* LIGAND DATABASE FILE (OPLS2005)
*
001     119   121    211    330     620
    1     0 S   NP   _N1_     1    28.52746    93.87904   -20.97200
    2     1 S   H    _HN1     2     1.02823    31.96551   151.73175
    3     1 S   H    _H1_     3     1.02776    86.10048   -74.37146
    4     1 S   H    _H2_     4     1.02969    93.06947    33.75940
    5     1 S   CT   _CA1     5     1.50158   142.34388   163.41721
    6     5 S   HC   _HA1     6     1.09580   105.20181    52.59296
    7     5 S   CO3  _C1_     7     1.53776   112.45556   -67.46211
    8     7 S   O2Z  _O11     8     1.26352   115.03188   -41.65913
    9     7 S   O2Z  _O12     9     1.26254   114.91719   137.41752
   10     5 S   CT   _CB1    10     1.53064   107.32621   170.37108
   11    10 S   HC   HB11    11     1.09824   109.13359   -51.56677
   12    10 S   HC   HB12    12     1.09825   110.42062    64.85841
   13    10 S   CT   _CG1    13     1.53019   112.86896  -172.81411
   14    13 S   HC   HG11    14     1.09593   110.33442   -64.98974
   15    13 S   HC   HG12    15     1.09640   110.13400    54.29110
   16    13 S   C    _CD1    16     1.51784   112.17259   174.36793
   17    16 S   O    _OE1    17     1.22701   123.22930    -8.82267
   18    16 S   N    _N2_    18     1.38647   111.86014   172.56602
   19    18 S   H    _HN2    19     1.01570   118.89596     3.48931
   20    18 S   CT1  _CA2    20     1.46100   123.35453  -178.72221
   21    20 S   HC   _HA2    21     1.09605   108.69997     9.94275
   22    20 S   C    _C2_    22     1.53307   109.93131  -104.70145
   23    22 S   O    _O2_    23     1.23140   122.14622  -145.71066
   24    20 S   CT   _CB2    32     1.53384   111.21822   131.82222
   25    24 S   HC   HB21    33     1.09617   110.03029    51.05998
   26    24 S   HC   HB22    34     1.09523   111.88948   169.42365
   27    22 S   N    _N3_    24     1.38411   113.77112    43.57201
   28    27 S   H    _HN3    25     1.01476   119.22838    -2.19383
   29    24 S   S    _SG2    35     1.82775   112.50628   -68.69418
   30    27 S   CT   _CA3    26     1.45347   122.83566   171.90604
   31    30 S   HC   HA31    27     1.09547   108.57015    38.77494
   32    30 S   HC   HA32    28     1.09453   107.42996   155.98914
   33    29 S   CT   _C25    36     1.84855    99.60422   -75.27699
   34    33 S   HC   _H5_    37     1.09145   106.76570     9.12087
   35    30 S   CO3  _C3_    29     1.52675   113.12384   -83.85439
   36    35 S   O2Z  _O31    30     1.26411   116.14396   -36.95949
   37    35 S   O2Z  _O32    31     1.26386   115.39847   142.73720
   38    33 S   CA   _C7_    38     1.52174   110.13080  -107.08811
   39    33 S   CM   _C26    93     1.51073   108.37218   127.12459
   40    39 S   HC   _H30    94     1.09221   115.03608    57.66947
   41    38 S   CA   _C8_    39     1.40624   118.90381   104.16668
   42    41 S   HA   _H10    40     1.08623   120.87847     1.02755
   43    39 S   CMA  _C27    95     1.35638   128.71860  -119.91787
   44    43 S   OM   _O37    96     1.26174   126.58282   177.68497
   45    41 S   CA   _C9_    41     1.38465   119.12330  -177.95340
   46    43 S   NE   _N8_    97     1.39519   121.43478    -2.60617
   47    46 S   H    _H31    98     1.01159   115.55063    -6.07235
   48    45 S   CA   _C10    42     1.38452   120.73381     0.54787
   49    46 S   CT   _C28    99     1.45756   129.00701   168.48014
   50    49 S   HC   _H32   100     1.09630   109.55351   -63.97969
   51    49 S   HC   _H33   101     1.09647   110.41109    55.30806
   52    48 S   CA   _C5_    43     1.38606   122.21696    -0.27124
   53    48 S   OS   _O34    51     1.37253   113.53868   177.99572
   54    49 S   CT   _C29   102     1.53043   109.83552   175.42504
   55    54 S   HC   _H34   103     1.09722   109.24005   -60.76328
   56    54 S   HC   _H35   104     1.09558   109.50685    55.89789
   57    38 S   CA   _C6_    44     1.41710   121.92623   -73.12086
   58    57 S   HA   _H9_    45     1.08623   118.33507    -1.30026
   59    52 S   OS   _O33    46     1.36597   116.43380   179.47362
