* LIGAND DATABASE FILE (OPLS2005)
*
001     106   113    212    361     633
    1     0 S   NP   _N1_     1    31.80767   102.17489   -17.13485
    2     1 S   H    _HN1     2     1.02946    42.04703    46.01919
    3     1 S   H    _H1_     3     1.02834    96.67344   154.01538
    4     1 S   H    _H2_     4     1.02798    73.37469   -99.28427
    5     1 S   CT   _CA1     5     1.50110   147.47468     6.17076
    6     5 S   HC   _HA1     6     1.09562   105.17229  -155.18269
    7     5 S   CO3  _C1_     7     1.53797   112.84505    84.62110
    8     7 S   O2Z  _O11     8     1.26382   115.05344   -33.44190
    9     7 S   O2Z  _O12     9     1.26309   115.20026   146.06954
   10     5 S   CT   _CB1    10     1.53120   107.45114   -36.93640
   11    10 S   HC   HB11    11     1.09823   109.55477   -47.51628
   12    10 S   HC   HB12    12     1.09816   110.38008    69.25732
   13    10 S   CT   _CG1    13     1.52874   112.44809  -168.41314
   14    13 S   HC   HG11    14     1.09463   110.57543   -66.05648
   15    13 S   HC   HG12    15     1.09669   109.74525    53.09897
   16    13 S   C    _CD1    16     1.51665   112.49653   173.93848
   17    16 S   O    _OE1    17     1.22685   123.37591    10.64756
   18    16 S   N    _N2_    18     1.38647   111.43502  -169.92768
   19    18 S   H    _HN2    19     1.01561   118.96157     2.97914
   20    18 S   CT1  _CA2    20     1.45836   123.53385   177.69939
   21    20 S   HC   _HA2    21     1.09724   109.42134     2.27624
   22    20 S   C    _C2_    22     1.53675   108.26415  -112.97450
   23    22 S   O    _O2_    23     1.23054   122.34910  -147.99615
   24    20 S   CT   _CB2    32     1.53227   111.84129   124.58689
   25    24 S   HC   HB21    33     1.09467   111.29491    56.05853
   26    24 S   HC   HB22    34     1.09583   109.45320   173.23943
   27    22 S   N    _N3_    24     1.38346   113.70406    39.40647
   28    27 S   H    _HN3    25     1.01574   119.58305    -3.09124
   29    24 S   S    _SG2    35     1.83025   113.06878   -69.54762
   30    27 S   CT   _CA3    26     1.45279   123.26207   177.30717
   31    30 S   HC   HA31    27     1.09547   107.47722   -65.56692
   32    30 S   HC   HA32    28     1.09555   108.03731    50.89609
   33    29 S   CT   _C16    36     1.85536   101.40780    93.90727
   34    33 S   HC   _H3_    37     1.09210   103.11845   -61.58879
   35    30 S   CO3  _C3_    29     1.52969   114.04018   172.89999
   36    35 S   O2Z  _O31    30     1.26383   116.06757    -1.22876
   37    35 S   O2Z  _O32    31     1.26428   114.41356   178.83820
   38    33 S   CT   _C17    38     1.55104   109.78358  -176.93063
   39    38 S   HC   _H4_    39     1.10104   108.20197   -46.11414
   40    38 S   CT   _C18    40     1.55862   112.39987  -163.00997
   41    40 S   HC   _H5_    41     1.09940   104.81696    91.85588
   42    38 S   CO4  _C33   100     1.52589   109.01042    69.12379
   43    42 S   O    _O33   101     1.22424   124.71527    39.66134
   44    40 S   CT   _C32    42     1.54457   116.22882  -154.76730
   45    44 S   HC   _H32    43     1.09636   109.93030   -41.57983
   46    44 S   HC   _H33    44     1.10031   107.65543  -155.40745
   47    40 S   CT   _C19    72     1.55182   113.88791   -22.49725
   48    47 S   HC   _H6_    73     1.10101   104.09400   164.35808
   49    42 S   OS   _O34   102     1.36492   109.85511  -141.03729
   50    44 S   CT   _C31    45     1.52897   114.44411    84.01696
   51    50 S   HC   _H8_    46     1.09224   112.15496   -63.95612
   52    47 S   CT   _C5_    74     1.58968   113.24438    48.63897
   53    49 S   CT   _C34   103     1.43065   115.23314  -179.50862
   54    53 S   HC   _H34   104     1.09321   108.09627  -179.31187
   55    53 S   HC   _H35   105     1.09428   110.20949    62.06142
   56    53 S   HC   _H36   106     1.09420   110.33333   -60.56880
   57    50 S   C5A  _C30    47     1.49187   113.67620   173.54983
