    70.00000  116.00000
   39    37    38    33.00000  107.80000
   44    37    38    35.00000  109.50000
   44    37    39    35.00000  109.50000
   44    46    47    35.00000  109.50000
   44    46    48    63.00000  111.10000
   44    46    49    90.00000  109.61100
   46    44    45    80.00000  120.40000
   46    48    51    58.35000  112.70000
   46    48    67    58.35000  112.70000
   46    48    53    58.35000  112.70000
   46    49    50    55.00000  108.50000
   48    46    47    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    57    58.35000  112.70000
   48    67    62    58.35000  112.70000
   48    67    81    58.35000  112.70000
   48    67    68    37.50000  110.70000
   48    53    54    37.50000  110.70000
   48    53    55    37.50000  110.70000
   48    53    56    37.50000  110.70000
   51    33    37    58.35000  112.70000
   51    57    58    37.50000  110.70000
   51    57    59    37.50000  110.70000
   51    57    60    58.35000  112.70000
   57    51    52    37.50000  110.70000
   57    60    61    37.50000  110.70000
   57    60    62    58.35000  112.70000
   57    60    63    50.00000  109.50000
   59    57    58    33.00000  107.80000
   60    57    58    37.50000  110.70000
   60    57    59    37.50000  110.70000
   60    62    64    58.35000  112.70000
   60    62    71    58.35000  112.70000
   60    62    67    58.35000  112.70000
   60    63    85    83.00000  116.90000
   62    60    61    37.50000  110.70000
   62    64    65    37.50000  110.70000
   62    64    66    37.50000  110.70000
   62    64    69    50.00000  109.50000
   62    71    70    58.35000  112.70000
   62    71    72    37.50000  110.70000
   62    71    79    58.35000  112.70000
   62    67    81    58.35000  112.70000
   62    67    68    37.50000  110.70000
   64    69    70    60.00000  109.50000
   66    64    65    33.00000  107.80000
   69    64    65    35.00000  109.50000
   69    64    66    35.00000  109.50000
   69    70    71    50.00000  109.50000
   69    70    73    50.00000  109.50000
   69    70    75    50.00000  109.50000
   70    71    72    37.50000  110.70000
   70    71    79    58.35000  112.70000
   70    73    74    37.50000  110.70000
   70    73    81    58.35000  112.70000
   70    73    83    50.00000  109.50000
   70    75    76    37.50000  110.70000
   70    75    77    37.50000  110.70000
   70    75    78    37.50000  110.70000
   71    62    64    58.35000  112.70000
   71    79    80    37.50000  110.70000
   71    79    85    63.00000  111.10000
   71    79    87    50.00000  109.50000
   79    71    72    37.50000  110.70000
   79    85    86    80.00000  120.40000
   79    85    63    81.00000  111.40000
   79    87    90    83.00000  116.90000
   85    79    80    35.00000  109.50000
   63    60    61    35.00000  109.50000
   63    60    62    50.00000  109.50000
   63    85    86    83.00000  123.40000
   87    79    80    35.00000  109.50000
   87    79    85    90.00000  108.74100
   87    90    91    83.00000  123.40000
   87    90    92    81.00000  111.40000
   90    92    93    35.00000  109.50000
   90    92    94    63.00000  111.10000
   90    92    97    90.00000  108.74100
   92    90    91    80.00000  120.40000
   92    94    95    37.50000  110.70000
   92    94    96    37.50000  110.70000
   92    94    98    58.35000  112.70000
   92    97   102    83.00000  116.90000
   94    92    93    37.50000  110.70000
   94    98    99    37.50000  110.70000
   94    98   100    37.50000  110.70000
   94    98   101    37.50000  110.70000
   96    94    95    33.00000  107.80000
   98    94    95    37.50000  110.70000
   98    94    96    37.50000  110.70000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