   60    53 S   CT   _C11    52     1.45307   105.18719     8.12475
   61    60 S   HC   _H3_    53     1.09959   105.28721   105.00258
   62    54 S   CT   _C30   105     1.52998   111.42376   177.40520
   63    62 S   HC   _H36   106     1.09651   109.44443   -67.61077
   64    62 S   HC   _H37   107     1.09665   109.35548    49.63341
   65    59 S   CT   _C4_    47     1.42237   116.83480   178.83165
   66    65 S   HC   _H6_    48     1.09429   107.75369  -178.91646
   67    65 S   HC   _H7_    49     1.09500   111.09788    63.36443
   68    65 S   HC   _H8_    50     1.09507   111.18801   -61.13621
   69    60 S   CA   _C19    54     1.51402   109.97632  -138.14028
   70    45 S   CT   _C12    66     1.48703   129.08908   176.30917
   71    70 S   HC   _H4_    67     1.09706   108.76644   -67.69311
   72    62 S   CT   _C31   108     1.52719   112.61959   169.99779
   73    72 S   HC   _H38   109     1.09504   108.79447  -174.23731
   74    72 S   HC   _H39   110     1.09514   109.75884   -54.35279
   75    69 S   CA   _C20    55     1.40323   119.86698  -136.98085
   76    75 S   HA   _H25    56     1.08751   120.42750     1.12396
   77    70 S   C    _C13    68     1.51766   114.63927    56.52106
   78    77 S   O    _O35    69     1.22843   123.24996    25.35119
   79    72 S   NG   _N9_   111     1.46984   112.40516    66.56415
   80    79 S   H    _H40   112     1.02332   120.23974     3.91001
   81    75 S   CA   _C21    57     1.39555   120.59969  -178.78131
   82    81 S   HA   _H26    58     1.08627   119.86682  -179.87333
   83    77 S   N    _N4_    70     1.38706   112.15291  -155.85865
   84    83 S   H    _H11    71     1.01554   119.55113     0.69661
   85    79 S   CG   _C32   113     1.38704   122.31317  -177.51848
   86    81 S   CA   _C22    59     1.39121   119.63511     0.18131
   87    83 S   CT   _C14    72     1.45032   122.80152  -177.37721
   88    87 S   HC   _H12    73     1.09569   108.00222    45.46026
   89    87 S   HC   _H13    74     1.09499   107.39058   161.73350
   90    85 S   NG   _N11   114     1.37862   119.65646   178.87883
   91    90 S   H    _H43   115     1.02022   121.42931    -0.08847
   92    90 S   H    _H44   116     1.01530   121.58400   179.36882
   93    85 S   NG   _N10   117     1.38149   121.59651    -0.80162
   94    93 S   H    _H41   118     1.01604   120.94746  -179.74283
   95    93 S   H    _H42   119     1.01525   121.84575    -0.85798
   96    86 S   CA   _C23    60     1.39217   120.74194     0.09279
   97    96 S   HA   _H27    61     1.08601   121.00767   179.82529
   98    86 S   OH   _O36    64     1.36615   118.18634   179.98022
   99    98 S   HO   _H29    65     0.97242   108.57914   179.67135
  100    87 S   CT   _C15    75     1.52785   113.08294   -75.85165
  101   100 S   HC   _H14    76     1.09630   109.73755    59.69231
  102   100 S   HC   _H15    77     1.09683   108.32037   176.03079
  103    69 S   CA   _C24    62     1.40392   121.26462    44.76950
  104   103 S   HA   _H28    63     1.08752   120.38888    -1.06991
  105   100 S   CT   _C16    78     1.53271   112.87565   -62.89665
  106   105 S   HC   _H16    79     1.09625   109.51626   -54.72292
  107   105 S   HC   _H17    80     1.09554   109.75688    62.81898
  108   105 S   CT   _C17    81     1.52530   111.65086  -175.27864
  109   108 S   HC   _H18    82     1.09582   110.38040    57.29314
  110   108 S   HC   _H19    83     1.09499   111.55282   175.42466
  111   108 S   NG   _N5_    84     1.47152   112.22743   -62.10987
  112   111 S   H    _H20    85     1.01646   118.36172   104.40280
  113   111 S   CG   _C18    86     1.38442   124.22125   -79.49499
  114   113 S   NG   _N7_    87     1.37833   118.87105   179.37006
  115   114 S   H    _H23    88     1.01494   121.51339    -0.67926
  116   114 S   H    _H24    89     1.01661   121.09712   177.70723
  117   113 S   NG   _N6_    90     1.37823   122.15904    -0.64468
  118   117 S   H    _H21    91     1.01935   120.51705  -178.42418
  119   117 S   H    _H22    92     1.01438   122.24387    -0.11364
  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   8   5   4   3
