* LIGAND DATABASE FILE (OPLS2005)
*
001     116   117    210    308     612
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02108   103.12171   -39.84264
    3     1 S   H    _H1_     3     1.02042    71.94265    65.80150
    4     1 S   H    _H2_     4     1.02127    41.67402  -143.36842
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    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     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C22    36     1.83652    97.71022   161.84066
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   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  _C21    37     1.53230   107.16077   -59.99567
   38    37 S   O    _O34    38     1.23198   122.50664   -45.07192
   39    33 S   OS   _O36   112     1.42117   110.61015  -174.88220
   40    37 S   CM   _C20    39     1.49075   119.49473   137.51291
   41    40 S   HC   _H20    40     1.08311   115.28838  -172.11076
   42    39 S   CT   _C26   113     1.42152   111.53763    55.73934
   43    42 S   HC   _H23   114     1.09255   109.48178  -179.98022
   44    42 S   HC   _H24   115     1.09290   109.49561    59.22798
   45    42 S   HC   _H25   116     1.09178   108.98254   -60.37318
   46    40 S   CM   _C19    41     1.33609   121.90705    10.77764
   47    46 S   CO4  _C25    42     1.48723   117.73348    -2.49889
   48    47 S   O    _O35    43     1.22802   119.73066   149.44393
   49    46 S   N    _N4_    76     1.37651   127.62896   178.19669
   50    49 S   H    _H19    77     1.01780   113.76749  -177.94424
   51    33 S   CT   _C23    44     1.53943   110.49162    63.04517
   52    51 S   HC   _H9_    45     1.09778   108.94960   -52.14171
   53    51 S   CT   _C24    46     1.55195   115.05870    71.17243
   54    53 S   HC   _H21    47     1.09594   110.85256   -37.22966
   55    53 S   HC   _H22    48     1.09539   109.05624    78.63730
   56    53 S   CT   _C5_    49     1.55164   112.94932  -158.48469
   57    56 S   HC   _H3_    50     1.09559   109.69426   -43.86415
   58    56 S   CT   _C6_    51     1.54392   112.17205  -165.12560
   59    58 S   HC   _H13    52     1.09773   109.60596  -168.19420
   60    58 S   HC   _H14    53     1.09861   109.25250   -54.55127
   61    56 S   CT   _C4_   108     1.53768   110.59105    73.83002
   62    61 S   HC   _H10   109     1.08553   109.28751    60.60026
   63    61 S   HC   _H11   110     1.08551   109.34047   -59.39501
   64    61 S   HC   _H12   111     1.08600   109.30645  -179.44680
   65    58 S   CT   _C7_    54     1.53812   116.34425    68.36842
   66    65 S   HC   _H4_    55     1.09601   109.44708   -67.53700
   67    65 S   CT   _C8_    56     1.54337   115.57147    55.34509
   68    67 S   HC   _H5_    57     1.09401   107.89869   -62.66436
   69    65 S   OS   _O41   103     1.43026   108.07216   178.16944
   70    67 S   CT   _C9_    58     1.55429   116.84611    59.44908
   71    70 S   HC   _H6_    59     1.09421   107.90355   -43.36374
   72    67 S   OH   _O40   101     1.43244   108.23101  -176.69216
   73    72 S   HO   _H40   102     0.96764   106.12219   171.76412
   74    69 S   CT   _C32   104     1.41833   111.25278    79.98698
   75    74 S   HC   _H41   105     1.09294   109.48155  -180.00000
   76    74 S   HC   _H42   106     1.09290   109.53112    59.20481
   77    74 S   HC   _H43   107     1.09233   108.99447   -60.43137
   78    70 S   CM   _C10    60     1.52162   108.95009  -160.85602
   79    78 S   HC   _H15    61     1.08877   114.58130   -41.04763
   80    70 S   CT   _C31    97     1.53048   114.28956    77.45954
   81    80 S   HC   _H37    98     1.08757   109.67713    59.51479
   82    80 S   HC   _H38    99     1.08772   109.62921   -60.47300
   83    80 S   HC   _H39   100     1.08728   109.65735   179.55325
   84    78 S   CM   _C11    62     1.35051   127.71963   137.00873
   85    84 S   CT   _C12    63     1.52523   119.49803  -175.81222
   86    85 S   HC   _H7_    64     1.09811   108.66204     0.49337
   87    84 S   CT   _C30    93     1.50472   123.60364     4.52052
   88    87 S   HC   _H34    94     1.08620   109.26668    90.01220
   89    87 S   HC   _H35    95     1.08628   109.27488   -30.25476
   90    87 S   HC   _H36    96     1.08652   109.22292  -149.85547
   91    85 S   CT   _C13    65     1.54697   113.03007   121.17572