   58    52 S   C5A  _C6_    75     1.52378   109.28901   105.44858
   59    52 S   CT   _C4_    96     1.55552   112.98137  -137.36800
   60    59 S   HC   _H9_    97     1.09349   112.75540    59.04437
   61    59 S   HC   _H10    98     1.09637   111.88741   -62.10748
   62    59 S   HC   _H11    99     1.09828   111.08269   179.25612
   63    57 S   C5B  _C23    48     1.37995   125.15332  -137.77044
   64    57 S   NA   _N7_    59     1.36592   126.36753    45.76427
   65    64 S   H    _H31    60     1.01099   125.71934    -1.69165
   66    58 S   C5B  _C7_    76     1.37744   126.66092  -124.22581
   67    58 S   NA   _N4_    87     1.37136   125.73281    57.40996
   68    67 S   H    _H16    88     1.01058   125.35761    -0.49416
   69    63 S   C56B _C24    49     1.42199   107.51074  -178.41860
   70    63 S   CT   _C22    61     1.49162   121.93587     2.20425
   71    70 S   HC   _H25    62     1.09691   108.68388   103.40268
   72    70 S   HC   _H26    63     1.09557   110.47620  -138.94380
   73    66 S   C56B _C8_    77     1.42018   108.21885  -179.32594
   74    66 S   CT   _C14    89     1.47843   120.70235     0.24549
   75    74 S   HC   _H17    90     1.09563   110.80760   145.19834
   76    74 S   HC   _H18    91     1.09677   109.39605   -96.21035
   77    69 S   CA   _C25    50     1.40934   134.40020  -179.32565
   78    77 S   HA   _H27    51     1.08623   120.75642     0.12195
   79    70 S   CT   _C21    64     1.53986   111.45710   -17.24486
   80    79 S   HC   _H23    65     1.09439   110.49874   165.95553
   81    79 S   HC   _H24    66     1.09369   111.82782   -71.09574
   82    73 S   CA   _C9_    78     1.40916   134.53926  -179.88809
   83    82 S   HA   _H12    79     1.08617   120.75929     0.10468
   84    74 S   CT   _C15    92     1.53955   109.48763    24.27706
   85    84 S   HC   _H19    93     1.09441   108.64421    72.73771
   86    84 S   HC   _H20    94     1.09497   106.12528  -173.27576
   87    77 S   CA   _C26    52     1.39949   119.29361  -179.86012
   88    87 S   HA   _H28    53     1.08691   119.52713  -180.00000
   89    50 S   NP   _N6_    67     1.53146   107.87364    52.26028
   90    89 S   H    _H7_    68     1.02931   107.28936    56.72904
   91    82 S   CA   _C10    80     1.39950   119.26191  -179.92867
   92    91 S   HA   _H13    81     1.08688   119.52619  -179.95154
   93    33 S   NT   _N5_    95     1.47313   114.23509    55.32636
   94    87 S   CA   _C27    54     1.39316   120.76042     0.05595
   95    94 S   HA   _H29    55     1.08719   119.55439   179.95154
   96    89 S   CT   _C20    69     1.51314   112.15228   -60.39826
   97    96 S   HC   _H21    70     1.09282   107.78331   -59.14996
   98    96 S   HC   _H22    71     1.09364   105.82107  -176.66928
   99    91 S   CA   _C11    82     1.39324   120.75581     0.08847
  100    99 S   HA   _H14    83     1.08716   119.55504   179.94766
  101    94 S   CA   _C28    56     1.39777   121.04209    -0.02798
  102   101 S   HA   _H30    57     1.08498   120.88599   179.92598
  103    99 S   CA   _C12    84     1.39779   121.03878     0.03956
  104   103 S   HA   _H15    85     1.08490   120.90462   179.84677
  105    69 S   C56A _C29    58     1.39902   106.89868     0.84326
  106    73 S   C56A _C13    86     1.39745   106.72738     0.33220
  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
  18   7   2   1   1  17   8  20   9   9   2  14   6   5  18   8
   4  16   7  19   3   2   1   1  14  17   8   3   2   1  15   9
   3  15   9   3  12  10   5   4  12   8   5   4   7   4   7   4
   3   7   4   3   2   1   6   3   4   3   6   3   1   4   3   2
   1   1   4   3   2   1   2   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    93    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    52    84    93    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    47    52    58    74    84    85    86    93    59    42    43    49  