  13   6   2   1   1  12   8   3  11   4   7   3  13   8   4  12
   9   5   4  10  10   9   5   4   3   1   4  13   6   8   5   4
   3   2   1   1  12   8   3   7   4   3   8   4   7   3   8   3
   7   3   8   4   6   6   9   5   4   5   2   1   2   1   1   5
   3   2   1   9   5   4   1   1   8   5   4   7   4   3   8   3
   6   5   2   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    57    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    52    57    58    39    40    43    44    46  
   38    41    57    39    40    43  
   36    37  
   37  
    0  
   41    42    45    48    52    57    58    59    70    39    40    43  
   40    43    44    46    47    49    41    57  
   43    44    46  
   42    45    48    52    57    58    53    60    70    71    77  
   45    48    57    70  
   44    46    47    49    50    51    54  
   46    47    49  
   48    52    57    59    53    60    61    69    70    71    77    78    83  
   47    49    50    51    54    55    56    62  
   49    50    51    54  
   52    57    58    59    65    53    60    61    69    70    71    77  
   50    51    54    55    56    62    63    64    72  
   51    54    55    56    62  
   54    55    56    62  
   57    58    59    65    66    67    68    53    60    70  
   60    61    69    75   103    70    71    77    57    59  
   55    56    62    63    64    72    73    74    79  
   56    62    63    64    72  
   62    63    64    72  
   58    59    65  
   59  
   65    66    67    68  
   61    69    75    76    81    96   103   104    70    71    77    78    83  
   69    75   103    70    71    77  
   63    64    72    73    74    79    80    85  
   64    72    73    74    79  
   72    73    74    79  
   66    67    68  
   67    68  
   68  
    0  
   75    76    81    82    86    96    97   103   104    70    71    77  
   71    77    78    83    84    87    75   103  
   77    78    83  
   73    74    79    80    85    90    93  
   74    79    80    85  
   79    80    85  
   76    81    82    86    96   103   104    98  
   81    82    86   103  
   78    83    84    87    88    89   100  
   83    84    87  
   80    85    90    91    92    93    94    95  
   85    90    93  
   82    86    96    97   103    98    99  
   86    96    98  
   84    87    88    89   100   101   102   105  
   87    88    89   100  
   90    91    92    93    94    95  
   96    97   103   104    98    99  
   88    89   100   101   102   105   106   107   108  
   89   100   101   102   105  
  100   101   102   105  
   91    92    93    94    95  
   92    93  
   93  
   94    95  
   95  
    0  
   97   103   104    98    99  
  103   104    98  
   99   103  
    0  
  101   102   105   106   107   108   109   110   111  
  102   105   106   107   108  
  105   106   107   108  
  104  
    0  
  106   107   108   109   110   111   112   113  
  107   108   109   110   111  
  108   109   110   111  
  109   110   111   112   113   114   117  
  110   111   112   113  
  111   112   113  
  112   113   114   115   116   117   118   119  
  113   114   117  
  114   115   116   117   118   119  
  115   116   117   118   119  
  116   117  
  117  
  118   119  
  119  
    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   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.2500   0.1700  -1.111500   1.8650   1.6500   0.051222218  -2.220205820
   47   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660   0.115300   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   53   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   54   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5000   0.0660   0.211800   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   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   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5500   0.0700  -0.041800   2.5000   1.7750   0.001000000  -0.843144165
