* LIGAND DATABASE FILE (OPLS2005)
*
001     114   115    214    323     629
    1     0 S   NP   _N1_     1    28.94161    96.18911   -21.77915
    2     1 S   H    _HN1     2     1.02784    89.65220   -62.72220
    3     1 S   H    _H1_     3     1.02956    84.76165    45.66743
    4     1 S   H    _H2_     4     1.02842    35.69547   175.01151
    5     1 S   CT   _CA1     5     1.50103   146.17582   165.27100
    6     5 S   HC   _HA1     6     1.09595   105.19793    65.27240
    7     5 S   CO3  _C1_     7     1.53732   112.24129   -54.66741
    8     7 S   O2Z  _O11     8     1.26328   115.07885   -50.06899
    9     7 S   O2Z  _O12     9     1.26228   114.77416   128.92076
   10     5 S   CT   _CB1    10     1.53072   107.41084  -177.21871
   11    10 S   HC   HB11    11     1.09814   109.05446   -53.54720
   12    10 S   HC   HB12    12     1.09819   110.56147    62.88296
   13    10 S   CT   _CG1    13     1.53004   112.69500  -174.84748
   14    13 S   HC   HG11    14     1.09625   110.18674   -65.14780
   15    13 S   HC   HG12    15     1.09642   110.19189    53.96293
   16    13 S   C    _CD1    16     1.51866   112.24671   173.95169
   17    16 S   O    _OE1    17     1.22731   123.19545   -11.82403
   18    16 S   N    _N2_    18     1.38516   111.66293   169.22684
   19    18 S   H    _HN2    19     1.01530   118.90792     0.44675
   20    18 S   CT1  _CA2    20     1.46197   123.72221  -179.24308
   21    20 S   HC   _HA2    21     1.09737   109.21628   -18.28993
   22    20 S   C    _C2_    22     1.53510   108.14688  -133.85318
   23    22 S   O    _O2_    23     1.23012   122.35017  -147.27780
   24    20 S   CT   _CB2    32     1.53607   111.63951   104.07921
   25    24 S   HC   HB21    33     1.09417   109.44841    53.09007
   26    24 S   HC   HB22    34     1.09415   109.78775   171.95543
   27    22 S   N    _N3_    24     1.38548   113.34681    40.22385
   28    27 S   H    _HN3    25     1.01526   118.87274    -0.53155
   29    24 S   S    _SG2    35     1.83018   111.57908   -68.58757
   30    27 S   CT   _CA3    26     1.45432   123.41601   175.19054
   31    30 S   HC   HA31    27     1.09526   109.18941    25.27483
   32    30 S   HC   HA32    28     1.09494   107.12929   142.27127
   33    29 S   CT   _C26    36     1.86378   101.69856   172.38797
   34    30 S   CO3  _C3_    29     1.52924   113.16018   -98.17093
   35    34 S   O2Z  _O31    30     1.26400   115.42972   -43.68965
   36    34 S   O2Z  _O32    31     1.26358   114.96671   137.26389
   37    33 S   CO4  _C25    37     1.52555   106.42649    60.23167
   38    37 S   O    _O33    38     1.23122   122.37532    64.65122
   39    33 S   CM   _C17    51     1.52803   110.54258   -65.47827
   40    33 S   CT   _C27   111     1.54338   106.89675   172.99442
   41    40 S   HC   _H30   112     1.09396   112.79553    55.82229
   42    40 S   HC   _H31   113     1.09731   112.36949   -64.38293
   43    40 S   HC   _H32   114     1.09715   110.67516   176.77366
   44    37 S   CA   _C24    39     1.47074   118.67220  -113.64456
   45    39 S   CT   _C16    52     1.54745   115.53918   -65.10285
   46    45 S   HC   _H24    53     1.09766   110.03124   144.42168
   47    45 S   HC   _H25    54     1.09134   110.19463    30.76221
   48    44 S   CA   _C23    40     1.40828   117.87973   173.52125
   49    48 S   HA   _H29    41     1.08743   121.08817     0.76898
   50    45 S   CM   _C15    55     1.50840   112.91946   -95.56662
   51    50 S   HC   _H23    56     1.09001   114.04133   -51.46534
   52    48 S   CA   _C22    42     1.39015   120.60094  -178.81617
   53    52 S   HA   _H28    43     1.08560   120.29561   179.85196
   54    50 S   CM   _C14    57     1.34870   128.50392   130.87328
   55    52 S   CA   _C21    44     1.38544   119.33950     0.07402
   56    55 S   HA   _H27    45     1.08607   120.23387   179.84298
