* LIGAND DATABASE FILE (OPLS2005)
*
001      80    83    149    250     449
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02105    59.78959  -110.57422
    3     1 S   H    _H1_     3     1.02110   106.50424    -8.21705
    4     1 S   H    _H2_     4     1.02039    52.38206    93.02346
    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   110.56213    58.83396
   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   _C25    36     1.84829    97.57100  -178.12622
   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  _C17    37     1.52187   106.09885    59.96830
   38    37 S   O    _O24    38     1.23036   122.15873    52.86588
   39    33 S   CM   _C18    51     1.51138   108.52467   -63.07733
   40    33 S   CT   _C24    54     1.53639   109.21816   175.88039
   41    40 S   HC   _H45    55     1.09782   107.85416    65.16312
   42    37 S   CA   _C13    39     1.47555   118.49205  -129.32565
   43    39 S   OH   _O25    52     1.40051   114.36374   -55.97315
   44    43 S   HO   _H46    53     0.95677   108.87726  -179.26885
   45    40 S   CT   _C21    56     1.53409   110.61153  -176.51316
   46    45 S   HC   _H40    57     1.09742   109.95798    56.77629
   47    45 S   HC   _H41    58     1.09671   109.90941   -60.51883
   48    42 S   CA   _C7_    40     1.40719   117.87807  -173.19352
   49    48 S   HA   _H31    41     1.08800   121.16075    -0.96611
   50    45 S   CT   _C19    59     1.52793   111.70127   178.13954
   51    50 S   HC   _H36    60     1.09827   109.23696    66.62544
   52    50 S   HC   _H37    61     1.09709   109.35698  -177.23303
   53    48 S   CA   _C5_    42     1.38994   120.52279   179.49603
   54    53 S   HA   _H29    43     1.08546   120.22194   179.75371
   55    50 S   CT   _C23    62     1.53831   111.46471   -55.29217
   56    55 S   HC   _H44    63     1.09712   109.01397   -65.29015
   57    53 S   CA   _C4_    44     1.38690   119.49285     0.01978
   58    57 S   HA   _H28    45     1.08546   120.13125  -179.77794
   59    55 S   CA   _C14    64     1.49475   110.12638   177.03535
   60    55 S   CT   _C20    75     1.53724   110.91596    54.86065
   61    60 S   HC   _H38    76     1.09745   110.09756  -176.45558
   62    60 S   HC   _H39    77     1.09818   110.14421    66.49093
   63    57 S   CA   _C6_    46     1.39782   119.94883     0.13848
   64    63 S   HA   _H30    47     1.08870   116.76528   179.91153
   65    59 S   CA   _C8_    65     1.39401   120.06202   -90.08582
   66    65 S   HA   _H32    66     1.08753   120.42032     0.12511
   67    40 S   CT   _C22    78     1.53373   110.62715   -53.20517
   68    67 S   HC   _H42    79     1.09615   109.97788    60.53948
   69    67 S   HC   _H43    80     1.09786   109.95390   -56.82360
   70    42 S   CA   _C12    48     1.40238   120.73866     6.57179
   71    65 S   CA   _C10    67     1.39455   120.04496  -179.90721
   72    71 S   HA   _H34    68     1.08764   119.19154   179.95577
   73    70 S   CMA  _C16    49     1.51273   123.23170     1.08858
   74    73 S   OM   _O23    50     1.26995   119.88969   175.54596
   75    71 S   CA   _C15    69     1.39468   120.00305     0.01978
   76    75 S   Cl   CL27    70     1.72072   119.98988  -179.97202
   77    75 S   CA   _C11    71     1.39520   119.97162    -0.04423
   78    77 S   HA   _H35    72     1.08761   120.76016  -179.98022
   79    59 S   CA   _C9_    73     1.39569   119.95306    89.99670
   80    79 S   HA   _H33    74     1.08603   120.46734    -0.03956
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  11   5   4   3
  20   2   1   1  14   5  11  17   8  10   4   1  12   6   5   8
   4  11   5   4   6   3  14   7   5   3  13   7   4   3   4   2
   8   4   2   1   1   2   6   3   1   1   5   3   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    73    39    43    40    41    45    67  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    48    70    73    74    39    43    44    40    41    45    46    47    50    60    67    68    69  
   35    36  
   36  
    0  
   38    42    48    49    53    63    70    73    39    43    40    41    45    67  
   42    48    70    39    40  