   70   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660   0.143000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   76   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   77   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   78   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   79   3.2500   0.1700  -0.528167   2.1120   1.8750   0.051222218  -2.220205820
   80   0.5000   0.0300   0.345100   0.9960   0.8600   0.030040813  -0.651083722
   81   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   82   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   83   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   84   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   85   2.2500   0.0500   0.837600   2.1120   1.8750   0.001000000  -0.126889456
   86   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   87   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   90   3.2500   0.1700  -0.913767   2.1120   1.8750   0.051222218  -2.220205820
   91   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   92   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   93   3.2500   0.1700  -0.913767   2.2900   2.0360   0.003973653   1.685851020
   94   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   95   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   96   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   97   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   98   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   99   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
  100   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  104   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  105   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   3.5000   0.0660   0.143000   1.9750   1.7500   0.005000000  -0.741685710
  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   3.2500   0.1700  -0.528167   2.1120   1.8750   0.051222218  -2.220205820
  112   0.5000   0.0300   0.345100   0.9960   0.8600   0.030040813  -0.651083722
  113   2.2500   0.0500   0.837600   2.1120   1.8750   0.001000000  -0.126889456
  114   3.2500   0.1700  -0.913767   2.1120   1.8750   0.051222218  -2.220205820
  115   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
  116   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
  117   3.2500   0.1700  -0.913767   2.2900   2.0360   0.003973653   1.685851020
  118   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
  119   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    38   317.000  1.510
   33    39   317.000  1.510
   38    41   469.000  1.400
   38    57   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    48   469.000  1.400
   45    70   317.000  1.510
   48    52   469.000  1.400
   48    53   450.000  1.364
   52    57   469.000  1.400
   52    59   450.000  1.364
   57    58   367.000  1.080
   59    65   320.000  1.410
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   53    60   320.000  1.410
   60    61   340.000  1.090
   60    69   317.000  1.510
   60    70   268.000  1.529
   69    75   469.000  1.400
   69   103   469.000  1.400
   75    76   367.000  1.080
   75    81   469.000  1.400
   81    82   367.000  1.080
   81    86   469.000  1.400
   86    96   469.000  1.400
   86    98   450.000  1.364
   96    97   367.000  1.080
   96   103   469.000  1.400
  103   104   367.000  1.080
   98    99   553.000  0.945
   70    71   340.000  1.090
   70    77   317.000  1.522
   77    78   570.000  1.229
   77    83   490.000  1.335
   83    84   434.000  1.010
   83    87   337.000  1.449
   87    88   340.000  1.090
   87    89   340.000  1.090
   87   100   268.000  1.529
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   105   268.000  1.529
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   268.000  1.529
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   111   337.000  1.463
  111   112   434.000  1.010
  111   113   481.000  1.340
  113   114   481.000  1.340
  113   117   481.000  1.340
  114   115   434.000  1.010
  114   116   434.000  1.010
  117   118   434.000  1.010
  117   119   434.000  1.010
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    46   415.000  1.382
   46    47   434.000  1.010
   46    49   382.000  1.448
