* LIGAND DATABASE FILE (OPLS2005)
*
001     113   116    227    374     697
    1     0 S   NP   _N1_     1    28.75417    91.14509   -19.31608
    2     1 S   H    _HN1     2     1.02778    81.37781   -91.98844
    3     1 S   H    _H1_     3     1.02950   105.98850    14.70803
    4     1 S   H    _H2_     4     1.02833    28.82699   111.04859
    5     1 S   CT   _CA1     5     1.50153   133.58859   155.36597
    6     5 S   HC   _HA1     6     1.09568   105.23713    37.79388
    7     5 S   CO3  _C1_     7     1.53799   112.35796   -82.42285
    8     7 S   O2Z  _O11     8     1.26359   115.02777   -42.57702
    9     7 S   O2Z  _O12     9     1.26236   114.91615   136.55567
   10     5 S   CT   _CB1    10     1.53051   107.41437   155.72299
   11    10 S   HC   HB11    11     1.09820   109.40587   -50.09781
   12    10 S   HC   HB12    12     1.09692   110.29598    66.44372
   13    10 S   CT   _CG1    13     1.52994   112.92374  -171.40655
   14    13 S   HC   HG11    14     1.09587   110.43439   -62.43077
   15    13 S   HC   HG12    15     1.09633   110.08008    56.89996
   16    13 S   C    _CD1    16     1.51824   112.10658   177.22999
   17    16 S   O    _OE1    17     1.22715   123.21512    -4.86526
   18    16 S   N    _N2_    18     1.38601   111.77630   175.52705
   19    18 S   H    _HN2    19     1.01578   119.00262     2.80044
   20    18 S   CT1  _CA2    20     1.46206   123.41947  -178.87482
   21    20 S   HC   _HA2    21     1.09609   109.25023     0.65072
   22    20 S   C    _C2_    22     1.53466   108.87581  -114.83794
   23    22 S   O    _O2_    23     1.23048   122.07033  -145.79917
   24    20 S   CT   _CB2    32     1.53388   111.35246   122.75704
   25    24 S   HC   HB21    33     1.09650   109.65924    58.98774
   26    24 S   HC   HB22    34     1.09549   111.33596   176.75273
   27    22 S   N    _N3_    24     1.38453   113.63251    41.65776
   28    27 S   H    _HN3    25     1.01483   119.03817    -0.43969
   29    24 S   S    _SG2    35     1.82734   113.49056   -60.40326
   30    27 S   CT   _CA3    26     1.45455   123.43918   175.05213
   31    30 S   HC   HA31    27     1.09522   109.27127    24.28759
   32    30 S   HC   HA32    28     1.09499   107.12461   141.29742
   33    29 S   CT   _C11    36     1.82704    99.69964   -78.27097
   34    33 S   HC   _H25    37     1.09600   107.53561   -63.21322
   35    33 S   HC   _H26    38     1.09275   109.12451    52.27613
   36    30 S   CO3  _C3_    29     1.52922   113.03946   -99.21077
   37    36 S   O2Z  _O31    30     1.26411   115.37024   -45.51929
   38    36 S   O2Z  _O32    31     1.26350   115.00592   135.38728
   39    33 S   CT   _C9_    39     1.54425   114.30177   175.70573
   40    39 S   HC   _H4_    40     1.09944   106.95211   179.94405
   41    39 S   CT   _C8_    41     1.54911   114.25687   -62.48832
   42    41 S   HC   _H20    42     1.09606   110.42487    59.45761
   43    41 S   HC   _H21    43     1.09608   108.57721   175.44216
   44    39 S   CT   _C10   109     1.53893   111.27340    63.58983
   45    44 S   HC   _H22   110     1.09459   111.67879   -73.39134
   46    44 S   HC   _H23   111     1.09502   110.67031    48.02274
   47    41 S   CT   _C7_    44     1.53263   113.33169   -64.15744
   48    47 S   HC   _H18    45     1.09448   109.90862    54.56465
   49    47 S   HC   _H19    46     1.09543   109.90752   -61.47627
   50    44 S   OH   _O33   112     1.42331   109.78222   166.76901
   51    50 S   HO   _H24   113     0.97238   107.03563   179.72517