   57    54 S   CT   _C28    58     1.50428   125.09514    -1.29452
   58    57 S   HC   _H33    59     1.09446   110.40907   113.94604
   59    57 S   HC   _H34    60     1.09140   113.73240    -6.56964
   60    57 S   HC   _H35    61     1.09521   110.03906  -126.44474
   61    54 S   CT   _C13    62     1.51828   119.71455   179.30564
   62    61 S   HC   _H21    63     1.09789   110.56306     8.67331
   63    61 S   HC   _H22    64     1.09764   108.38710   123.84632
   64    55 S   CA   _C20    46     1.39839   119.85675    -0.17914
   65    64 S   HA   _H26    47     1.08886   116.69565   180.00000
   66    61 S   CT   _C12    65     1.53623   114.86769  -114.30675
   67    66 S   HC   _H19    66     1.09641   109.98843   -63.03510
   68    66 S   HC   _H20    67     1.09552   107.45535  -178.64636
   69    44 S   CA   _C19    48     1.39792   120.55844    -5.51086
   70    66 S   CT   _C11    68     1.53431   113.05733    59.88162
   71    70 S   HC   _H17    69     1.09362   108.23293   -57.56224
   72    70 S   HC   _H18    70     1.09741   109.43346    58.20355
   73    69 S   CMA  _C18    49     1.51546   123.63694    -1.80862
   74    73 S   OM   _O34    50     1.27025   118.46468  -175.13413
   75    70 S   CT   _C9_    71     1.54419   113.53927  -178.88601
   76    75 S   HC   _H4_    72     1.09766   108.92126    52.03984
   77    75 S   CT   _C10    73     1.53330   111.27365   -66.68411
   78    77 S   HC   _H14    74     1.09523   111.22412   -57.45340
   79    77 S   HC   _H15    75     1.09378   111.53307    63.50397
   80    77 S   HC   _H16    76     1.09550   110.80675  -177.52725
   81    75 S   CT   _C8_    77     1.54521   111.31578   171.42620
   82    81 S   HC   _H12    78     1.09766   109.16712   168.00311
   83    81 S   HC   _H13    79     1.09741   109.72152    51.46720
   84    81 S   CT   _C7_    80     1.53398   113.28245   -71.58956
   85    84 S   HC   _H10    81     1.09649   109.37338   -58.37271
   86    84 S   HC   _H11    82     1.09299   109.96093    59.28791
   87    84 S   CT   _C6_    83     1.53208   111.21848  -179.57433
   88    87 S   HC   _H8_    84     1.09693   109.43719   -62.24924
   89    87 S   HC   _H9_    85     1.09798   108.75599    53.31628
   90    87 S   CT   _C5_    86     1.54174   113.58583   174.11280
   91    90 S   HC   _H3_    87     1.09879   107.43172   -62.42097
   92    90 S   CT   _C4_    88     1.53248   109.65650  -178.05831
   93    92 S   HC   _H5_    89     1.09454   111.78934   -59.68201
   94    92 S   HC   _H6_    90     1.09547   110.53433    60.16813
   95    92 S   HC   _H7_    91     1.09502   110.92950   179.41516
   96    90 S   CT   _C29    92     1.54299   114.78432    55.84399
   97    96 S   HC   _H36    93     1.09689   109.02992   -66.18964
   98    96 S   HC   _H37    94     1.09767   108.46285   179.22696
   99    96 S   CT   _C30    95     1.53292   115.28697    56.93793
  100    99 S   HC   _H38    96     1.09515   110.16634   -59.57540
  101    99 S   HC   _H39    97     1.09417   109.46798    58.47723
  102    99 S   CT   _C31    98     1.53342   110.97667   179.63846
  103   102 S   HC   _H40    99     1.09733   109.36934   -62.79636
  104   102 S   HC   _H41   100     1.09790   108.71831    53.31021
  105   102 S   CT   _C32   101     1.53973   113.41263   174.37412
  106   105 S   HC   _H42   102     1.09694   108.61024   -56.45436
  107   105 S   CT   _C33   103     1.52898   112.55895    63.32608
  108   107 S   HC   _H43   104     1.09521   111.25862    55.94478
  109   107 S   HC   _H44   105     1.09547   110.73676   176.01046
  110   107 S   HC   _H45   106     1.09408   111.37772   -64.87762
  111   105 S   CT   _C34   107     1.52989   109.76754  -174.21196
  112   111 S   HC   _H46   108     1.09531   111.24480   -62.31319
  113   111 S   HC   _H47   109     1.09448   110.71215    57.87780