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    54   268.000  1.529
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    79   337.000  1.463
   79    80   434.000  1.010
   79    85   481.000  1.340
   85    90   481.000  1.340
   85    93   481.000  1.340
   90    91   434.000  1.010
   90    92   434.000  1.010
   93    94   434.000  1.010
   93    95   434.000  1.010
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    38    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    57    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    57    52    63.00000  120.00000
   38    57    58    35.00000  120.00000
   41    45    48    63.00000  120.00000
   41    45    70    70.00000  120.00000
   45    41    42    35.00000  120.00000
   45    48    52    63.00000  120.00000
   45    48    53    70.00000  120.00000
   45    70    60    70.00000  112.17500
   45    70    71    35.00000  109.50000
   45    70    77    70.00000  109.44300
   48    52    57    63.00000  120.00000
   48    52    59    70.00000  120.00000
   48    53    60    75.00000  111.00000
   52    57    58    35.00000  120.00000
   52    59    65    75.00000  111.00000
   57    38    41    63.00000  120.00000
   59    52    57    70.00000  120.00000
   59    65    66    35.00000  109.50000
   59    65    67    35.00000  109.50000
   59    65    68    35.00000  109.50000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   53    48    52    70.00000  120.00000
   53    60    61    35.00000  109.50000
   53    60    69    85.00000  111.85700
   53    60    70    50.00000  109.50000
   60    69    75    70.00000  120.00000
   60    69   103    70.00000  120.00000
   60    70    71    37.50000  110.70000
   60    70    77    63.00000  111.10000
   69    60    61    35.00000  109.50000
   69    75    76    35.00000  120.00000
   69    75    81    63.00000  120.00000
   69   103    96    63.00000  120.00000
   69   103   104    35.00000  120.00000
   75    81    82    35.00000  120.00000
   75    81    86    63.00000  120.00000
   81    75    76    35.00000  120.00000
   81    86    96    63.00000  120.00000
   81    86    98    70.00000  120.00000
   86    81    82    35.00000  120.00000
   86    96    97    35.00000  120.00000
   86    96   103    63.00000  120.00000
   86    98    99    35.00000  113.00000
   96   103   104    35.00000  120.00000
  103    69    75    63.00000  120.00000
  103    96    97    35.00000  120.00000
   98    86    96    70.00000  120.00000
   70    45    48    70.00000  120.00000
   70    60    61    37.50000  110.70000
   70    60    69    70.00000  112.17500
   70    77    78    80.00000  120.40000
   70    77    83    70.00000  116.60000
   77    70    71    35.00000  109.50000
   77    83    84    35.00000  119.80000
   77    83    87    50.00000  121.90000
   83    77    78    80.00000  122.90000
   83    87    88    35.00000  109.50000
   83    87    89    35.00000  109.50000
   83    87   100    70.00000  110.72300
   87    83    84    38.00000  118.40000
   87   100   101    37.50000  110.70000
   87   100   102    37.50000  110.70000
   87   100   105    58.35000  112.70000
   89    87    88    33.00000  107.80000
  100    87    88    37.50000  110.70000
  100    87    89    37.50000  110.70000
  100   105   106    37.50000  110.70000
  100   105   107    37.50000  110.70000
  100   105   108    58.35000  112.70000
  102   100   101    33.00000  107.80000
  105   100   101    37.50000  110.70000
  105   100   102    37.50000  110.70000
  105   108   109    37.50000  110.70000
  105   108   110    37.50000  110.70000
  105   108   111    80.00000  111.20000
  107   105   106    33.00000  107.80000
  108   105   106    37.50000  110.70000
  108   105   107    37.50000  110.70000
  108   111   112    35.00000  118.40000
  108   111   113    50.00000  123.20000
  110   108   109    33.00000  107.80000
  111   108   109    35.00000  109.50000
  111   108   110    35.00000  109.50000
  111   113   114    70.00000  120.00000
  111   113   117    70.00000  120.00000
  113   111   112    35.00000  120.00000
  113   114   115    35.00000  120.00000