   52    47 S   CT   _C6_    47     1.53629   113.57557   174.25649
   53    52 S   HC   _H16    48     1.09565   106.29376   -67.15042
   54    52 S   HC   _H17    49     1.09783   108.05878   179.14958
   55    52 S   CT   _C5_    50     1.55549   117.24463    55.56849
   56    55 S   HC   _H3_    51     1.09559   107.49127   -61.53273
   57    55 S   CT   _C12    52     1.56369   110.47795  -179.51908
   58    57 S   HC   _H5_    53     1.10121   106.72540   -64.33039
   59    55 S   CT   _C4_   105     1.53251   109.79495    56.26276
   60    59 S   HC   _H13   106     1.09487   111.22141    69.39209
   61    59 S   HC   _H14   107     1.09328   112.05551   -51.47559
   62    59 S   HC   _H15   108     1.08954   111.76728  -169.05520
   63    57 S   CT   _C13    54     1.54497   111.85257    51.52805
   64    63 S   HC   _H27    55     1.09640   111.54549    35.49815
   65    63 S   HC   _H28    56     1.09503   110.68267   -84.28040
   66    63 S   CT   _C14    57     1.52282   107.48341   155.17949
   67    66 S   HC   _H29    58     1.09566   110.94356   122.14872
   68    66 S   HC   _H30    59     1.09464   109.37618  -120.11557
   69    66 S   CT   _C15    60     1.53085   105.97890     1.48094
   70    69 S   HC   _H6_    61     1.10083   106.64213    87.22883
   71    69 S   CT   _C20    62     1.55103   114.75142  -153.90799
   72    71 S   HC   _H9_    63     1.09748   105.19237  -170.36804
   73    71 S   CT   _C19    64     1.55314   112.74319    71.93603
   74    73 S   HC   _H8_    65     1.09942   107.44422   -63.74593
   75    71 S   CT   _C21    95     1.54285   111.88272   -55.00885
   76    75 S   HC   _H10    96     1.09619   110.04821    58.19696
   77    73 S   CT   _C18    66     1.53819   110.05268    51.77779
   78    77 S   HC   _H31    67     1.09584   111.17943    66.70610
   79    77 S   HC   _H32    68     1.09591   110.39459  -176.80579
   80    73 S   CT   _C24    78     1.57769   112.33701   179.83687
   81    75 S   OH   _O35    97     1.42612   109.31310   -59.53802
   82    81 S   HO   _H45    98     0.97239   107.58726   179.56885
   83    77 S   CT   _C17    69     1.53283   112.49373   -56.22367
   84    83 S   HC   _H7_    70     1.09634   108.39898   -64.73249
   85    80 S   CT   _C25    79     1.55671   110.52252   172.43151
   86    85 S   HC   _H35    80     1.09597   110.72378    67.45185
   87    85 S   HC   _H36    81     1.09800   109.39612   -49.60331
   88    80 S   CT   _C29   101     1.55081   110.90436   -67.47189
   89    88 S   HC   _H42   102     1.09274   112.70508    53.99371
   90    88 S   HC   _H43   103     1.09523   111.19347   -66.55442
   91    88 S   HC   _H44   104     1.09349   112.43087   174.40325
   92    57 S   CT   _C16    71     1.57218   120.53137   173.08349
   93    83 S   OH   _O36    76     1.42604   107.77412  -179.80317
   94    93 S   HO   _H46    77     0.97230   107.70919    60.50111
   95    85 S   CT   _C26    82     1.53031   113.59532  -170.88831
   96    95 S   HC   _H37    83     1.09731   109.45282   175.27333
   97    95 S   HC   _H38    84     1.09684   110.50440   -69.64513
   98    92 S   CT   _C30    72     1.54407   111.78678    79.73271
   99    98 S   HC   _H47    73     1.09041   113.05464   -75.07010
  100    98 S   HC   _H48    74     1.09440   111.78562   165.25156
  101    98 S   HC   _H49    75     1.09586   111.12619    45.90655
  102    95 S   CT   _C27    85     1.52555   112.40263    53.57707
  103   102 S   HC   _H12    86     1.09677   109.56095    69.22139