   38    39    40    52    84    93    42  
   36    37  
   37  
    0  
   39    40    41    44    45    46    50    96    47    48    52    84    93    42    43    49    53  
   40    41    44    47    93    42    43    49  
   41    44    45    46    50    51    57    89    96    97    98    47    48    52    58    93    59    42    43    49  
   44    45    46    50    96    47    48    52    42  
   43    49    53    54    55    56    44    47    93  
   49    53  
   45    46    50    51    57    63    64    79    89    90    96    47    48    52  
   46    50    51    57    89    47  
   50    51    57    89    47  
   48    52    58    66    67    84    93    59    60    61    62    50    79    89    90    96    97    98  
   52    58    93    59    89    96    97    98  
   53    54    55    56  
   51    57    63    69   105    64    65    70    79    80    81    89    90    96    97    98  
   57    63    64    79    89    90    96  
   58    66    73   106    67    68    74    84    85    86    93    59    60    61    62    89    96    97    98  
   54    55    56  
   55    56  
   56  
    0  
   63    69    77   101   105    64    65    70    71    72    79    89    90    96  
   66    73    82   103   106    67    68    74    75    76    84    93    59    60    61    62    96  
   60    61    62    66    67    84    93    96  
   61    62    93  
   62    93  
   93  
   69    77    78    87   101   105    64    65    70    71    72    79    80    81    89  
   65    70    89    69    77    94   101   102   105  
   69   101   105  
   73    82    83    91   103   106    67    68    74    75    76    84    85    86    93  
   68    74    93    73    82    99   103   104   106  
   73   103   106  
   77    78    87    88    94   101   102   105    70    71    72    79  
   71    72    79    80    81    89    90    96    77   105  
   72    79    80    81    89  
   79    80    81    89  
   82    83    91    92    99   103   104   106    74    75    76    84  
   75    76    84    85    86    93    82   106  
   76    84    85    86    93  
   84    85    86    93  
   78    87    88    94    95   101   105  
   87    88    94   105  
   80    81    89    90    96    97    98  
   81    89    90    96  
   89    90    96  
   83    91    92    99   100   103   106  
   91    92    99   106  
   85    86    93  
   86    93  
   93  
   88    94    95   101   102   105  
   94    95   101  
   90    96    97    98  
   96    97    98  
   92    99   100   103   104   106  
   99   100   103  
   96  
   95   101   102   105  
  101   102   105  
   97    98  
   98  
    0  
  100   103   104   106  
  103   104   106  
  102   105  
  105  
  104   106  
  106  
    0  
    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   0.317500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   42   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   49   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   50   3.5000   0.0660   0.325000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   52   3.5000   0.0660   0.325000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.5000   0.0660   0.160000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   56   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   57   3.5500   0.0700  -0.029300   2.5000   1.7750   0.001000000  -0.843144165
   58   3.5500   0.0700  -0.029300   2.5000   1.7750   0.001000000  -0.843144165
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0700  -0.174900   2.5000   1.7750   0.001000000  -0.843144165
   64   3.2500   0.1700  -0.478600   1.8650   1.6500   0.001000000  -0.511443539
   65   0.5000   0.0300   0.357700   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5500   0.0700  -0.174900   2.5000   1.7750   0.001000000  -0.843144165
   67   3.2500   0.1700  -0.478600   1.8650   1.6500   0.001000000  -0.511443539
   68   0.5000   0.0300   0.357700   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5500   0.0700   0.123300   2.5000   1.7750   0.001000000  -0.843144165
