* LIGAND DATABASE FILE (OPLS2005)
*
001     105   110    200    331     598
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02044    36.06099   133.75194
    3     1 S   H    _H1_     3     1.02095    80.02537   -83.82250
    4     1 S   H    _H2_     4     1.02079    98.67641    23.74058
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08519   110.61667    58.77943
   26    24 S   HC   HB22    34     1.08612   109.94660   179.13182
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C31    36     1.84957    97.31649  -158.11030
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CO4  _C19    37     1.53268   106.21242   -40.05525
   38    37 S   O    _O38    38     1.22767   123.66012    93.67474
   39    33 S   CT   _C30    94     1.56892   112.80452    78.62180
   40    39 S   HC   _H59    95     1.10199   108.69913  -164.52204
   41    37 S   CA   _C12    39     1.47012   117.89615   -83.44282
   42    39 S   CT   _C33    96     1.53345   116.65428   -43.64485
   43    42 S   HC   _H63    97     1.08583   109.47028    58.18147
   44    42 S   HC   _H64    98     1.08610   109.46276   -61.83217
   45    42 S   HC   _H65    99     1.08704   109.47543   178.21195
   46    41 S   CA   _C10    40     1.39773   119.43012   -23.26997
   47    46 S   CA   _C6_    41     1.41449   116.57313   178.69434
   48    47 S   HA   _H48    42     1.08909   121.20537  -179.42088
   49    46 S   CMA  _C16    85     1.51310   122.41660    -2.78263
   50    49 S   OM   _O33    86     1.26973   118.80126  -165.25418
   51    47 S   CA   _C4_    43     1.39853   121.87894     0.44146
   52    51 S   HA   _H46    44     1.08722   118.89124  -179.98022
   53    33 S   CM   _C20    87     1.53418   107.43430  -157.82074
   54    51 S   CA   _C8_    45     1.38787   120.03518     0.14935
   55    53 S   CT   _C23    88     1.53060   112.95877   -83.71704
   56    55 S   HC   _H50    89     1.09738   108.00933    70.79041
   57    55 S   HC   _H51    90     1.09532   112.69544  -171.80264
   58    54 S   CA   _C9_    46     1.44929   119.02393   180.00000
   59    41 S   CA   _C14    82     1.40427   118.72152   156.28069
   60    55 S   CT   _C27    91     1.52031   110.52647   -49.79117
   61    60 S   HC   _H56    92     1.09809   111.45839   -59.04685
   62    58 S   CA   _C5_    47     1.39271   118.78661   -90.00197
   63    62 S   HA   _H47    48     1.08796   120.93935     0.15577
   64    59 S   OH   _O43    83     1.36718   121.51021    -0.81517
   65    64 S   HO   _H70    84     0.96844   109.96463     1.88917
   66    60 S   OS   _O41    93     1.42423   108.13573    61.67660
   67    60 S   CT   _C34   100     1.52315   111.17493   179.48604
   68    67 S   HC   _H66   101     1.09444   108.63199    61.43599
   69    67 S   HC   _H67   102     1.09401   108.69845   -55.39848
   70    62 S   CA   _C7_    49     1.39514   120.12635   179.90721
   71    70 S   HA   _H49    50     1.08670   118.66326  -179.21541
   72    67 S   CO3  _C21   103     1.52832   115.15752  -177.04786
   73    72 S   O2Z  _O34   104     1.26546   113.78130   148.19059
   74    72 S   O2Z  _O39   105     1.26121   116.88845   -31.73637
   75    70 S   CA   _C11    51     1.39996   119.97287    -0.04846
   76    75 S   CA   _C13    52     1.39981   119.98788     0.63366
   77    58 S   CA   _C15    53     1.39505   121.09814    90.27924
   78    76 S   CO4  _C18    56     1.48315   120.99452   177.16690
   79    78 S   O    _O37    57     1.22789   119.90229   177.76664
   80    77 S   OH   _O44    54     1.36680   118.20949     0.31279
   81    80 S   HO   _H71    55     0.96856   109.99646   179.98022
   82    78 S   CT   _C26    58     1.52029   117.14185    -6.94755
   83    82 S   HC   _H55    59     1.10197   105.08393   -80.12725
   84    82 S   CT   _C25    60     1.52818   111.87941    36.57942
   85    84 S   HC   _H54    61     1.09763   110.77561    62.83263
   86    75 S   CO4  _C17    62     1.47996   119.21691  -178.06913
   87    86 S   O    _O36    63     1.22688   120.30278   -13.45676
   88    84 S   CT   _C24    64     1.53260   109.18941  -177.21091
   89    88 S   HC   _H52    65     1.09899   108.85461    67.58279
   90    88 S   HC   _H53    66     1.09703   110.34074  -175.61528
   91    88 S   CT   _C28    67     1.52936   111.12206   -53.17116