  114   111 S   HC   _H48   110     1.09509   110.96961   177.37542
  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
  16   2   1   1  14   5  15   6   2   1   1  10  10   5   4   8
   4  11   3   6   3  11   5   3   7   3   2   1   9   5   4   4
   2   9   5   4   2  12   5   4   1   1  12   8   7   3   2   1
   9   5   4   9   5   4  12   5   4  12   8   7   3   2   1   9
   5   4   9   5   4  12   5   4   9   8   7   3   2   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    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    44    73    39    45    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    44    48    69    73    74    39    45    46    47    50    40    41    42    43  
   35    36  
   36  
    0  
   38    44    48    49    52    64    69    73    39    45    40    41    42    43  
   44    48    69    39    40  
   45    46    47    50    51    54    40    41    42    43    44    64    69    73    74  
   41    42    43    44    45    73  
   42    43  
   43  
    0  
   48    49    52    53    55    64    65    69    73    74  
   46    47    50    51    54    57    61    69    73    74  
   47    50    51    54    73  
   50    51    54    73  
   49    52    53    55    56    64    69    73  
   52    53    55    69  
   51    54    57    58    59    60    61    62    63    66    73  
   54    57    61  
   53    55    56    64    65    69  
   55    56    64  
   57    58    59    60    61    62    63    66    67    68    70  
   56    64    65    69    73  
   64    65    69  
   58    59    60    61    62    63    66  
   59    60    61  
   60    61  
   61  
   62    63    66    67    68    70    71    72    75  
   63    66    67    68    70  
   66    67    68    70  
   65    69    73    74  
   69    73  
   67    68    70    71    72    75    76    77    81  
   68    70    71    72    75  
   70    71    72    75  
   73    74  
   71    72    75    76    77    78    79    80    81    82    83    84  
   72    75    76    77    81  
   75    76    77    81  
   74  
    0  
   76    77    78    79    80    81    82    83    84    85    86    87  
   77    78    79    80    81    82    83    84  
   78    79    80    81    82    83    84  
   79    80    81  
   80    81  
   81  
   82    83    84    85    86    87    88    89    90  
   83    84    85    86    87  
   84    85    86    87  
   85    86    87    88    89    90    91    92    96  
   86    87    88    89    90  
   87    88    89    90  
   88    89    90    91    92    93    94    95    96    97    98    99  
   89    90    91    92    96  
   90    91    92    96  
   91    92    93    94    95    96    97    98    99   100   101   102  
   92    93    94    95    96    97    98    99  
   93    94    95    96    97    98    99  
   94    95    96  
   95    96  
   96  
   97    98    99   100   101   102   103   104   105  
   98    99   100   101   102  
   99   100   101   102  
  100   101   102   103   104   105   106   107   111  
  101   102   103   104   105  
  102   103   104   105  
  103   104   105   106   107   108   109   110   111   112   113   114  
  104   105   106   107   111  
  105   106   107   111  
  106   107   108   109   110   111   112   113   114  
  107   108   109   110   111   112   113   114  
  108   109   110   111   112   113   114  
  109   110   111  
  110   111  
  111  
  112   113   114  
  113   114  
  114  
    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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   70   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   74   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   75   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   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    39   317.000  1.510
   33    40   268.000  1.529
   37    38   570.000  1.229
   37    44   310.000  1.470