   70   3.5000   0.0660  -0.064100   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   73   3.5500   0.0700   0.123300   2.5000   1.7750   0.001000000  -0.843144165
   74   3.5000   0.0660  -0.064100   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5500   0.0700  -0.224300   2.0020   1.7750   0.001000000  -0.843144165
   78   2.4200   0.0300   0.169900   1.3810   1.2100   0.030040813   0.268726247
   79   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   82   3.5500   0.0700  -0.224300   2.0020   1.7750   0.001000000  -0.843144165
   83   2.4200   0.0300   0.169900   1.3810   1.2100   0.030040813   0.268726247
   84   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5500   0.0700  -0.222200   2.0020   1.7750   0.001000000  -0.843144165
   88   2.4200   0.0300   0.148900   1.3810   1.2100   0.030040813   0.268726247
   89   3.2500   0.1700  -0.100000   2.2900   2.0360   0.003973653   1.685851020
   90   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   91   3.5500   0.0700  -0.222200   2.0020   1.7750   0.001000000  -0.843144165
   92   2.4200   0.0300   0.148900   1.3810   1.2100   0.030040813   0.268726247
   93   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   94   3.5500   0.0700  -0.088800   2.0020   1.7750   0.001000000  -0.843144165
   95   2.4200   0.0300   0.135900   1.3810   1.2100   0.030040813   0.268726247
   96   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   99   3.5500   0.0700  -0.088800   2.0020   1.7750   0.001000000  -0.843144165
  100   2.4200   0.0300   0.135900   1.3810   1.2100   0.030040813   0.268726247
  101   3.5500   0.0700  -0.354100   2.5000   1.7750   0.001000000  -0.843144165
  102   2.4200   0.0300   0.179600   1.3810   1.2100   0.030040813   0.268726247
  103   3.5500   0.0700  -0.354100   2.5000   1.7750   0.001000000  -0.843144165
  104   2.4200   0.0300   0.179600   1.3810   1.2100   0.030040813   0.268726247
  105   3.5500   0.0700   0.286000   2.5000   1.7750   0.001000000  -0.843144165
  106   3.5500   0.0700   0.286000   2.5000   1.7750   0.001000000  -0.843144165
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    93   382.000  1.448
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    42   317.000  1.522
   40    41   340.000  1.090
   40    44   268.000  1.529
   40    47   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    50   268.000  1.529
   50    51   340.000  1.090
   50    57   295.000  1.489
   50    89   367.000  1.471
   57    63   520.000  1.370
   57    64   427.000  1.381
   63    69   380.000  1.440
   63    70   295.000  1.494
   69    77   469.000  1.404
   69   105   447.000  1.419
   77    78   367.000  1.080
   77    87   469.000  1.400
   87    88   367.000  1.080
   87    94   469.000  1.400
   94    95   367.000  1.080
   94   101   469.000  1.400
  101   102   367.000  1.080
  101   105   469.000  1.400
  105    64   428.000  1.380
   64    65   434.000  1.010
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    79   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    89   367.000  1.471
   89    90   434.000  1.010
   89    96   367.000  1.471
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    47   268.000  1.529
   47    48   340.000  1.090
   47    52   268.000  1.529
   52    58   295.000  1.489
   52    93   382.000  1.448
   52    59   268.000  1.529
   58    66   520.000  1.370
   58    67   427.000  1.381
   66    73   380.000  1.440
   66    74   295.000  1.494
   73    82   469.000  1.404
   73   106   447.000  1.419
   82    83   367.000  1.080
   82    91   469.000  1.400
   91    92   367.000  1.080
   91    99   469.000  1.400
   99   100   367.000  1.080
   99   103   469.000  1.400
  103   104   367.000  1.080
  103   106   469.000  1.400
  106    67   428.000  1.380
   67    68   434.000  1.010
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    84   268.000  1.529