   43    44    40    41    45    67    42    63    70    73    74  
   41    45    46    47    50    51    52    55    60    61    62    67    68    69    42    43    73  
   45    46    47    50    60    67    68    69  
   48    49    53    54    57    63    64    70    73    74  
   44    70    73    74  
   73  
   46    47    50    51    52    55    56    59    60    67    68    69  
   47    50    51    52    55    67  
   50    51    52    55    67  
   49    53    54    57    58    63    70    73  
   53    54    57    70  
   51    52    55    56    59    65    79    60    61    62    67  
   52    55    56    59    60  
   55    56    59    60  
   54    57    58    63    64    70  
   57    58    63  
   56    59    65    66    71    77    79    80    60    61    62    67    68    69  
   59    65    79    60    61    62    67  
   58    63    64    70    73  
   63    64    70  
   65    66    71    72    75    77    78    79    80    60    61    62    67  
   61    62    67    68    69    65    79  
   62    67    68    69  
   67    68    69  
   64    70    73    74  
   70    73  
   66    71    72    75    76    77    79    80  
   71    72    75    79  
   68    69  
   69  
    0  
   73    74  
   72    75    76    77    78    79  
   75    76    77  
   74  
    0  
   76    77    78    79    80  
   77    78    79  
   78    79    80  
   79    80  
   80  
    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   3.5500   0.0760  -0.552400   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   43   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   71   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   72   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   73   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   74   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   75   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   76   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   77   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   78   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   79   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   80   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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    39   317.000  1.510
   33    40   268.000  1.529
   37    38   570.000  1.229
   37    42   310.000  1.470
   42    48   469.000  1.400
   42    70   469.000  1.400
   48    49   367.000  1.080
   48    53   469.000  1.400
   53    54   367.000  1.080
   53    57   469.000  1.400
   57    58   367.000  1.080
   57    63   469.000  1.400
   63    64   367.000  1.080
   63    70   469.000  1.400
   70    73   320.000  1.460
   73    74   745.000  1.250
   73    39   465.000  1.376
   39    43   510.000  1.338
   43    44   553.000  0.945
   40    41   340.000  1.090
   40    45   268.000  1.529
   40    67   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    55   268.000  1.529
   55    56   340.000  1.090
   55    59   317.000  1.510
   55    60   268.000  1.529
   59    65   469.000  1.400
   59    79   469.000  1.400
   65    66   367.000  1.080
   65    71   469.000  1.400
   71    72   367.000  1.080
   71    75   469.000  1.400
   75    76   300.000  1.725
   75    77   469.000  1.400
   77    78   367.000  1.080
   77    79   469.000  1.400
   79    80   367.000  1.080
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    67   268.000  1.529
   67    68   340.000  1.090
   67    69   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  110.18000
   29    33    39    75.00000  112.20000
   29    33    40    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    42    65.00000  115.47100
   33    39    73    70.00000  124.00000
   33    39    43    90.00000  109.34000
   33    40    41    37.50000  110.70000
   33    40    45    58.35000  112.70000
   33    40    67    58.35000  112.70000
   37    42    48    60.00000  119.52600
   37    42    70    60.00000  119.52600
   42    37    38    75.00000  123.78400
   42    48    49    35.00000  120.00000
   42    48    53    63.00000  120.00000
   42    70    63    63.00000  120.00000