   44    48   469.000  1.400
   44    69   469.000  1.400
   48    49   367.000  1.080
   48    52   469.000  1.400
   52    53   367.000  1.080
   52    55   469.000  1.400
   55    56   367.000  1.080
   55    64   469.000  1.400
   64    65   367.000  1.080
   64    69   469.000  1.400
   69    73   320.000  1.460
   73    74   745.000  1.250
   73    39   465.000  1.376
   39    45   317.000  1.510
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    50   317.000  1.510
   50    51   340.000  1.080
   50    54   549.000  1.340
   54    57   317.000  1.510
   54    61   317.000  1.510
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    70   268.000  1.529
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    75   268.000  1.529
   75    76   340.000  1.090
   75    77   268.000  1.529
   75    81   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   268.000  1.529
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    90   268.000  1.529
   90    91   340.000  1.090
   90    92   268.000  1.529
   90    96   268.000  1.529
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   268.000  1.529
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   102   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   268.000  1.529
  105   106   340.000  1.090
  105   107   268.000  1.529
  105   111   268.000  1.529
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  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    44    65.00000  115.47100
   33    39    73    70.00000  124.00000
   33    39    45    65.00000  117.92700
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    48    60.00000  119.52600
   37    44    69    60.00000  119.52600
   44    37    38    75.00000  123.78400
   44    48    49    35.00000  120.00000
   44    48    52    63.00000  120.00000
   44    69    64    63.00000  120.00000
   44    69    73    60.00000  120.93500
   48    52    53    35.00000  120.00000
   48    52    55    63.00000  120.00000
   52    48    49    35.00000  120.00000
   52    55    56    35.00000  120.00000
   52    55    64    63.00000  120.00000
   55    52    53    35.00000  120.00000
   55    64    65    35.00000  120.00000
   55    64    69    63.00000  120.00000
   64    55    56    35.00000  120.00000
   64    69    73    60.00000  120.93500
   69    44    48    63.00000  120.00000
   69    64    65    35.00000  120.00000
   69    73    74    85.00000  114.86500
   69    73    39    60.00000  123.20500
   73    39    45    70.00000  124.00000
   39    33    37    70.00000  109.06800
   39    73    74    65.00000  137.10300
   39    45    46    35.00000  109.50000
   39    45    47    35.00000  109.50000
   39    45    50    70.00000  110.12100
   45    50    51    35.00000  117.00000
   45    50    54    70.00000  124.00000
   47    45    46    33.00000  107.80000
   50    45    46    35.00000  109.50000
   50    45    47    35.00000  109.50000
   50    54    57    70.00000  124.00000
   50    54    61    70.00000  124.00000
   54    50    51    35.00000  120.00000
   54    57    58    35.00000  109.50000
   54    57    59    35.00000  109.50000
   54    57    60    35.00000  109.50000
   54    61    62    35.00000  109.50000
   54    61    63    35.00000  109.50000
   54    61    66    70.00000  112.02700
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   61    54    57    65.00000  117.92700
   61    66    67    37.50000  110.70000
   61    66    68    37.50000  110.70000
   61    66    70    58.35000  112.70000
   63    61    62    33.00000  107.80000
   66    61    62    37.50000  110.70000
   66    61    63    37.50000  110.70000
   66    70    71    37.50000  110.70000
   66    70    72    37.50000  110.70000
   66    70    75    58.35000  112.70000
   68    66    67    33.00000  107.80000
   70    66    67    37.50000  110.70000
   70    66    68    37.50000  110.70000