   92    91 S   HC   _H57    68     1.09516   110.20027   -67.21743
   93    91 S   OS   _O42    69     1.43110   111.08747    54.03229
   94    91 S   CT   _C35    76     1.52434   110.86228   173.44201
   95    94 S   HC   _H68    77     1.09428   108.60161    59.13742
   96    94 S   HC   _H69    78     1.09361   108.64546   -57.74498
   97    82 S   CT   _C29    70     1.53964   113.78389   163.36868
   98    97 S   HC   _H58    71     1.09782   108.23364    61.92531
   99    94 S   CO3  _C22    79     1.52786   115.11461  -179.30705
  100    99 S   O2Z  _O35    80     1.26534   113.80966   148.20311
  101    99 S   O2Z  _O40    81     1.26198   116.87786   -31.70997
  102    97 S   CT   _C32    72     1.53071   115.61619   -57.73437
  103   102 S   HC   _H60    73     1.08739   109.59651   -59.52508
  104   102 S   HC   _H61    74     1.08695   109.63607  -179.52112
  105   102 S   HC   _H62    75     1.08777   109.59748    60.45693
  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
  19   2   1   1  14   5  13   7  12   6   3   2   1  11   9   4
   8   2   7   3   7  10   9   5   4  12   4   8   5   8   4   1
   1   4   5   4   3   8   3   2   1   1  11  11   6  12   4   1
   1  16   8  13   7   6   1  10   5   4  11   6  10   6   4   3
   5   4   2   1   1   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    53    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    49    53    55    66    39    40    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    46    59    49    50    53    55    56    57    60    66    39    40    42    43    44    45  
   35    36  
   36  
    0  
   38    41    46    47    54    59    64    49    53    55    66    39    40    42  
   41    46    59    53    39  
   40    42    43    44    45    67    41    49    53    55    60    61    66  
   42    43    44    45    53    60    66  
   46    47    48    51    54    58    59    64    65    49    50    53  
   43    44    45    53    60    66  
   44    45    66  
   45    66  
   66  
   47    48    51    52    54    59    64    49    50    53    55  
   48    51    52    54    58    59    49    50    53  
   51    52    54    49  
   50    53    55    56    57    60    51    59  
   53    55  
   52    54    58    62    77    59    64  
   54    58    59  
   55    56    57    60    61    66    67  
   58    62    63    70    76    77    80    59    64    65  
   56    57    60    61    66    67    68    69    72  
   57    60    61    66    67  
   60    61    66    67  
   62    63    70    71    75    76    77    80    81    78    59    64  
   64    65    62    77  
   61    66    67    68    69    72    73    74  
   66    67    68    69    72  
   63    70    71    75    76    77    80    86  
   70    71    75    77  
   65  
    0  
   67    68    69    72  
   68    69    72    73    74  
   69    72    73    74  
   72    73    74  
   71    75    76    77    78    84    86    87  
   75    76    86  
   73    74  
   74  
    0  
   76    77    80    78    79    82    84    85    86    87    88  
   77    80    81    78    79    82    83    84    86    87    97  
   80    81    78    79    82    86  
   79    82    83    84    85    86    88    93    97    98   102    80  
   82    83    84    97  
   81  
    0  
   83    84    85    86    87    88    89    90    91    93    97    98   102   103   104   105  
   84    85    86    88    93    97    98   102  
   85    86    87    88    89    90    91    92    93    97    98   102    94  
   86    87    88    89    90    91    97  
   87    88    89    90    91    97  
   88  
   89    90    91    92    93    97    94    95    96    99  
   90    91    92    93    94  
   91    92    93    94  
   92    93    97    98   102    94    95    96    99   100   101  
   93    97    94    95    96    99  
   97    98   102   103   104   105    94    95    96    99  
   95    96    99   100   101    97  
   96    99   100   101  
   99   100   101  
   98   102   103   104   105  
  102   103   104   105  
  100   101  
  101  
    0  
  103   104   105  
  104   105  
  105  