   42    70    73    60.00000  120.93500
   48    53    54    35.00000  120.00000
   48    53    57    63.00000  120.00000
   53    48    49    35.00000  120.00000
   53    57    58    35.00000  120.00000
   53    57    63    63.00000  120.00000
   57    53    54    35.00000  120.00000
   57    63    64    35.00000  120.00000
   57    63    70    63.00000  120.00000
   63    57    58    35.00000  120.00000
   63    70    73    60.00000  120.93500
   70    42    48    63.00000  120.00000
   70    63    64    35.00000  120.00000
   70    73    74    85.00000  114.86500
   70    73    39    60.00000  123.20500
   73    39    43    80.00000  121.38400
   39    33    37    70.00000  109.06800
   39    73    74    65.00000  137.10300
   39    43    44    70.00000  107.45700
   40    33    37    63.00000  111.10000
   40    33    39    70.00000  112.02700
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    50    58.35000  112.70000
   40    67    60    58.35000  112.70000
   40    67    68    37.50000  110.70000
   40    67    69    37.50000  110.70000
   45    40    41    37.50000  110.70000
   45    50    51    37.50000  110.70000
   45    50    52    37.50000  110.70000
   45    50    55    58.35000  112.70000
   47    45    46    33.00000  107.80000
   50    45    46    37.50000  110.70000
   50    45    47    37.50000  110.70000
   50    55    56    37.50000  110.70000
   50    55    59    70.00000  112.17500
   50    55    60    58.35000  112.70000
   52    50    51    33.00000  107.80000
   55    50    51    37.50000  110.70000
   55    50    52    37.50000  110.70000
   55    59    65    70.00000  120.00000
   55    59    79    70.00000  120.00000
   55    60    61    37.50000  110.70000
   55    60    62    37.50000  110.70000
   55    60    67    58.35000  112.70000
   59    55    56    35.00000  109.50000
   59    65    66    35.00000  120.00000
   59    65    71    63.00000  120.00000
   59    79    77    63.00000  120.00000
   59    79    80    35.00000  120.00000
   65    71    72    35.00000  120.00000
   65    71    75    63.00000  120.00000
   71    65    66    35.00000  120.00000
   71    75    76    75.00000  120.00000
   71    75    77    63.00000  120.00000
   75    71    72    35.00000  120.00000
   75    77    78    35.00000  120.00000
   75    77    79    63.00000  120.00000
   77    75    76    75.00000  120.00000
   77    79    80    35.00000  120.00000
   79    59    65    63.00000  120.00000
   79    77    78    35.00000  120.00000
   60    55    56    37.50000  110.70000
   60    55    59    70.00000  112.17500
   60    67    68    37.50000  110.70000
   60    67    69    37.50000  110.70000
   62    60    61    33.00000  107.80000
   67    40    41    37.50000  110.70000
   67    40    45    58.35000  112.70000
   67    60    61    37.50000  110.70000
   67    60    62    37.50000  110.70000
   69    67    68    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.30150 -1.0 2.0
   29    33    37    42   0.65300  1.0 1.0
   29    33    37    42  -0.03850 -1.0 2.0
   29    33    37    42   0.33900  1.0 3.0
   29    33    39    73   0.42700  1.0 1.0
   29    33    39    73  -0.70350 -1.0 2.0
   29    33    39    73  -0.43150  1.0 3.0
   29    33    39    43   0.09700  1.0 1.0
   29    33    39    43   0.15600 -1.0 2.0
   29    33    39    43  -0.50800  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    45   0.44750  1.0 1.0
   29    33    40    45  -0.17800 -1.0 2.0
   29    33    40    45   0.20200  1.0 3.0
   29    33    40    67   0.44750  1.0 1.0
   29    33    40    67  -0.17800 -1.0 2.0
   29    33    40    67   0.20200  1.0 3.0
   33    37    42    48   2.26350  1.0 1.0
   33    37    42    48   0.76750 -1.0 2.0
   33    37    42    48   0.22500  1.0 3.0
   33    37    42    70   2.26350  1.0 1.0
   33    37    42    70   0.76750 -1.0 2.0
   33    37    42    70   0.22500  1.0 3.0
   33    39    43    44   2.00000 -1.0 2.0
   33    40    45    46   0.15000  1.0 3.0
   33    40    45    47   0.15000  1.0 3.0
   33    40    45    50   0.56750  1.0 1.0
   33    40    45    50  -0.07550 -1.0 2.0
   33    40    45    50   0.20000  1.0 3.0