   97    92    93    35.00000  109.50000
   97    92    94    50.00000  109.50000
   97   102   103    83.00000  123.40000
   97   102   104    81.00000  111.40000
  102   104   105    35.00000  109.50000
  102   104   106    35.00000  109.50000
  102   104   107    35.00000  109.50000
  104   102   103    80.00000  120.40000
  106   104   105    33.00000  107.80000
  107   104   105    33.00000  107.80000
  107   104   106    33.00000  107.80000
   73    70    71    58.35000  112.70000
   73    81    82    37.50000  110.70000
   73    81    67    58.35000  112.70000
   73    81    88    50.00000  109.50000
   73    83    84    55.00000  108.50000
   81    73    74    37.50000  110.70000
   81    67    68    37.50000  110.70000
   81    88    89    55.00000  108.50000
   67    48    51    58.35000  112.70000
   67    62    64    58.35000  112.70000
   67    62    71    58.35000  112.70000
   67    81    82    37.50000  110.70000
   88    81    82    35.00000  109.50000
   88    81    67    50.00000  109.50000
   83    73    74    35.00000  109.50000
   83    73    81    50.00000  109.50000
   75    70    71    58.35000  112.70000
   75    70    73    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
   53    48    51    58.35000  112.70000
   53    48    67    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   49    46    47    35.00000  109.50000
   49    46    48    50.00000  109.50000
   40    33    37    58.35000  112.70000
   40    33    51    58.35000  112.70000
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    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
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   95    94    98   101   0.15000  1.0 3.0
   96    94    98    99   0.15000  1.0 3.0
   96    94    98   100   0.15000  1.0 3.0
   96    94    98   101   0.15000  1.0 3.0
   97    92    94    95   0.23400  1.0 3.0
   97    92    94    96   0.23400  1.0 3.0
   97    92    94    98   0.62750  1.0 1.0
   97    92    94    98  -0.30950 -1.0 2.0
   97    92    94    98   0.27300  1.0 3.0
   97   102   104   105   0.00000  1.0 1.0
   97   102   104   106   0.00000  1.0 1.0
   97   102   104   107   0.00000  1.0 1.0
  103   102   104   105   0.00000  1.0 1.0
  103   102   104   106   0.00000  1.0 1.0
  103   102   104   107   0.00000  1.0 1.0
   73    70    71    62   0.56750  1.0 1.0
   73    70    71    62  -0.07550 -1.0 2.0
   73    70    71    62   0.20000  1.0 3.0
   73    70    71    72   0.15000  1.0 3.0
   73    70    71    79   0.56750  1.0 1.0
   73    70    71    79  -0.07550 -1.0 2.0
   73    70    71    79   0.20000  1.0 3.0
   73    70    75    76   0.15000  1.0 3.0
   73    70    75    77   0.15000  1.0 3.0
   73    70    75    78   0.15000  1.0 3.0
   73    81    67    48   0.56750  1.0 1.0
   73    81    67    48  -0.07550 -1.0 2.0
   73    81    67    48   0.20000  1.0 3.0
   73    81   -67    62   0.56750  1.0 1.0
   73    81   -67    62  -0.07550 -1.0 2.0
   73    81   -67    62   0.20000  1.0 3.0
   73    81    67    68   0.15000  1.0 3.0
   73    81    88    89  -0.11600  1.0 1.0
   73    81    88    89  -0.09450 -1.0 2.0
   73    81    88    89   0.21250  1.0 3.0
   74    73    81    82   0.15000  1.0 3.0
   74    73    81    67   0.15000  1.0 3.0
   74    73    81    88   0.23400  1.0 3.0
   74    73    83    84   0.19450  1.0 3.0
   81    73    83    84  -0.11600  1.0 1.0
   81    73    83    84  -0.09450 -1.0 2.0
   81    73    83    84   0.21250  1.0 3.0
   82    81    67    48   0.15000  1.0 3.0
   82    81    67    62   0.15000  1.0 3.0
   82    81    67    68   0.15000  1.0 3.0
   82    81    88    89   0.19450  1.0 3.0
   67    48    51    33   0.56750  1.0 1.0
   67    48    51    33  -0.07550 -1.0 2.0
   67    48    51    33   0.20000  1.0 3.0