   70    75    76    37.50000  110.70000
   70    75    77    58.35000  112.70000
   70    75    81    58.35000  112.70000
   72    70    71    33.00000  107.80000
   75    70    71    37.50000  110.70000
   75    70    72    37.50000  110.70000
   75    77    78    37.50000  110.70000
   75    77    79    37.50000  110.70000
   75    77    80    37.50000  110.70000
   75    81    82    37.50000  110.70000
   75    81    83    37.50000  110.70000
   75    81    84    58.35000  112.70000
   77    75    76    37.50000  110.70000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   81    75    76    37.50000  110.70000
   81    75    77    58.35000  112.70000
   81    84    85    37.50000  110.70000
   81    84    86    37.50000  110.70000
   81    84    87    58.35000  112.70000
   83    81    82    33.00000  107.80000
   84    81    82    37.50000  110.70000
   84    81    83    37.50000  110.70000
   84    87    88    37.50000  110.70000
   84    87    89    37.50000  110.70000
   84    87    90    58.35000  112.70000
   86    84    85    33.00000  107.80000
   87    84    85    37.50000  110.70000
   87    84    86    37.50000  110.70000
   87    90    91    37.50000  110.70000
   87    90    92    58.35000  112.70000
   87    90    96    58.35000  112.70000
   89    87    88    33.00000  107.80000
   90    87    88    37.50000  110.70000
   90    87    89    37.50000  110.70000
   90    92    93    37.50000  110.70000
   90    92    94    37.50000  110.70000
   90    92    95    37.50000  110.70000
   90    96    97    37.50000  110.70000
   90    96    98    37.50000  110.70000
   90    96    99    58.35000  112.70000
   92    90    91    37.50000  110.70000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   96    90    91    37.50000  110.70000
   96    90    92    58.35000  112.70000
   96    99   100    37.50000  110.70000
   96    99   101    37.50000  110.70000
   96    99   102    58.35000  112.70000
   98    96    97    33.00000  107.80000
   99    96    97    37.50000  110.70000
   99    96    98    37.50000  110.70000
   99   102   103    37.50000  110.70000
   99   102   104    37.50000  110.70000
   99   102   105    58.35000  112.70000
  101    99   100    33.00000  107.80000
  102    99   100    37.50000  110.70000
  102    99   101    37.50000  110.70000
  102   105   106    37.50000  110.70000
  102   105   107    58.35000  112.70000
  102   105   111    58.35000  112.70000
  104   102   103    33.00000  107.80000
  105   102   103    37.50000  110.70000
  105   102   104    37.50000  110.70000
  105   107   108    37.50000  110.70000
  105   107   109    37.50000  110.70000
  105   107   110    37.50000  110.70000
  105   111   112    37.50000  110.70000
  105   111   113    37.50000  110.70000
  105   111   114    37.50000  110.70000
  107   105   106    37.50000  110.70000
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
  111   105   106    37.50000  110.70000
  111   105   107    58.35000  112.70000
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   40    33    37    63.00000  111.10000
   40    33    39    70.00000  112.02700
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
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   40    33    39    45   0.46850  1.0 1.0
   40    33    39    45   0.08550 -1.0 2.0
   40    33    39    45   0.09800  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    44    37    38  10.50000 -1.0 2.0
   48    69    44    37   4.00000 -1.0 2.0
   52    49    48    44   1.10000 -1.0 2.0
   55    53    52    48   1.10000 -1.0 2.0
   64    56    55    52   1.10000 -1.0 2.0
   69    65    64    55   1.10000 -1.0 2.0
   64    73    69    44   4.00000 -1.0 2.0
   69    74    73    39   1.10000 -1.0 2.0
   33    45    39    73   1.10000 -1.0 2.0
   45    51    50    54  15.00000 -1.0 2.0
   57    61    54    50  15.00000 -1.0 2.0
END