   92    91 S   HC   _H8_    66     1.09923   108.61323   -35.73802
   93    85 S   OS   _O38    87     1.42743   108.61836  -115.15349
   94    91 S   CM   _C14    67     1.51126   111.86244  -158.33499
   95    94 S   HC   _H16    68     1.08939   115.53499   -62.65871
   96    91 S   OS   _O37    82     1.42728   109.97447    81.21995
   97    93 S   CO4  _C29    88     1.36648   115.88070    86.91049
   98    97 S   O    _O39    89     1.22612   125.12622     0.05595
   99    94 S   CM   _C15    69     1.34538   127.90075   115.91671
  100    99 S   HC   _H17    70     1.08677   116.94785  -178.11737
  101    96 S   CT   _C28    83     1.41947   111.29715  -157.43806
  102   101 S   HC   _H29    84     1.09277   109.49206  -179.98022
  103   101 S   HC   _H30    85     1.09268   109.48802    59.18872
  104   101 S   HC   _H31    86     1.09231   108.93330   -60.40873
  105    97 S   N    _N5_    90     1.37333   110.58181  -179.97202
  106   105 S   H    _H32    91     1.01435   119.31098  -179.98022
  107   105 S   H    _H33    92     1.01450   121.34992    -0.00000
  108    99 S   CM   _C16    71     1.44715   125.95819     2.02371
  109   108 S   HC   _H18    72     1.08708   114.91355    12.58056
  110   108 S   CM   _C17    73     1.34642   127.28499  -168.46141
  111   110 S   C    _C18    74     1.50686   117.18010   179.45464
  112   111 S   O    _O33    75     1.22644   119.94393   134.43126
  113   110 S   CT   _C27    78     1.49832   127.61119    -0.91728
  114   113 S   HC   _H26    79     1.08719   109.58589    89.94475
  115   113 S   HC   _H27    80     1.08904   109.56028   -30.23210
  116   113 S   HC   _H28    81     1.08855   109.58399  -149.80970
  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  10   5   4   3
  18   2   1   1  11   5   9   8   3   4   2   1   1  10  10   4
   7   3   8   4  12   5   4  12   8  14   6   5   4   2   1   1
  14   6  14   7   6  12   8   3   1   3   2   1   1  14   4   4
   2   1   1  12  16   7   5   2   1   1  13   6   7   8   4   5
   4   3   6   3   3   2   1   1   2   1   1   8   3   6   5   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    51    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    47    51    52    53    39    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    46    47    48    51    52    53    54    55    56    39    42    43    44    45  
   35    36  
   36  
    0  
   38    40    41    46    47    51    52    53    49    39    42  
   40    41    46    51    39  
   42    43    44    45    40    47    51    52    53  
   41    46    47    48    51   111    49    50  
   46    47    49  
   43    44    45    51  
   44    45  
   45  
    0  
   47    48    51    52    53   110   111   112    49    50  
   48    51    52    53    54    55    56   111    49    50  
   51    52    53    49  
   50   113    51   108   110   111   112  
  110   111   112  
   52    53    54    55    56    57    58    61  
   53    54    55    56  
   54    55    56    57    58    59    60    65    61    62    63    64  
   55    56    57    58    61  
   56    57    58    61  
   57    58    59    60    65    66    67    69    61    62    63    64  
   58    59    60    65    61    62    63    64  
   59    60    65    66    67    68    70    72    69    74    61    62    63    64  
   60    65    66    67    69    61  
   65    66    67    69    61  
   62    63    64    65  
   63    64  
   64  
    0  
   66    67    68    70    71    78    80    72    73    69    74    75    76    77  
   67    68    70    72    69    74  
   68    70    71    78    79    84    80    81    82    83    72    73    69    74  
   70    71    78    80    72    73    69  
   74    75    76    77    70    72  
   71    78    79    84    85    87    80    81    82    83    72    73  
   78    79    84    80    81    82    83    72  
   73    78    80  
    0  
   75    76    77  
   76    77  
   77  
    0  
   79    84    85    86    91    93    87    88    89    90    80    81    82    83  
   84    85    87    80  
   81    82    83    84  
   82    83  
   83  
    0  
   85    86    91    92    94    96    93    97    87    88    89    90  
   86    91    92    94    95    99    96   101    93    97    98   105    87    88    89    90  
   91    92    94    96    93    97    87  