   33    40    67    60   0.56750  1.0 1.0
   33    40    67    60  -0.07550 -1.0 2.0
   33    40    67    60   0.20000  1.0 3.0
   33    40    67    68   0.15000  1.0 3.0
   33    40    67    69   0.15000  1.0 3.0
   37    33    39    73  -0.51250  1.0 1.0
   37    33    39    73  -0.88800 -1.0 2.0
   37    33    39    73   0.08850  1.0 3.0
   37    33    39    43   0.09700  1.0 1.0
   37    33    39    43   0.15600 -1.0 2.0
   37    33    39    43  -0.50800  1.0 3.0
   37    33    40    41  -0.11250  1.0 3.0
   37    33    40    45  -0.95700  1.0 1.0
   37    33    40    45  -0.18200 -1.0 2.0
   37    33    40    45   0.29450  1.0 3.0
   37    33    40    67  -0.95700  1.0 1.0
   37    33    40    67  -0.18200 -1.0 2.0
   37    33    40    67   0.29450  1.0 3.0
   37    42    48    49   3.62500 -1.0 2.0
   37    42    48    53   3.62500 -1.0 2.0
   37    42    70    63   3.62500 -1.0 2.0
   37    42   -70    73   3.62500 -1.0 2.0
   38    37    42    48   1.05000 -1.0 2.0
   38    37    42    70   1.05000 -1.0 2.0
   42    48    53    54   3.62500 -1.0 2.0
   42    48    53    57   3.62500 -1.0 2.0
   42    70    73    74  -0.01750  1.0 1.0
   42    70    73    74  -0.32000 -1.0 2.0
   42    70    73    74   0.00600  1.0 3.0
   42    70    73    39   0.15800  1.0 1.0
   42    70    73    39   1.85350 -1.0 2.0
   42    70    73    39  -0.48700  1.0 3.0
   48    42    70    63   3.62500 -1.0 2.0
   48    42    70    73   3.62500 -1.0 2.0
   48    53    57    58   3.62500 -1.0 2.0
   48    53   -57    63   3.62500 -1.0 2.0
   49    48    53    54   3.62500 -1.0 2.0
   49    48    53    57   3.62500 -1.0 2.0
   53    57    63    64   3.62500 -1.0 2.0
   53    57    63    70   3.62500 -1.0 2.0
   54    53    57    58   3.62500 -1.0 2.0
   54    53    57    63   3.62500 -1.0 2.0
   57    63   -70    42   3.62500 -1.0 2.0
   57    63    70    73   3.62500 -1.0 2.0
   58    57    63    64   3.62500 -1.0 2.0
   58    57    63    70   3.62500 -1.0 2.0
   63    70    73    74  -0.01750  1.0 1.0
   63    70    73    74  -0.32000 -1.0 2.0
   63    70    73    74   0.00600  1.0 3.0
   63    70    73    39   0.15800  1.0 1.0
   63    70    73    39   1.85350 -1.0 2.0
   63    70    73    39  -0.48700  1.0 3.0
   64    63    70    42   3.62500 -1.0 2.0
   64    63    70    73   3.62500 -1.0 2.0
   70    42    48    49   3.62500 -1.0 2.0
   70    42   -48    53   3.62500 -1.0 2.0
   70    73   -39    33   7.00000 -1.0 2.0
   70    73    39    43   7.00000 -1.0 2.0
   73    39    43    44  -0.66100  1.0 1.0
   73    39    43    44   1.20850 -1.0 2.0
   73    39    43    44  -0.36000  1.0 3.0
   74    73    39    33   7.00000 -1.0 2.0
   74    73    39    43   7.00000 -1.0 2.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33   -37    42   0.65300  1.0 1.0
   39    33   -37    42  -0.03850 -1.0 2.0
   39    33   -37    42   0.33900  1.0 3.0
   39    33    40    41   0.15000  1.0 3.0
   39    33    40    45   0.34400  1.0 1.0
   39    33    40    45   0.09450 -1.0 2.0
   39    33    40    45   0.11100  1.0 3.0
   39    33    40    67   0.34400  1.0 1.0
   39    33    40    67   0.09450 -1.0 2.0
   39    33    40    67   0.11100  1.0 3.0
   40    33    37    38   0.30150 -1.0 2.0
   40    33    37    42   0.05850 -1.0 2.0
   40    33    37    42   0.17250  1.0 3.0
   40    33    39    73   0.09850  1.0 1.0
   40    33    39    73   0.15250 -1.0 2.0
   40    33    39    73  -0.50650  1.0 3.0
   40    33    39    43   0.09700  1.0 1.0
   40    33    39    43   0.15600 -1.0 2.0
   40    33    39    43  -0.50800  1.0 3.0
   40    45    50    51   0.15000  1.0 3.0
   40    45    50    52   0.15000  1.0 3.0
   40    45    50    55   0.56750  1.0 1.0
   40    45    50    55  -0.07550 -1.0 2.0
   40    45    50    55   0.20000  1.0 3.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    47   0.15000  1.0 3.0
   41    40    45    50   0.15000  1.0 3.0
   41    40    67    60   0.15000  1.0 3.0
   41    40    67    68   0.15000  1.0 3.0
   41    40    67    69   0.15000  1.0 3.0
   45    40    67    60   0.56750  1.0 1.0
   45    40    67    60  -0.07550 -1.0 2.0