  104   102 S   CT   _C28    87     1.52700   112.14155   -52.15104
  105   104 S   HC   _H39    88     1.09660   110.43185   -70.60028
  106   104 S   HC   _H40    89     1.09798   108.69711   174.80016
  107   102 S   OH   _O34    99     1.42364   109.67128  -172.92415
  108   107 S   HO   _H41   100     0.97244   107.55356   -57.71692
  109    80 S   CT   _C23    90     1.56169   107.57943    55.26698
  110   109 S   HC   _H11    91     1.10144   107.32593    58.16141
  111   109 S   CT   _C22    92     1.52954   112.13326   -58.42017
  112   111 S   HC   _H33    93     1.09791   110.07031   179.45249
  113   111 S   HC   _H34    94     1.09671   111.49534   -64.34929
  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   7   5   4   3
  12   5   4   2   1   1  13   8  13   6   5   5   3   2   9   5
   4   1   1  12   5   4  15   8  23   9   5   2   1   1  11   6
   5  11   5   4  19   7  20   9  24   9  12   6  12   6   5  20
   5   1   8   4  16   7   6   8   3   2   1   6   2   1  10   5
   4   3   2   1   1   9   6   9   5   4   2   1   4   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    44  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    47    44    45    46    50  
   35    39    40    41    44  
   39    40    41    44  
   37    38  
   38  
    0  
   40    41    42    43    47    48    49    52    44    45    46    50    51  
   41    42    43    47    44    45    46    50  
   42    43    47    48    49    52    53    54    55    44    45    46    50  
   43    47    48    49    52    44  
   47    48    49    52    44  
   45    46    50    51    47  
   46    50    51  
   50    51  
   48    49    52    53    54    55    56    57    59  
   49    52    53    54    55  
   52    53    54    55  
   51  
    0  
   53    54    55    56    57    58    63    92    59    60    61    62  
   54    55    56    57    59  
   55    56    57    59  
   56    57    58    63    64    65    66    69    83    92    98    59    60    61    62  
   57    58    63    92    59    60    61    62  
   58    63    64    65    66    67    68    69    70    71    77    83    84    92    98    99   100   101    93    59    60    61    62  
   63    64    65    66    69    83    92    98    59  
   60    61    62    63    92  
   61    62  
   62  
    0  
   64    65    66    67    68    69    70    71    83    92    98  
   65    66    67    68    69    92  
   66    67    68    69    92  
   67    68    69    70    71    72    73    83    92    98    75  
   68    69    70    71    92  
   69    70    71    92  
   70    71    72    73    74    77    83    84    92    98    99   100   101    93    80   111    75    76    81  
   71    72    73    83    92    98    75  
   72    73    74    77    78    79    83    92    98    80    85   109   111   112   113    75    76    81    82    88  
   73    74    77    92    80   111    75    76    81  
   74    77    78    79    83    84    92    93    80    85    86    87    95   104   109   110   111    75    76    81    88    89    90    91  
   77    78    79    83    80    85   109    75    88  
   76    81    82    77    80    92   104   109   110   111   112   113  
   81    82   109   111   112   113  
   78    79    83    84    92    98    93    94    80    85   109    88  
   79    83    84    92    93    80  
   83    84    92    93    80  
   85    86    87    95    96    97   102   104   105   106   109   110   111   112   113    88    89    90    91    83  
   82   109   111   112   113  
  111  
   84    92    98    99   100   101    93    94  