  113   114   116    35.00000  120.00000
  113   117   118    35.00000  120.00000
  113   117   119    35.00000  120.00000
  116   114   115    35.00000  120.00000
  117   113   114    70.00000  120.00000
  119   117   118    35.00000  120.00000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    46    75.00000  114.40000
   43    39    40    40.00000  120.50800
   43    46    47    50.00000  121.48000
   43    46    49    50.00000  121.00000
   46    43    44   105.00000  113.92000
   46    49    50    35.00000  109.50000
   46    49    51    35.00000  109.50000
   46    49    54    80.00000  111.61500
   49    46    47    35.00000  112.50000
   49    54    55    37.50000  110.70000
   49    54    56    37.50000  110.70000
   49    54    62    58.35000  112.70000
   51    49    50    33.00000  107.80000
   54    49    50    37.50000  110.70000
   54    49    51    37.50000  110.70000
   54    62    63    37.50000  110.70000
   54    62    64    37.50000  110.70000
   54    62    72    58.35000  112.70000
   56    54    55    33.00000  107.80000
   62    54    55    37.50000  110.70000
   62    54    56    37.50000  110.70000
   62    72    73    37.50000  110.70000
   62    72    74    37.50000  110.70000
   62    72    79    80.00000  111.20000
   64    62    63    33.00000  107.80000
   72    62    63    37.50000  110.70000
   72    62    64    37.50000  110.70000
   72    79    80    35.00000  118.40000
   72    79    85    50.00000  123.20000
   74    72    73    33.00000  107.80000
   79    72    73    35.00000  109.50000
   79    72    74    35.00000  109.50000
   79    85    90    70.00000  120.00000
   79    85    93    70.00000  120.00000
   85    79    80    35.00000  120.00000
   85    90    91    35.00000  120.00000
   85    90    92    35.00000  120.00000
   85    93    94    35.00000  120.00000
   85    93    95    35.00000  120.00000
   92    90    91    35.00000  120.00000
   93    85    90    70.00000  120.00000
   95    93    94    35.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    57  -0.16000  1.0 1.0
   29    33    38    57  -0.03200 -1.0 2.0
   29    33    38    57   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    57    52   3.62500 -1.0 2.0
   33    38    57    58   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    46   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    57   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    45    48   3.62500 -1.0 2.0
   38    41    45    70   3.62500 -1.0 2.0
   41    38    57    52   3.62500 -1.0 2.0
   41    38    57    58   3.62500 -1.0 2.0
   41    45   -48    52   3.62500 -1.0 2.0
   41    45    48    53   3.62500 -1.0 2.0
   41    45    70    60   0.04150 -1.0 2.0
   41    45    70    71   0.00000  1.0 1.0
   41    45    70    77   0.04300 -1.0 2.0
   42    41    45    48   3.62500 -1.0 2.0
   42    41    45    70   3.62500 -1.0 2.0
   45    48    52    57   3.62500 -1.0 2.0
   45    48    52    59   3.62500 -1.0 2.0
   45    48   -53    60   1.63200 -1.0 2.0
   45    70    77    78   0.30150 -1.0 2.0
   45    70    77    83   0.00000  1.0 1.0
   48    45   -70    60   0.04150 -1.0 2.0
   48    45    70    71   0.00000  1.0 1.0
   48    45    70    77   0.04300 -1.0 2.0
   48    52   -57    38   3.62500 -1.0 2.0
   48    52    57    58   3.62500 -1.0 2.0
   48    52    59    65   1.63200 -1.0 2.0
   48    53    60    61   0.08050  1.0 3.0
   48    53    60    69  -0.50150  1.0 1.0
   48    53    60    69  -0.23050 -1.0 2.0
   48    53    60    69   0.70600  1.0 3.0
   48    53   -60    70  -0.32850  1.0 1.0
   48    53   -60    70  -0.35800 -1.0 2.0
   48    53   -60    70   0.33950  1.0 3.0
   52    48    53    60   1.63200 -1.0 2.0
   52    59    65    66   0.08050  1.0 3.0
   52    59    65    67   0.08050  1.0 3.0
   52    59    65    68   0.08050  1.0 3.0
   57    38    41    42   3.62500 -1.0 2.0
   57    38   -41    45   3.62500 -1.0 2.0
   57    52    59    65   1.63200 -1.0 2.0
   59    52    57    38   3.62500 -1.0 2.0
   59    52    57    58   3.62500 -1.0 2.0
   53    48    52    57   3.62500 -1.0 2.0
   53    48    52    59   3.62500 -1.0 2.0