    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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   50   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5000   0.0660  -0.120000   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   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   60   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   66   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   67   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   70   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   72   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   73   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   75   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   76   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   77   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   78   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   79   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   80   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   81   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   82   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   84   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   86   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   87   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   88   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   93   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   94   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   99   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
  100   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  102   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   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   317.000  1.522
   33    53   317.000  1.510
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    41   310.000  1.470
   41    46   469.000  1.400
   41    59   469.000  1.400
   46    47   469.000  1.400
   46    49   320.000  1.460
   47    48   367.000  1.080
   47    51   469.000  1.400
   51    52   367.000  1.080
   51    54   469.000  1.400
   54    58   375.000  1.464
   54    59   469.000  1.400
   58    62   469.000  1.400
   58    77   469.000  1.400
   62    63   367.000  1.080
   62    70   469.000  1.400
   70    71   367.000  1.080
   70    75   469.000  1.400
   75    76   469.000  1.400
   75    86   310.000  1.470
   76    77   469.000  1.400
   76    78   310.000  1.470
   77    80   450.000  1.364
   80    81   553.000  0.945
   78    79   570.000  1.229
   78    82   317.000  1.522
   82    83   340.000  1.090
   82    84   268.000  1.529
   82    97   268.000  1.529
   84    85   340.000  1.090
   84    86   317.000  1.522
   84    88   268.000  1.529
   86    87   570.000  1.229
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   268.000  1.529
   91    92   340.000  1.090
   91    93   320.000  1.410
   91    94   268.000  1.529
   93    97   320.000  1.410
   97    98   340.000  1.090
   97   102   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   340.000  1.090
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    99   317.000  1.522
   99   100   656.000  1.250
   99   101   656.000  1.250
   59    64   450.000  1.364
   64    65   553.000  0.945
   49    50   745.000  1.250
   49    53   465.000  1.376
   53    55   317.000  1.510
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    60   268.000  1.529
   60    61   340.000  1.090
   60    66   320.000  1.410
   60    67   268.000  1.529
   66    39   320.000  1.410
   39    40   340.000  1.090
   39    42   268.000  1.529
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    72   317.000  1.522
   72    73   656.000  1.250
   72    74   656.000  1.250
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  110.18000
   29    33    53    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    41    65.00000  115.47100
   33    53    49    70.00000  124.00000
   33    53    55    65.00000  117.92700
   33    39    66    50.00000  109.50000
   33    39    40    37.50000  110.70000
   33    39    42    58.35000  112.70000
   37    41    46    60.00000  119.52600
   37    41    59    60.00000  119.52600
   41    37    38    75.00000  123.78400
   41    46    47    63.00000  120.00000
   41    46    49    60.00000  120.93500
   41    59    54    63.00000  120.00000
   41    59    64    70.00000  120.00000
   46    47    48    35.00000  120.00000
   46    47    51    63.00000  120.00000
   46    49    50    85.00000  114.86500
   46    49    53    60.00000  123.20500
   47    51    52    35.00000  120.00000