   92    98    93    94  
   86    87    95    96    97   102   103   104   109   110   111   107    88    89    90    91  
   87    95    96    97   102   109    88  
   95    96    97   102   109    88  
   89    90    91    95   104   109   110   111  
   90    91   109  
   91   109  
  109  
   98    99   100   101    93    94  
   94    98  
    0  
   96    97   102   103   104   105   106   109   107   108  
   97   102   103   104   107  
  102   103   104   107  
   99   100   101  
  100   101  
  101  
    0  
  103   104   105   106   109   110   111   107   108  
  104   105   106   109   107   108  
  105   106   109   110   111   112   113   107   108  
  106   109   110   111   107  
  109   110   111   107  
  108   109  
    0  
  110   111   112   113  
  111   112   113  
  112   113  
  113  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660   0.205000   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  -0.120000   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   81   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   82   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   83   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   93   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   94   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   95   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  108   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  109   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.5000   0.0660  -0.120000   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
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    44   268.000  1.529
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    47   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   268.000  1.529
   55    56   340.000  1.090
   55    57   268.000  1.529
   55    59   268.000  1.529
   57    58   340.000  1.090
   57    63   268.000  1.529
   57    92   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   268.000  1.529
   69    70   340.000  1.090
   69    71   268.000  1.529
   69    92   268.000  1.529
   71    72   340.000  1.090
   71    73   268.000  1.529
   71    75   268.000  1.529
   73    74   340.000  1.090
   73    77   268.000  1.529
   73    80   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    83   268.000  1.529
   83    84   340.000  1.090
   83    92   268.000  1.529
   83    93   320.000  1.410
   92    98   268.000  1.529
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
   93    94   553.000  0.945
   80    85   268.000  1.529
   80   109   268.000  1.529
   80    88   268.000  1.529
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    95   268.000  1.529
   95    96   340.000  1.090
   95    97   340.000  1.090
   95   102   268.000  1.529
  102   103   340.000  1.090
  102   104   268.000  1.529
  102   107   320.000  1.410
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   109   268.000  1.529
  109   110   340.000  1.090
  109   111   268.000  1.529
  111   112   340.000  1.090
  111   113   340.000  1.090
  111    75   268.000  1.529
   75    76   340.000  1.090
   75    81   320.000  1.410
   81    82   553.000  0.945
  107   108   553.000  0.945
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    50   320.000  1.410
   50    51   553.000  0.945
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    44    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    37.50000  110.70000
   39    41    47    58.35000  112.70000
   39    44    45    37.50000  110.70000