   88    89    90    91    93  
   89    90  
   90  
    0  
   92    94    95    99   100   108    96   101   102   103   104    93    97  
   94    95    99    96   101    93  
   97    98   105   106   107    94    96  
   95    99   100   108   109   110    96   101  
   99   100   108    96  
  101   102   103   104    99  
   98   105   106   107  
  105   106   107  
  100   108   109   110   111   113  
  108   109   110  
  102   103   104  
  103   104  
  104  
    0  
  106   107  
  107  
    0  
  109   110   111   112   113   114   115   116  
  110   111   113  
  111   112   113   114   115   116  
  112   113   114   115   116  
  113  
  114   115   116  
  115   116  
  116  
    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  -0.316400   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   0.396900   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   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   47   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   50   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   70   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   74   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   79   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   85   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   87   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   93   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   94   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   95   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   96   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   97   3.7500   0.1050   0.632500   1.9250   1.7000   0.001000000  -0.126889456
   98   2.9600   0.2100  -0.497000   1.8100   1.6000   0.001000000  -1.480495490
   99   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  100   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  101   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  105   3.2500   0.1700  -0.883900   1.8100   1.6000   0.054801302  -1.445846770
  106   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
  107   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
  108   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  109   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  110   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
  111   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
  112   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  113   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  116   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    51   268.000  1.529
   33    39   320.000  1.410
   37    38   570.000  1.229
   37    40   320.000  1.462
   40    41   340.000  1.080
   40    46   549.000  1.340
   46    47   320.000  1.462
   46    49   400.000  1.384
   47    48   570.000  1.229
   47    51   317.000  1.522
   51    52   340.000  1.090
   51    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   268.000  1.529
   56    57   340.000  1.090
   56    58   268.000  1.529
   56    61   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    65   268.000  1.529
   65    66   340.000  1.090
   65    67   268.000  1.529
   65    69   320.000  1.410
   67    68   340.000  1.090
   67    70   268.000  1.529
   67    72   320.000  1.410
   70    71   340.000  1.090
   70    78   317.000  1.510
   70    80   268.000  1.529
   78    79   340.000  1.080
   78    84   549.000  1.340
   84    85   317.000  1.510
   84    87   317.000  1.510
   85    86   340.000  1.090
   85    91   268.000  1.529
   85    93   320.000  1.410
   91    92   340.000  1.090
   91    94   317.000  1.510
   91    96   320.000  1.410
   94    95   340.000  1.080
   94    99   549.000  1.340
   99   100   340.000  1.080
   99   108   380.000  1.444
  108   109   340.000  1.080
  108   110   549.000  1.340
  110   111   410.000  1.444
  110   113   317.000  1.510
  111   112   570.000  1.229
  111    49   490.000  1.335
   49    50   434.000  1.010
  113   114   340.000  1.090
  113   115   340.000  1.090
  113   116   340.000  1.090
   96   101   320.000  1.410
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   340.000  1.090
   93    97   214.000  1.327
   97    98   570.000  1.229
   97   105   435.000  1.380
  105   106   434.000  1.010