   53    60    69    75   0.64500  1.0 1.0
   53    60    69    75   0.14800 -1.0 2.0
   53    60    69    75   0.20650  1.0 3.0
   53    60    69   103   0.64500  1.0 1.0
   53    60    69   103   0.14800 -1.0 2.0
   53    60    69   103   0.20650  1.0 3.0
   53    60   -70    45  -0.64350  1.0 1.0
   53    60   -70    45  -0.04200 -1.0 2.0
   53    60   -70    45   0.19800  1.0 3.0
   53    60    70    71   0.23400  1.0 3.0
   53    60    70    77  -0.09450  1.0 1.0
   53    60    70    77  -1.12950 -1.0 2.0
   53    60    70    77   0.54000  1.0 3.0
   60    69    75    76   3.62500 -1.0 2.0
   60    69    75    81   3.62500 -1.0 2.0
   60    69   103    96   3.62500 -1.0 2.0
   60    69   103   104   3.62500 -1.0 2.0
   60    70    77    78   0.30150 -1.0 2.0
   60    70    77    83   1.39750  1.0 1.0
   60    70    77    83  -0.07950 -1.0 2.0
   60    70    77    83  -0.18750  1.0 3.0
   61    60    69    75   0.00000  1.0 1.0
   61    60    69   103   0.00000  1.0 1.0
   61    60    70    45   0.43200  1.0 3.0
   61    60    70    71   0.15000  1.0 3.0
   61    60    70    77  -0.11250  1.0 3.0
   69    60    70    45  -0.94300  1.0 1.0
   69    60    70    45   1.32550 -1.0 2.0
   69    60    70    45  -0.07100  1.0 3.0
   69    60    70    71   0.43200  1.0 3.0
   69    60    70    77   0.56750  1.0 1.0
   69    60    70    77  -0.07550 -1.0 2.0
   69    60    70    77   0.20000  1.0 3.0
   69    75    81    82   3.62500 -1.0 2.0
   69    75    81    86   3.62500 -1.0 2.0
   75    69   103    96   3.62500 -1.0 2.0
   75    69   103   104   3.62500 -1.0 2.0
   75    81   -86    96   3.62500 -1.0 2.0
   75    81    86    98   3.62500 -1.0 2.0
   76    75    81    82   3.62500 -1.0 2.0
   76    75    81    86   3.62500 -1.0 2.0
   81    86    96    97   3.62500 -1.0 2.0
   81    86    96   103   3.62500 -1.0 2.0
   81    86    98    99   0.84100 -1.0 2.0
   82    81    86    96   3.62500 -1.0 2.0
   82    81    86    98   3.62500 -1.0 2.0
   86    96  -103    69   3.62500 -1.0 2.0
   86    96   103   104   3.62500 -1.0 2.0
   96    86    98    99   0.84100 -1.0 2.0
   97    96   103    69   3.62500 -1.0 2.0
   97    96   103   104   3.62500 -1.0 2.0
  103    69    75    76   3.62500 -1.0 2.0
  103    69   -75    81   3.62500 -1.0 2.0
   98    86    96    97   3.62500 -1.0 2.0
   98    86    96   103   3.62500 -1.0 2.0
   70    45    48    52   3.62500 -1.0 2.0
   70    45   -48    53   3.62500 -1.0 2.0
   70    60    69    75   0.04150 -1.0 2.0
   70    60    69   103   0.04150 -1.0 2.0
   70    77    83    84   2.45000 -1.0 2.0
   70    77    83    87   1.49850  1.0 1.0
   70    77    83    87   1.53950 -1.0 2.0
   71    70    77    78   0.00000  1.0 1.0
   71    70    77    83   0.00000  1.0 1.0
   77    83    87    88   0.00000  1.0 1.0
   77    83    87    89   0.00000  1.0 1.0
   77    83    87   100  -0.43950  1.0 1.0
   77    83    87   100  -0.08100 -1.0 2.0
   77    83    87   100   0.03350  1.0 3.0
   78    77    83    84   2.45000 -1.0 2.0
   78    77    83    87   3.04450 -1.0 2.0
   83    87   100   101   0.15000  1.0 3.0
   83    87   100   102   0.15000  1.0 3.0
   83    87   100   105   0.43900  1.0 1.0
   83    87   100   105   0.49100 -1.0 2.0
   83    87   100   105   0.28400  1.0 3.0
   84    83    87    88   0.00000  1.0 1.0
   84    83    87    89   0.00000  1.0 1.0
   84    83    87   100   0.00000  1.0 1.0
   87   100   105   106   0.15000  1.0 3.0
   87   100   105   107   0.15000  1.0 3.0
   87   100   105   108   0.56750  1.0 1.0
   87   100   105   108  -0.07550 -1.0 2.0
   87   100   105   108   0.20000  1.0 3.0
   88    87   100   101   0.15000  1.0 3.0
   88    87   100   102   0.15000  1.0 3.0
   88    87   100   105   0.15000  1.0 3.0
   89    87   100   101   0.15000  1.0 3.0
   89    87   100   102   0.15000  1.0 3.0
   89    87   100   105   0.15000  1.0 3.0
  100   105   108   109   0.15000  1.0 3.0
  100   105   108   110   0.15000  1.0 3.0
  100   105   108   111   1.34550  1.0 1.0
  100   105   108   111  -0.31050 -1.0 2.0
  100   105   108   111   0.95500  1.0 3.0