   39    44    46    37.50000  110.70000
   39    44    50    50.00000  109.50000
   41    39    40    37.50000  110.70000
   41    47    48    37.50000  110.70000
   41    47    49    37.50000  110.70000
   41    47    52    58.35000  112.70000
   43    41    42    33.00000  107.80000
   47    41    42    37.50000  110.70000
   47    41    43    37.50000  110.70000
   47    52    53    37.50000  110.70000
   47    52    54    37.50000  110.70000
   47    52    55    58.35000  112.70000
   49    47    48    33.00000  107.80000
   52    47    48    37.50000  110.70000
   52    47    49    37.50000  110.70000
   52    55    56    37.50000  110.70000
   52    55    57    58.35000  112.70000
   52    55    59    58.35000  112.70000
   54    52    53    33.00000  107.80000
   55    52    53    37.50000  110.70000
   55    52    54    37.50000  110.70000
   55    57    58    37.50000  110.70000
   55    57    63    58.35000  112.70000
   55    57    92    58.35000  112.70000
   55    59    60    37.50000  110.70000
   55    59    61    37.50000  110.70000
   55    59    62    37.50000  110.70000
   57    55    56    37.50000  110.70000
   57    63    64    37.50000  110.70000
   57    63    65    37.50000  110.70000
   57    63    66    58.35000  112.70000
   57    92    69    58.35000  112.70000
   57    92    83    58.35000  112.70000
   57    92    98    58.35000  112.70000
   63    57    58    37.50000  110.70000
   63    66    67    37.50000  110.70000
   63    66    68    37.50000  110.70000
   63    66    69    58.35000  112.70000
   65    63    64    33.00000  107.80000
   66    63    64    37.50000  110.70000
   66    63    65    37.50000  110.70000
   66    69    70    37.50000  110.70000
   66    69    71    58.35000  112.70000
   66    69    92    58.35000  112.70000
   68    66    67    33.00000  107.80000
   69    66    67    37.50000  110.70000
   69    66    68    37.50000  110.70000
   69    71    72    37.50000  110.70000
   69    71    73    58.35000  112.70000
   69    71    75    58.35000  112.70000
   69    92    83    58.35000  112.70000
   69    92    98    58.35000  112.70000
   71    69    70    37.50000  110.70000
   71    73    74    37.50000  110.70000
   71    73    77    58.35000  112.70000
   71    73    80    58.35000  112.70000
   71    75   111    58.35000  112.70000
   71    75    76    37.50000  110.70000
   71    75    81    50.00000  109.50000
   73    71    72    37.50000  110.70000
   73    77    78    37.50000  110.70000
   73    77    79    37.50000  110.70000
   73    77    83    58.35000  112.70000
   73    80    85    58.35000  112.70000
   73    80   109    58.35000  112.70000
   73    80    88    58.35000  112.70000
   77    73    74    37.50000  110.70000
   77    83    84    37.50000  110.70000
   77    83    92    58.35000  112.70000
   77    83    93    50.00000  109.50000
   79    77    78    33.00000  107.80000
   83    77    78    37.50000  110.70000
   83    77    79    37.50000  110.70000
   83    92    98    58.35000  112.70000
   83    93    94    55.00000  108.50000
   92    57    58    37.50000  110.70000
   92    57    63    58.35000  112.70000
   92    69    70    37.50000  110.70000
   92    69    71    58.35000  112.70000
   92    83    84    37.50000  110.70000
   92    98    99    37.50000  110.70000
   92    98   100    37.50000  110.70000
   92    98   101    37.50000  110.70000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
   93    83    84    35.00000  109.50000
   93    83    92    50.00000  109.50000