   45    40    67    60   0.20000  1.0 3.0
   45    40    67    68   0.15000  1.0 3.0
   45    40    67    69   0.15000  1.0 3.0
   45    50    55    56   0.15000  1.0 3.0
   45    50    55    59  -0.03700  1.0 1.0
   45    50    55    59   0.37200 -1.0 2.0
   45    50    55    59  -0.47300  1.0 3.0
   45    50   -55    60   0.56750  1.0 1.0
   45    50   -55    60  -0.07550 -1.0 2.0
   45    50   -55    60   0.20000  1.0 3.0
   46    45    50    51   0.15000  1.0 3.0
   46    45    50    52   0.15000  1.0 3.0
   46    45    50    55   0.15000  1.0 3.0
   47    45    50    51   0.15000  1.0 3.0
   47    45    50    52   0.15000  1.0 3.0
   47    45    50    55   0.15000  1.0 3.0
   50    55    59    65   0.04150 -1.0 2.0
   50    55    59    79   0.04150 -1.0 2.0
   50    55    60    61   0.15000  1.0 3.0
   50    55    60    62   0.15000  1.0 3.0
   50    55    60    67   0.56750  1.0 1.0
   50    55    60    67  -0.07550 -1.0 2.0
   50    55    60    67   0.20000  1.0 3.0
   51    50    55    56   0.15000  1.0 3.0
   51    50    55    59   0.43200  1.0 3.0
   51    50    55    60   0.15000  1.0 3.0
   52    50    55    56   0.15000  1.0 3.0
   52    50    55    59   0.43200  1.0 3.0
   52    50    55    60   0.15000  1.0 3.0
   55    59    65    66   3.62500 -1.0 2.0
   55    59    65    71   3.62500 -1.0 2.0
   55    59    79    77   3.62500 -1.0 2.0
   55    59    79    80   3.62500 -1.0 2.0
   55    60   -67    40   0.56750  1.0 1.0
   55    60   -67    40  -0.07550 -1.0 2.0
   55    60   -67    40   0.20000  1.0 3.0
   55    60    67    68   0.15000  1.0 3.0
   55    60    67    69   0.15000  1.0 3.0
   56    55    59    65   0.00000  1.0 1.0
   56    55    59    79   0.00000  1.0 1.0
   56    55    60    61   0.15000  1.0 3.0
   56    55    60    62   0.15000  1.0 3.0
   56    55    60    67   0.15000  1.0 3.0
   59    55    60    61   0.43200  1.0 3.0
   59    55    60    62   0.43200  1.0 3.0
   59    55    60    67  -0.03700  1.0 1.0
   59    55    60    67   0.37200 -1.0 2.0
   59    55    60    67  -0.47300  1.0 3.0
   59    65    71    72   3.62500 -1.0 2.0
   59    65    71    75   3.62500 -1.0 2.0
   65    59    79    77   3.62500 -1.0 2.0
   65    59    79    80   3.62500 -1.0 2.0
   65    71    75    76   3.62500 -1.0 2.0
   65    71   -75    77   3.62500 -1.0 2.0
   66    65    71    72   3.62500 -1.0 2.0
   66    65    71    75   3.62500 -1.0 2.0
   71    75    77    78   3.62500 -1.0 2.0
   71    75    77    79   3.62500 -1.0 2.0
   72    71    75    76   3.62500 -1.0 2.0
   72    71    75    77   3.62500 -1.0 2.0
   75    77   -79    59   3.62500 -1.0 2.0
   75    77    79    80   3.62500 -1.0 2.0
   76    75    77    78   3.62500 -1.0 2.0
   76    75    77    79   3.62500 -1.0 2.0
   78    77    79    59   3.62500 -1.0 2.0
   78    77    79    80   3.62500 -1.0 2.0
   79    59    65    66   3.62500 -1.0 2.0
   79    59   -65    71   3.62500 -1.0 2.0
   60    55    59    65   0.04150 -1.0 2.0
   60    55    59    79   0.04150 -1.0 2.0
   61    60    67    40   0.15000  1.0 3.0
   61    60    67    68   0.15000  1.0 3.0
   61    60    67    69   0.15000  1.0 3.0
   62    60    67    40   0.15000  1.0 3.0
   62    60    67    68   0.15000  1.0 3.0
   62    60    67    69   0.15000  1.0 3.0
   67    40    45    46   0.15000  1.0 3.0
   67    40    45    47   0.15000  1.0 3.0
   67    40   -45    50   0.56750  1.0 1.0
   67    40   -45    50  -0.07550 -1.0 2.0
   67    40   -45    50   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
   33    42    37    38  10.50000 -1.0 2.0
   48    70    42    37   4.00000 -1.0 2.0
   53    49    48    42   1.10000 -1.0 2.0
   57    54    53    48   1.10000 -1.0 2.0
   63    58    57    53   1.10000 -1.0 2.0
   70    64    63    57   1.10000 -1.0 2.0
   63    73    70    42   4.00000 -1.0 2.0
   70    74    73    39   1.10000 -1.0 2.0
   33    43    39    73   1.10000 -1.0 2.0
   65    79    59    55   4.00000 -1.0 2.0
   71    66    65    59   1.10000 -1.0 2.0
   75    72    71    65   1.10000 -1.0 2.0
   77    76    75    71   4.00000 -1.0 2.0
   79    78    77    75   1.10000 -1.0 2.0
   77    80    79    59   1.10000 -1.0 2.0
END