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    93   382.000  1.448
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   42    43   570.000  1.229
   42    49   214.000  1.327
   49    53   320.000  1.410
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   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  111.63000
   29    33    93    85.00000  109.00000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    42    63.00000  111.10000
   33    93    52    51.80000  107.20000
   33    93    84    51.80000  107.20000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    44    58.35000  112.70000
   38    40    47    58.35000  112.70000
   38    42    43    80.00000  120.40000
   38    42    49    81.00000  111.40000
   40    38    39    37.50000  110.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    50    58.35000  112.70000
   40    47    96    58.35000  112.70000
   40    47    48    37.50000  110.70000
   40    47    52    58.35000  112.70000
   44    40    41    37.50000  110.70000
   44    50    51    37.50000  110.70000
   44    50    57    70.00000  113.44400
   44    50    89    80.00000  111.20000
   46    44    45    33.00000  107.80000
   50    44    45    37.50000  110.70000
   50    44    46    37.50000  110.70000
   50    57    63    55.00000  130.44200
   50    57    64    65.00000  122.56900
   50    89    79    75.00000  113.01200
   50    89    90    35.00000  109.50000
   50    89    96    75.00000  113.01200
   57    50    51    45.00000  110.47400
   57    63    69    80.00000  105.82900
   57    63    70    55.00000  127.77900
   57    64   105    90.00000  107.14200
   57    64    65    35.00000  120.00000
   63    69    77    50.00000  134.85500
   63    69   105    80.00000  107.43600
   63    70    71    45.00000  111.11700
   63    70    72    45.00000  111.11700
   63    70    79    70.00000  112.62400
   69    77    78    35.00000  120.00000
   69    77    87    63.00000  120.00000
   69   105   101    85.00000  122.70000
   69   105    64    70.00000  104.40000
   77    87    88    35.00000  120.00000
   77    87    94    63.00000  120.00000
   87    77    78    35.00000  120.00000
   87    94    95    35.00000  120.00000
   87    94   101    63.00000  120.00000
   94    87    88    35.00000  120.00000
   94   101   102    35.00000  120.00000
   94   101   105    85.00000  120.00000
  101    94    95    35.00000  120.00000
  101   105    64    70.00000  132.80000
  105    69    77    85.00000  116.20000
  105   101   102    35.00000  120.00000
  105    64    65    35.00000  123.10000
   64    57    63    70.00000  106.30000
   70    63    69    55.00000  128.73000
   70    79    80    37.50000  110.70000
   70    79    81    37.50000  110.70000
   70    79    89    80.00000  111.20000
   72    70    71    33.00000  107.80000
   79    70    71    37.50000  110.70000
   79    70    72    37.50000  110.70000
   79    89    90    35.00000  109.50000
   79    89    96    75.00000  113.01200
   81    79    80    33.00000  107.80000
   89    50    51    35.00000  109.50000
   89    50    57    75.00000  111.64000
   89    79    80    35.00000  109.50000
   89    79    81    35.00000  109.50000
   89    96    97    35.00000  109.50000
   89    96    98    35.00000  109.50000
   89    96    47    80.00000  111.20000
   96    89    90    35.00000  109.50000
   96    47    48    37.50000  110.70000
   96    47    52    58.35000  112.70000
   98    96    97    33.00000  107.80000
   47    40    41    37.50000  110.70000
   47    40    44    58.35000  112.70000
   47    96    97    37.50000  110.70000
   47    96    98    37.50000  110.70000
   47    52    58    70.00000  113.44400
   47    52    93    56.20000  109.47000
   47    52    59    58.35000  112.70000
   52    47    48    37.50000  110.70000
   52    58    66    55.00000  130.44200
   52    58    67    65.00000  122.56900
   52    93    84    51.80000  107.20000