   80    73    74    37.50000  110.70000
   80    73    77    58.35000  112.70000
   80    85    86    37.50000  110.70000
   80    85    87    37.50000  110.70000
   80    85    95    58.35000  112.70000
   80   109   104    58.35000  112.70000
   80   109   110    37.50000  110.70000
   80   109   111    58.35000  112.70000
   80    88    89    37.50000  110.70000
   80    88    90    37.50000  110.70000
   80    88    91    37.50000  110.70000
   85    95    96    37.50000  110.70000
   85    95    97    37.50000  110.70000
   85    95   102    58.35000  112.70000
   87    85    86    33.00000  107.80000
   95    85    86    37.50000  110.70000
   95    85    87    37.50000  110.70000
   95   102   103    37.50000  110.70000
   95   102   104    58.35000  112.70000
   95   102   107    50.00000  109.50000
   97    95    96    33.00000  107.80000
  102    95    96    37.50000  110.70000
  102    95    97    37.50000  110.70000
  102   104   105    37.50000  110.70000
  102   104   106    37.50000  110.70000
  102   104   109    58.35000  112.70000
  102   107   108    55.00000  108.50000
  104   102   103    37.50000  110.70000
  104   109   110    37.50000  110.70000
  104   109   111    58.35000  112.70000
  106   104   105    33.00000  107.80000
  109    80    85    58.35000  112.70000
  109   104   105    37.50000  110.70000
  109   104   106    37.50000  110.70000
  109   111   112    37.50000  110.70000
  109   111   113    37.50000  110.70000
  109   111    75    58.35000  112.70000
  111   109   110    37.50000  110.70000
  111    75    76    37.50000  110.70000
  111    75    81    50.00000  109.50000
  113   111   112    33.00000  107.80000
   75    71    72    37.50000  110.70000
   75    71    73    58.35000  112.70000
   75   111   112    37.50000  110.70000
   75   111   113    37.50000  110.70000
   75    81    82    55.00000  108.50000
   81    75    76    35.00000  109.50000
  107   102   103    35.00000  109.50000
  107   102   104    50.00000  109.50000
   88    80    85    58.35000  112.70000
   88    80   109    58.35000  112.70000
   90    88    89    33.00000  107.80000
   91    88    89    33.00000  107.80000
   91    88    90    33.00000  107.80000
   59    55    56    37.50000  110.70000
   59    55    57    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   44    39    40    37.50000  110.70000
   44    39    41    58.35000  112.70000
   44    50    51    55.00000  108.50000
   46    44    45    33.00000  107.80000
   50    44    45    35.00000  109.50000
   50    44    46    35.00000  109.50000
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
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   77    83    93    94  -0.11600  1.0 1.0
   77    83    93    94  -0.09450 -1.0 2.0
   77    83    93    94   0.21250  1.0 3.0
   78    77    83    84   0.15000  1.0 3.0
   78    77    83    92   0.15000  1.0 3.0
   78    77    83    93   0.23400  1.0 3.0
   79    77    83    84   0.15000  1.0 3.0
   79    77    83    92   0.15000  1.0 3.0
   79    77    83    93   0.23400  1.0 3.0
   83    92    98    99   0.15000  1.0 3.0
   83    92    98   100   0.15000  1.0 3.0
   83    92    98   101   0.15000  1.0 3.0
   84    83    92    57   0.15000  1.0 3.0
   84    83    92    69   0.15000  1.0 3.0
   84    83    92    98   0.15000  1.0 3.0
   84    83    93    94   0.19450  1.0 3.0
   92    57    63    64   0.15000  1.0 3.0
   92    57    63    65   0.15000  1.0 3.0
   92    57   -63    66   0.56750  1.0 1.0
   92    57   -63    66  -0.07550 -1.0 2.0