   67    48    51    52   0.15000  1.0 3.0
   67    48   -51    57   0.56750  1.0 1.0
   67    48   -51    57  -0.07550 -1.0 2.0
   67    48   -51    57   0.20000  1.0 3.0
   67    48    53    54   0.15000  1.0 3.0
   67    48    53    55   0.15000  1.0 3.0
   67    48    53    56   0.15000  1.0 3.0
   67    62    64    65   0.15000  1.0 3.0
   67    62    64    66   0.15000  1.0 3.0
   67    62    64    69   0.62750  1.0 1.0
   67    62    64    69  -0.30950 -1.0 2.0
   67    62    64    69   0.27300  1.0 3.0
   67    62   -71    70   0.56750  1.0 1.0
   67    62   -71    70  -0.07550 -1.0 2.0
   67    62   -71    70   0.20000  1.0 3.0
   67    62    71    72   0.15000  1.0 3.0
   67    62    71    79   0.56750  1.0 1.0
   67    62    71    79  -0.07550 -1.0 2.0
   67    62    71    79   0.20000  1.0 3.0
   67    81    88    89  -0.11600  1.0 1.0
   67    81    88    89  -0.09450 -1.0 2.0
   67    81    88    89   0.21250  1.0 3.0
   88    81    67    48   0.86500  1.0 1.0
   88    81    67    48  -0.17500 -1.0 2.0
   88    81    67    48   0.20800  1.0 3.0
   88    81    67    62   0.86500  1.0 1.0
   88    81    67    62  -0.17500 -1.0 2.0
   88    81    67    62   0.20800  1.0 3.0
   88    81    67    68   0.23400  1.0 3.0
   83    73    81    82   0.23400  1.0 3.0
   83    73    81    67   0.86500  1.0 1.0
   83    73    81    67  -0.17500 -1.0 2.0
   83    73    81    67   0.20800  1.0 3.0
   83    73    81    88   3.75450  1.0 1.0
   75    70    71    62   0.56750  1.0 1.0
   75    70    71    62  -0.07550 -1.0 2.0
   75    70    71    62   0.20000  1.0 3.0
   75    70    71    72   0.15000  1.0 3.0
   75    70    71    79   0.56750  1.0 1.0
   75    70    71    79  -0.07550 -1.0 2.0
   75    70    71    79   0.20000  1.0 3.0
   75    70    73    74   0.15000  1.0 3.0
   75    70    73    81   0.56750  1.0 1.0
   75    70    73    81  -0.07550 -1.0 2.0
   75    70    73    81   0.20000  1.0 3.0
   75    70    73    83   0.86500  1.0 1.0
   75    70    73    83  -0.17500 -1.0 2.0
   75    70    73    83   0.20800  1.0 3.0
   53    48    51    33   0.56750  1.0 1.0
   53    48    51    33  -0.07550 -1.0 2.0
   53    48    51    33   0.20000  1.0 3.0
   53    48    51    52   0.15000  1.0 3.0
   53    48    51    57   0.56750  1.0 1.0
   53    48    51    57  -0.07550 -1.0 2.0
   53    48    51    57   0.20000  1.0 3.0
   53    48    67    62   0.56750  1.0 1.0
   53    48    67    62  -0.07550 -1.0 2.0
   53    48    67    62   0.20000  1.0 3.0
   53    48    67    81   0.56750  1.0 1.0
   53    48    67    81  -0.07550 -1.0 2.0
   53    48    67    81   0.20000  1.0 3.0
   53    48    67    68   0.15000  1.0 3.0
   49    46    48    51   0.86500  1.0 1.0
   49    46    48    51  -0.17500 -1.0 2.0
   49    46    48    51   0.20800  1.0 3.0
   49    46    48    67   0.86500  1.0 1.0
   49    46    48    67  -0.17500 -1.0 2.0
   49    46    48    67   0.20800  1.0 3.0
   49    46    48    53   0.86500  1.0 1.0
   49    46    48    53  -0.17500 -1.0 2.0
   49    46    48    53   0.20800  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    44  -0.95700  1.0 1.0
   40    33    37    44  -0.18200 -1.0 2.0
   40    33    37    44   0.29450  1.0 3.0
   40    33    51    48   0.56750  1.0 1.0
   40    33    51    48  -0.07550 -1.0 2.0
   40    33    51    48   0.20000  1.0 3.0
   40    33    51    52   0.15000  1.0 3.0
   40    33    51    57   0.56750  1.0 1.0
   40    33    51    57  -0.07550 -1.0 2.0
   40    33    51    57   0.20000  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   37    46    44    45  10.50000 -1.0 2.0
   79    63    85    86  10.50000 -1.0 2.0
   87    92    90    91  10.50000 -1.0 2.0
   97   104   102   103  10.50000 -1.0 2.0
END