   52    59    60    37.50000  110.70000
   52    59    61    37.50000  110.70000
   52    59    62    37.50000  110.70000
   58    66    73    80.00000  105.82900
   58    66    74    55.00000  127.77900
   58    67   106    90.00000  107.14200
   58    67    68    35.00000  120.00000
   66    73    82    50.00000  134.85500
   66    73   106    80.00000  107.43600
   66    74    75    45.00000  111.11700
   66    74    76    45.00000  111.11700
   66    74    84    70.00000  112.62400
   73    82    83    35.00000  120.00000
   73    82    91    63.00000  120.00000
   73   106   103    85.00000  122.70000
   73   106    67    70.00000  104.40000
   82    91    92    35.00000  120.00000
   82    91    99    63.00000  120.00000
   91    82    83    35.00000  120.00000
   91    99   100    35.00000  120.00000
   91    99   103    63.00000  120.00000
   99    91    92    35.00000  120.00000
   99   103   104    35.00000  120.00000
   99   103   106    85.00000  120.00000
  103    99   100    35.00000  120.00000
  103   106    67    70.00000  132.80000
  106    73    82    85.00000  116.20000
  106   103   104    35.00000  120.00000
  106    67    68    35.00000  123.10000
   67    58    66    70.00000  106.30000
   74    66    73    55.00000  128.73000
   74    84    85    37.50000  110.70000
   74    84    86    37.50000  110.70000
   74    84    93    56.20000  109.47000
   76    74    75    33.00000  107.80000
   84    74    75    37.50000  110.70000
   84    74    76    37.50000  110.70000
   86    84    85    33.00000  107.80000
   93    33    34    35.00000  109.50000
   93    33    38    56.20000  109.47000
   93    52    58    75.00000  112.58000
   93    84    85    35.00000  109.50000
   93    84    86    35.00000  109.50000
   59    52    58    70.00000  113.44400
   59    52    93    56.20000  109.47000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   42    38    39    35.00000  109.50000
   42    38    40    63.00000  111.10000
   42    49    53    83.00000  116.90000
   49    42    43    83.00000  123.40000
   49    53    54    35.00000  109.50000
   49    53    55    35.00000  109.50000
   49    53    56    35.00000  109.50000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    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
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   59    52    93    33   0.23450  1.0 1.0
   59    52    93    33   0.02050 -1.0 2.0
   59    52    93    33   0.25250  1.0 3.0
   59    52    93    84   0.23450  1.0 1.0
   59    52    93    84   0.02050 -1.0 2.0
   59    52    93    84   0.25250  1.0 3.0
   42    38    40    41  -0.11250  1.0 3.0
   42    38    40    44  -0.95700  1.0 1.0
   42    38    40    44  -0.18200 -1.0 2.0
   42    38    40    44   0.29450  1.0 3.0
   42    38    40    47  -0.95700  1.0 1.0
   42    38    40    47  -0.18200 -1.0 2.0
   42    38    40    47   0.29450  1.0 3.0
   42    49    53    54   0.08050  1.0 3.0
   42    49    53    55   0.08050  1.0 3.0
   42    49    53    56   0.08050  1.0 3.0
   43    42    49    53   3.00000 -1.0 2.0
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
   63    64    57    50   4.00000 -1.0 2.0
   69    70    63    57   4.00000 -1.0 2.0
   77   105    69    63   4.00000 -1.0 2.0
   87    78    77    69   1.10000 -1.0 2.0
   94    88    87    77   1.10000 -1.0 2.0
  101    95    94    87   1.10000 -1.0 2.0
  105   102   101    94   1.10000 -1.0 2.0
  101    64   105    69   4.00000 -1.0 2.0
   65    57    64   105   1.00000 -1.0 2.0
   66    67    58    52   4.00000 -1.0 2.0
   73    74    66    58   4.00000 -1.0 2.0
   82   106    73    66   4.00000 -1.0 2.0
   91    83    82    73   1.10000 -1.0 2.0
   99    92    91    82   1.10000 -1.0 2.0
  103   100    99    91   1.10000 -1.0 2.0
  106   104   103    99   1.10000 -1.0 2.0
  103    67   106    73   4.00000 -1.0 2.0
   68    58    67   106   1.00000 -1.0 2.0
   38    49    42    43  10.50000 -1.0 2.0
END