   92    57   -63    66   0.20000  1.0 3.0
   92    69    71    72   0.15000  1.0 3.0
   92    69   -71    73   0.56750  1.0 1.0
   92    69   -71    73  -0.07550 -1.0 2.0
   92    69   -71    73   0.20000  1.0 3.0
   92    69    71    75   0.56750  1.0 1.0
   92    69    71    75  -0.07550 -1.0 2.0
   92    69    71    75   0.20000  1.0 3.0
   92    83    93    94  -0.11600  1.0 1.0
   92    83    93    94  -0.09450 -1.0 2.0
   92    83    93    94   0.21250  1.0 3.0
   93    83    92    57   0.86500  1.0 1.0
   93    83    92    57  -0.17500 -1.0 2.0
   93    83    92    57   0.20800  1.0 3.0
   93    83    92    69   0.86500  1.0 1.0
   93    83    92    69  -0.17500 -1.0 2.0
   93    83    92    69   0.20800  1.0 3.0
   93    83    92    98   0.86500  1.0 1.0
   93    83    92    98  -0.17500 -1.0 2.0
   93    83    92    98   0.20800  1.0 3.0
   80    73    77    78   0.15000  1.0 3.0
   80    73    77    79   0.15000  1.0 3.0
   80    73    77    83   0.56750  1.0 1.0
   80    73    77    83  -0.07550 -1.0 2.0
   80    73    77    83   0.20000  1.0 3.0
   80    85    95    96   0.15000  1.0 3.0
   80    85    95    97   0.15000  1.0 3.0
   80    85    95   102   0.56750  1.0 1.0
   80    85    95   102  -0.07550 -1.0 2.0
   80    85    95   102   0.20000  1.0 3.0
   80   109   111   112   0.15000  1.0 3.0
   80   109   111   113   0.15000  1.0 3.0
   80   109   111    75   0.56750  1.0 1.0
   80   109   111    75  -0.07550 -1.0 2.0
   80   109   111    75   0.20000  1.0 3.0
   85    80   109   104   0.56750  1.0 1.0
   85    80   109   104  -0.07550 -1.0 2.0
   85    80   109   104   0.20000  1.0 3.0
   85    80   109   110   0.15000  1.0 3.0
   85    80   109   111   0.56750  1.0 1.0
   85    80   109   111  -0.07550 -1.0 2.0
   85    80   109   111   0.20000  1.0 3.0
   85    80    88    89   0.15000  1.0 3.0
   85    80    88    90   0.15000  1.0 3.0
   85    80    88    91   0.15000  1.0 3.0
   85    95   102   103   0.15000  1.0 3.0
   85    95  -102   104   0.56750  1.0 1.0
   85    95  -102   104  -0.07550 -1.0 2.0
   85    95  -102   104   0.20000  1.0 3.0
   85    95   102   107   0.86500  1.0 1.0
   85    95   102   107  -0.17500 -1.0 2.0
   85    95   102   107   0.20800  1.0 3.0
   86    85    95    96   0.15000  1.0 3.0
   86    85    95    97   0.15000  1.0 3.0
   86    85    95   102   0.15000  1.0 3.0
   87    85    95    96   0.15000  1.0 3.0
   87    85    95    97   0.15000  1.0 3.0
   87    85    95   102   0.15000  1.0 3.0
   95   102   104   105   0.15000  1.0 3.0
   95   102   104   106   0.15000  1.0 3.0
   95   102   104   109   0.56750  1.0 1.0
   95   102   104   109  -0.07550 -1.0 2.0
   95   102   104   109   0.20000  1.0 3.0
   95   102   107   108  -0.11600  1.0 1.0
   95   102   107   108  -0.09450 -1.0 2.0
   95   102   107   108   0.21250  1.0 3.0
   96    95   102   103   0.15000  1.0 3.0
   96    95   102   104   0.15000  1.0 3.0
   96    95   102   107   0.23400  1.0 3.0
   97    95   102   103   0.15000  1.0 3.0
   97    95   102   104   0.15000  1.0 3.0
   97    95   102   107   0.23400  1.0 3.0
  102   104  -109    80   0.56750  1.0 1.0
  102   104  -109    80  -0.07550 -1.0 2.0
  102   104  -109    80   0.20000  1.0 3.0
  102   104   109   110   0.15000  1.0 3.0
  102   104   109   111   0.56750  1.0 1.0
  102   104   109   111  -0.07550 -1.0 2.0
  102   104   109   111   0.20000  1.0 3.0
  103   102   104   105   0.15000  1.0 3.0
  103   102   104   106   0.15000  1.0 3.0
  103   102   104   109   0.15000  1.0 3.0
  103   102   107   108   0.19450  1.0 3.0