   47    51    54    63.00000  120.00000
   51    47    48    35.00000  120.00000
   51    54    58    60.00000  122.76000
   51    54    59    63.00000  120.00000
   54    51    52    35.00000  120.00000
   54    58    62    60.00000  122.76000
   54    58    77    60.00000  122.76000
   54    59    64    70.00000  120.00000
   58    62    63    35.00000  120.00000
   58    62    70    63.00000  120.00000
   58    77    76    63.00000  120.00000
   58    77    80    70.00000  120.00000
   62    70    71    35.00000  120.00000
   62    70    75    63.00000  120.00000
   70    62    63    35.00000  120.00000
   70    75    76    63.00000  120.00000
   70    75    86    60.00000  119.52600
   75    70    71    35.00000  120.00000
   75    76    77    63.00000  120.00000
   75    76    78    60.00000  119.52600
   75    86    84    65.00000  115.47100
   75    86    87    75.00000  123.78400
   76    77    80    70.00000  120.00000
   76    78    79    75.00000  123.78400
   76    78    82    65.00000  115.47100
   77    58    62    63.00000  120.00000
   77    80    81    35.00000  113.00000
   78    76    77    60.00000  119.52600
   78    82    83    35.00000  109.50000
   78    82    84    63.00000  111.10000
   78    82    97    63.00000  111.10000
   82    78    79    80.00000  120.40000
   82    84    85    37.50000  110.70000
   82    84    86    63.00000  111.10000
   82    84    88    58.35000  112.70000
   82    97    93    50.00000  109.50000
   82    97    98    37.50000  110.70000
   82    97   102    58.35000  112.70000
   84    82    83    37.50000  110.70000
   84    86    87    80.00000  120.40000
   84    88    89    37.50000  110.70000
   84    88    90    37.50000  110.70000
   84    88    91    58.35000  112.70000
   86    75    76    60.00000  119.52600
   86    84    85    35.00000  109.50000
   88    84    85    37.50000  110.70000
   88    84    86    63.00000  111.10000
   88    91    92    37.50000  110.70000
   88    91    93    50.00000  109.50000
   88    91    94    58.35000  112.70000
   90    88    89    33.00000  107.80000
   91    88    89    37.50000  110.70000
   91    88    90    37.50000  110.70000
   91    93    97    60.00000  109.50000
   91    94    95    37.50000  110.70000
   91    94    96    37.50000  110.70000
   91    94    99    70.00000  109.69300
   93    91    92    35.00000  109.50000
   93    97    98    35.00000  109.50000
   93    97   102    50.00000  109.50000
   97    82    83    37.50000  110.70000
   97    82    84    58.35000  112.70000
   97   102   103    37.50000  110.70000
   97   102   104    37.50000  110.70000
   97   102   105    37.50000  110.70000
  102    97    98    37.50000  110.70000
  104   102   103    33.00000  107.80000
  105   102   103    33.00000  107.80000
  105   102   104    33.00000  107.80000
   94    91    92    37.50000  110.70000
   94    91    93    50.00000  109.50000
   94    99   100    70.00000  117.00000
   94    99   101    70.00000  117.00000
   96    94    95    33.00000  107.80000
   99    94    95    35.00000  109.50000
   99    94    96    35.00000  109.50000
  101    99   100    80.00000  126.00000
   59    41    46    63.00000  120.00000
   59    54    58    60.00000  122.76000
   59    64    65    35.00000  113.00000
   49    46    47    60.00000  120.93500
   49    53    55    70.00000  124.00000
   53    33    37    70.00000  109.06800
   53    49    50    65.00000  137.10300
   53    55    56    35.00000  109.50000
   53    55    57    35.00000  109.50000
   53    55    60    70.00000  112.02700
   55    60    61    37.50000  110.70000
   55    60    66    50.00000  109.50000
   55    60    67    58.35000  112.70000
   57    55    56    33.00000  107.80000
   60    55    56    37.50000  110.70000
   60    55    57    37.50000  110.70000
   60    66    39    60.00000  109.50000
   60    67    68    37.50000  110.70000
   60    67    69    37.50000  110.70000
   60    67    72    70.00000  109.69300
   66    60    61    35.00000  109.50000
   66    39    40    35.00000  109.50000
   66    39    42    50.00000  109.50000
   39    33    37    63.00000  111.10000
   39    33    53    70.00000  112.02700
   39    42    43    37.50000  110.70000
   39    42    44    37.50000  110.70000
   39    42    45    37.50000  110.70000
   42    39    40    37.50000  110.70000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