  105   107   434.000  1.010
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    90   340.000  1.090
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   340.000  1.090
   72    73   553.000  0.945
   69    74   320.000  1.410
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   39    42   320.000  1.410
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   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    51    75.00000  111.63000
   29    33    39    85.00000  114.68000
   33    37    38    80.00000  120.40000
   33    37    40    65.00000  118.62400
   33    51    47    63.00000  111.10000
   33    51    52    37.50000  110.70000
   33    51    53    58.35000  112.70000
   33    39    42    60.00000  109.50000
   37    40    41    40.00000  117.72500
   37    40    46    65.00000  118.96000
   40    37    38    80.00000  123.72100
   40    46    47    65.00000  118.96000
   40    46    49    75.00000  120.83300
   46    40    41    35.00000  120.00000
   46    47    48    80.00000  123.72100
   46    47    51    65.00000  118.62400
   46    49   111    70.00000  120.89900
   46    49    50    45.00000  117.55000
   47    51    52    35.00000  109.50000
   47    51    53    63.00000  111.10000
   51    33    37    63.00000  111.10000
   51    47    48    80.00000  120.40000
   51    53    54    37.50000  110.70000
   51    53    55    37.50000  110.70000
   51    53    56    58.35000  112.70000
   53    51    52    37.50000  110.70000
   53    56    57    37.50000  110.70000
   53    56    58    58.35000  112.70000
   53    56    61    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    37.50000  110.70000
   56    53    55    37.50000  110.70000
   56    58    59    37.50000  110.70000
   56    58    60    37.50000  110.70000
   56    58    65    58.35000  112.70000
   56    61    62    37.50000  110.70000
   56    61    63    37.50000  110.70000
   56    61    64    37.50000  110.70000
   58    56    57    37.50000  110.70000
   58    65    66    37.50000  110.70000
   58    65    67    58.35000  112.70000
   58    65    69    50.00000  109.50000
   60    58    59    33.00000  107.80000
   65    58    59    37.50000  110.70000
   65    58    60    37.50000  110.70000
   65    67    68    37.50000  110.70000
   65    67    70    58.35000  112.70000
   65    67    72    50.00000  109.50000
   65    69    74    60.00000  109.50000
   67    65    66    37.50000  110.70000
   67    70    71    37.50000  110.70000
   67    70    78    70.00000  112.02700
   67    70    80    58.35000  112.70000
   67    72    73    55.00000  108.50000
   70    67    68    37.50000  110.70000
   70    78    79    35.00000  117.00000
   70    78    84    70.00000  124.00000
   70    80    81    37.50000  110.70000
   70    80    82    37.50000  110.70000
   70    80    83    37.50000  110.70000
   78    70    71    35.00000  109.50000
   78    84    85    70.00000  124.00000
   78    84    87    70.00000  124.00000
   84    78    79    35.00000  120.00000
   84    85    86    35.00000  109.50000
   84    85    91    70.00000  112.02700
   84    85    93    85.00000  110.90400
   84    87    88    35.00000  109.50000
   84    87    89    35.00000  109.50000
   84    87    90    35.00000  109.50000
   85    91    92    37.50000  110.70000
   85    91    94    70.00000  112.02700
   85    91    96    50.00000  109.50000
   85    93    97    83.00000  116.90000
   91    85    86    37.50000  110.70000
   91    94    95    35.00000  117.00000
   91    94    99    70.00000  124.00000
   91    96   101    60.00000  109.50000
   94    91    92    35.00000  109.50000
   94    99   100    35.00000  120.00000
   94    99   108    70.00000  123.01800
   99    94    95    35.00000  120.00000
   99   108   109    35.00000  120.00000
   99   108   110    70.00000  123.01800
  108    99   100    35.00000  120.00000
  108   110   111    70.00000  118.70000
  108   110   113    70.00000  124.00000
  110   108   109    35.00000  120.00000
  110   111   112    80.00000  125.30000
  110   111    49    80.00000  111.56200
  110   113   114    35.00000  109.50000
  110   113   115    35.00000  109.50000
  110   113   116    35.00000  109.50000
  111    49    50    35.00000  119.80000
   49    46    47    70.00000  117.92000
   49   111   112    80.00000  122.90000