  104   102   107   108  -0.11600  1.0 1.0
  104   102   107   108  -0.09450 -1.0 2.0
  104   102   107   108   0.21250  1.0 3.0
  104   109   111   112   0.15000  1.0 3.0
  104   109   111   113   0.15000  1.0 3.0
  104   109   111    75   0.56750  1.0 1.0
  104   109   111    75  -0.07550 -1.0 2.0
  104   109   111    75   0.20000  1.0 3.0
  105   104   109    80   0.15000  1.0 3.0
  105   104   109   110   0.15000  1.0 3.0
  105   104   109   111   0.15000  1.0 3.0
  106   104   109    80   0.15000  1.0 3.0
  106   104   109   110   0.15000  1.0 3.0
  106   104   109   111   0.15000  1.0 3.0
  109    80    85    86   0.15000  1.0 3.0
  109    80    85    87   0.15000  1.0 3.0
  109    80   -85    95   0.56750  1.0 1.0
  109    80   -85    95  -0.07550 -1.0 2.0
  109    80   -85    95   0.20000  1.0 3.0
  109    80    88    89   0.15000  1.0 3.0
  109    80    88    90   0.15000  1.0 3.0
  109    80    88    91   0.15000  1.0 3.0
  109   111   -75    71   0.56750  1.0 1.0
  109   111   -75    71  -0.07550 -1.0 2.0
  109   111   -75    71   0.20000  1.0 3.0
  109   111    75    76   0.15000  1.0 3.0
  109   111    75    81   0.86500  1.0 1.0
  109   111    75    81  -0.17500 -1.0 2.0
  109   111    75    81   0.20800  1.0 3.0
  110   109   111   112   0.15000  1.0 3.0
  110   109   111   113   0.15000  1.0 3.0
  110   109   111    75   0.15000  1.0 3.0
  111    75    81    82  -0.11600  1.0 1.0
  111    75    81    82  -0.09450 -1.0 2.0
  111    75    81    82   0.21250  1.0 3.0
  112   111    75    71   0.15000  1.0 3.0
  112   111    75    76   0.15000  1.0 3.0
  112   111    75    81   0.23400  1.0 3.0
  113   111    75    71   0.15000  1.0 3.0
  113   111    75    76   0.15000  1.0 3.0
  113   111    75    81   0.23400  1.0 3.0
   75    71    73    74   0.15000  1.0 3.0
   75    71    73    77   0.56750  1.0 1.0
   75    71    73    77  -0.07550 -1.0 2.0
   75    71    73    77   0.20000  1.0 3.0
   75    71   -73    80   0.56750  1.0 1.0
   75    71   -73    80  -0.07550 -1.0 2.0
   75    71   -73    80   0.20000  1.0 3.0
   76    75    81    82   0.19450  1.0 3.0
  107   102   104   105   0.23400  1.0 3.0
  107   102   104   106   0.23400  1.0 3.0
  107   102   104   109   0.86500  1.0 1.0
  107   102   104   109  -0.17500 -1.0 2.0
  107   102   104   109   0.20800  1.0 3.0
   88    80    85    86   0.15000  1.0 3.0
   88    80    85    87   0.15000  1.0 3.0
   88    80    85    95   0.56750  1.0 1.0
   88    80    85    95  -0.07550 -1.0 2.0
   88    80    85    95   0.20000  1.0 3.0
   88    80   109   104   0.56750  1.0 1.0
   88    80   109   104  -0.07550 -1.0 2.0
   88    80   109   104   0.20000  1.0 3.0
   88    80   109   110   0.15000  1.0 3.0
   88    80   109   111   0.56750  1.0 1.0
   88    80   109   111  -0.07550 -1.0 2.0
   88    80   109   111   0.20000  1.0 3.0
   59    55    57    58   0.15000  1.0 3.0
   59    55    57    63   0.56750  1.0 1.0
   59    55    57    63  -0.07550 -1.0 2.0
   59    55    57    63   0.20000  1.0 3.0
   59    55    57    92   0.56750  1.0 1.0
   59    55    57    92  -0.07550 -1.0 2.0
   59    55    57    92   0.20000  1.0 3.0
   44    39    41    42   0.15000  1.0 3.0
   44    39    41    43   0.15000  1.0 3.0
   44    39    41    47   0.56750  1.0 1.0
   44    39    41    47  -0.07550 -1.0 2.0
   44    39    41    47   0.20000  1.0 3.0
   45    44    50    51   0.19450  1.0 3.0
   46    44    50    51   0.19450  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
   37    30    36    38  10.50000 -1.0 2.0
END