   67    60    61    37.50000  110.70000
   67    60    66    50.00000  109.50000
   67    72    73    70.00000  117.00000
   67    72    74    70.00000  117.00000
   69    67    68    33.00000  107.80000
   72    67    68    35.00000  109.50000
   72    67    69    35.00000  109.50000
   74    72    73    80.00000  126.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
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   59    54    58    62  -0.19450  1.0 1.0
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   59    54    58    77  -0.19450  1.0 1.0
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   49    53    55    56   0.00000  1.0 1.0
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   53    33    37    38   0.30150 -1.0 2.0
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   53    33    39    40   0.15000  1.0 3.0
   53    33    39    42   0.34400  1.0 1.0
   53    33    39    42   0.09450 -1.0 2.0
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   53    55    60    61   0.15000  1.0 3.0
   53    55   -60    66   0.61850  1.0 1.0
   53    55   -60    66  -0.22750 -1.0 2.0
   53    55   -60    66   0.15300  1.0 3.0
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   55    60    66    39   0.06250  1.0 1.0
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   55    60    67    69   0.15000  1.0 3.0
   55    60    67    72  -1.63150  1.0 1.0
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   55    60    67    72   0.24500  1.0 3.0
   56    55    60    61   0.15000  1.0 3.0
   56    55    60    66   0.23400  1.0 3.0
   56    55    60    67   0.15000  1.0 3.0
   57    55    60    61   0.15000  1.0 3.0
   57    55    60    66   0.23400  1.0 3.0
   57    55    60    67   0.15000  1.0 3.0
   60    66   -39    33   0.06250  1.0 1.0
   60    66   -39    33  -0.01100 -1.0 2.0
   60    66   -39    33   0.28050  1.0 3.0
   60    66    39    40   0.37050  1.0 3.0
   60    66    39    42   0.06250  1.0 1.0
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   60    67    72    73   0.41150 -1.0 2.0
   60    67    72    74   0.41150 -1.0 2.0
   61    60    66    39   0.37050  1.0 3.0
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   61    60    67    69   0.15000  1.0 3.0
   61    60    67    72  -0.11250  1.0 3.0
   66    60    67    68   0.23400  1.0 3.0
   66    60    67    69   0.23400  1.0 3.0
   66    60    67    72  -3.35100  1.0 1.0
   66    60    67    72  -0.37050 -1.0 2.0
   66    60    67    72   0.22400  1.0 3.0
   66    39    42    43   0.23400  1.0 3.0
   66    39    42    44   0.23400  1.0 3.0
   66    39    42    45   0.23400  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    41   0.05850 -1.0 2.0
   39    33    37    41   0.17250  1.0 3.0
   39    33    53    49   0.09850  1.0 1.0
   39    33    53    49   0.15250 -1.0 2.0
   39    33    53    49  -0.50650  1.0 3.0
   39    33   -53    55   0.46850  1.0 1.0
   39    33   -53    55   0.08550 -1.0 2.0
   39    33   -53    55   0.09800  1.0 3.0
   40    39    42    43   0.15000  1.0 3.0
   40    39    42    44   0.15000  1.0 3.0
   40    39    42    45   0.15000  1.0 3.0
   67    60    66    39   0.06250  1.0 1.0
   67    60    66    39  -0.01100 -1.0 2.0
   67    60    66    39   0.28050  1.0 3.0
   68    67    72    73   0.00000  1.0 1.0
   68    67    72    74   0.00000  1.0 1.0
   69    67    72    73   0.00000  1.0 1.0
   69    67    72    74   0.00000  1.0 1.0
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
   33    41    37    38  10.50000 -1.0 2.0
   46    59    41    37   4.00000 -1.0 2.0
   47    49    46    41   4.00000 -1.0 2.0
   51    48    47    46   1.10000 -1.0 2.0
   54    52    51    47   1.10000 -1.0 2.0
   58    59    54    51   4.00000 -1.0 2.0
   62    77    58    54   4.00000 -1.0 2.0
   70    63    62    58   1.10000 -1.0 2.0
   75    71    70    62   1.10000 -1.0 2.0
   76    86    75    70   4.00000 -1.0 2.0
   77    78    76    75   4.00000 -1.0 2.0
   76    80    77    58   4.00000 -1.0 2.0
   76    82    78    79  10.50000 -1.0 2.0
   75    84    86    87  10.50000 -1.0 2.0
  100    94    99   101  10.50000 -1.0 2.0
   54    64    59    41   4.00000 -1.0 2.0
   46    50    49    53   1.10000 -1.0 2.0
   33    55    53    49   1.10000 -1.0 2.0
   73    67    72    74  10.50000 -1.0 2.0
END