  113   110   111    70.00000  119.70000
  115   113   114    33.00000  107.80000
  116   113   114    33.00000  107.80000
  116   113   115    33.00000  107.80000
   96    91    92    35.00000  109.50000
   96    91    94    85.00000  110.90400
   96   101   102    35.00000  109.50000
   96   101   103    35.00000  109.50000
   96   101   104    35.00000  109.50000
  103   101   102    33.00000  107.80000
  104   101   102    33.00000  107.80000
  104   101   103    33.00000  107.80000
   93    85    86    35.00000  109.50000
   93    85    91    50.00000  109.50000
   93    97    98    83.00000  123.40000
   93    97   105   110.00000  108.75700
   97   105   106    50.00000  116.34900
   97   105   107    50.00000  116.34900
  105    97    98    85.00000  125.96000
  107   105   106    35.00000  120.00000
   87    84    85    65.00000  117.92700
   89    87    88    33.00000  107.80000
   90    87    88    33.00000  107.80000
   90    87    89    33.00000  107.80000
   80    70    71    37.50000  110.70000
   80    70    78    70.00000  112.02700
   82    80    81    33.00000  107.80000
   83    80    81    33.00000  107.80000
   83    80    82    33.00000  107.80000
   72    67    68    35.00000  109.50000
   72    67    70    50.00000  109.50000
   69    65    66    35.00000  109.50000
   69    65    67    50.00000  109.50000
   69    74    75    35.00000  109.50000
   69    74    76    35.00000  109.50000
   69    74    77    35.00000  109.50000
   76    74    75    33.00000  107.80000
   77    74    75    33.00000  107.80000
   77    74    76    33.00000  107.80000
   61    56    57    37.50000  110.70000
   61    56    58    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   39    33    37    90.00000  108.74100
   39    33    51    50.00000  109.50000
   39    42    43    35.00000  109.50000
   39    42    44    35.00000  109.50000
   39    42    45    35.00000  109.50000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    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
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   87    84    85    91   0.08550 -1.0 2.0
   87    84    85    91   0.09800  1.0 3.0
   87    84    85    93   0.09700  1.0 1.0
   87    84    85    93   0.15600 -1.0 2.0
   87    84    85    93  -0.50800  1.0 3.0
   80    70    78    79   0.00000  1.0 1.0
   80    70    78    84   0.09850  1.0 1.0
   80    70    78    84   0.15250 -1.0 2.0
   80    70    78    84  -0.50650  1.0 3.0
   72    67    70    71   0.23400  1.0 3.0
   72    67    70    78   1.05650  1.0 1.0
   72    67    70    78   0.15600 -1.0 2.0
   72    67    70    78   0.53150  1.0 3.0
   72    67    70    80   0.86500  1.0 1.0
   72    67    70    80  -0.17500 -1.0 2.0
   72    67    70    80   0.20800  1.0 3.0
   69    65    67    68   0.23400  1.0 3.0
   69    65    67    70   0.62750  1.0 1.0
   69    65    67    70  -0.30950 -1.0 2.0
   69    65    67    70   0.27300  1.0 3.0
   69    65    67    72   3.69350  1.0 1.0
   69    65    67    72  -1.82950 -1.0 2.0
   61    56    58    59   0.15000  1.0 3.0
   61    56    58    60   0.15000  1.0 3.0
   61    56    58    65   0.56750  1.0 1.0
   61    56    58    65  -0.07550 -1.0 2.0
   61    56    58    65   0.20000  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    40   0.65300  1.0 1.0
   39    33    37    40  -0.03850 -1.0 2.0
   39    33    37    40   0.33900  1.0 3.0
   39    33    51    47  -0.09450  1.0 1.0
   39    33    51    47  -1.12950 -1.0 2.0
   39    33    51    47   0.54000  1.0 3.0
   39    33    51    52   0.23400  1.0 3.0
   39    33    51    53   0.62750  1.0 1.0
   39    33    51    53  -0.30950 -1.0 2.0
   39    33    51    53   0.27300  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    40    37    38  10.50000 -1.0 2.0
   37    41    40    46   1.10000 -1.0 2.0
   47    49    46    40   1.10000 -1.0 2.0
   46    51    47    48  10.50000 -1.0 2.0
   70    79    78    84   1.10000 -1.0 2.0
   85    87    84    78   1.10000 -1.0 2.0
   91    95    94    99   1.10000 -1.0 2.0
  108   100    99    94   1.10000 -1.0 2.0
   99   109   108   110   1.10000 -1.0 2.0
  111   113   110   108   1.10000 -1.0 2.0
  110    49   111   112  10.50000 -1.0 2.0
   50   111    49    46   1.00000 -1.0 2.0
   93   105    97    98  10.50000 -1.0 2.0
  107    97   105   106   1.00000 -1.0 2.0
END