  101   100   105   106   0.15000  1.0 3.0
  101   100   105   107   0.15000  1.0 3.0
  101   100   105   108   0.15000  1.0 3.0
  102   100   105   106   0.15000  1.0 3.0
  102   100   105   107   0.15000  1.0 3.0
  102   100   105   108   0.15000  1.0 3.0
  105   108   111   112  -0.09500  1.0 1.0
  105   108   111   112  -0.20850 -1.0 2.0
  105   108   111   112   0.20900  1.0 3.0
  105   108   111   113   0.25550 -1.0 2.0
  106   105   108   109   0.15000  1.0 3.0
  106   105   108   110   0.15000  1.0 3.0
  106   105   108   111  -0.29100  1.0 3.0
  107   105   108   109   0.15000  1.0 3.0
  107   105   108   110   0.15000  1.0 3.0
  107   105   108   111  -0.29100  1.0 3.0
  108   111   113   114   3.96800 -1.0 2.0
  108   111   113   117   3.96800 -1.0 2.0
  109   108   111   112   0.00000  1.0 1.0
  109   108   111   113   0.08850  1.0 3.0
  110   108   111   112   0.00000  1.0 1.0
  110   108   111   113   0.08850  1.0 3.0
  111   113   114   115   1.50000 -1.0 2.0
  111   113   114   116   1.50000 -1.0 2.0
  111   113   117   118   1.50000 -1.0 2.0
  111   113   117   119   1.50000 -1.0 2.0
  112   111   113   114   1.50000 -1.0 2.0
  112   111   113   117   1.50000 -1.0 2.0
  114   113   117   118   1.50000 -1.0 2.0
  114   113   117   119   1.50000 -1.0 2.0
  117   113   114   115   1.50000 -1.0 2.0
  117   113   114   116   1.50000 -1.0 2.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    57   0.18050 -1.0 2.0
   39    43    46    47   1.00000 -1.0 2.0
   39    43    46    49  -0.54700  1.0 1.0
   39    43    46    49   1.23000 -1.0 2.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    46   7.00000 -1.0 2.0
   43    46    49    50   0.00000  1.0 1.0
   43    46    49    51   0.00000  1.0 1.0
   43    46    49    54   0.25450  1.0 1.0
   43    46    49    54  -0.61700 -1.0 2.0
   43    46    49    54  -0.23550  1.0 3.0
   44    43    46    47   1.00000 -1.0 2.0
   44    43    46    49   1.00000 -1.0 2.0
   46    49    54    55   0.22950  1.0 3.0
   46    49    54    56   0.22950  1.0 3.0
   46    49    54    62   1.26750  1.0 1.0
   46    49    54    62  -0.00950 -1.0 2.0
   46    49    54    62   0.30600  1.0 3.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    51   0.00000  1.0 1.0
   47    46    49    54   0.00000  1.0 1.0
   49    54    62    63   0.15000  1.0 3.0
   49    54    62    64   0.15000  1.0 3.0
   49    54    62    72   0.56750  1.0 1.0
   49    54    62    72  -0.07550 -1.0 2.0
   49    54    62    72   0.20000  1.0 3.0
   50    49    54    55   0.15000  1.0 3.0
   50    49    54    56   0.15000  1.0 3.0
   50    49    54    62   0.15000  1.0 3.0
   51    49    54    55   0.15000  1.0 3.0
   51    49    54    56   0.15000  1.0 3.0
   51    49    54    62   0.15000  1.0 3.0
   54    62    72    73   0.15000  1.0 3.0
   54    62    72    74   0.15000  1.0 3.0
   54    62    72    79   1.34550  1.0 1.0
   54    62    72    79  -0.31050 -1.0 2.0
   54    62    72    79   0.95500  1.0 3.0
   55    54    62    63   0.15000  1.0 3.0
   55    54    62    64   0.15000  1.0 3.0
   55    54    62    72   0.15000  1.0 3.0
   56    54    62    63   0.15000  1.0 3.0
   56    54    62    64   0.15000  1.0 3.0
   56    54    62    72   0.15000  1.0 3.0
   62    72    79    80  -0.09500  1.0 1.0
   62    72    79    80  -0.20850 -1.0 2.0
   62    72    79    80   0.20900  1.0 3.0
   62    72    79    85   0.25550 -1.0 2.0
   63    62    72    73   0.15000  1.0 3.0
   63    62    72    74   0.15000  1.0 3.0
   63    62    72    79  -0.29100  1.0 3.0
   64    62    72    73   0.15000  1.0 3.0
   64    62    72    74   0.15000  1.0 3.0
   64    62    72    79  -0.29100  1.0 3.0
   72    79    85    90   3.96800 -1.0 2.0
   72    79    85    93   3.96800 -1.0 2.0
   73    72    79    80   0.00000  1.0 1.0
   73    72    79    85   0.08850  1.0 3.0
   74    72    79    80   0.00000  1.0 1.0
   74    72    79    85   0.08850  1.0 3.0
   79    85    90    91   1.50000 -1.0 2.0
   79    85    90    92   1.50000 -1.0 2.0
   79    85    93    94   1.50000 -1.0 2.0
   79    85    93    95   1.50000 -1.0 2.0
   80    79    85    90   1.50000 -1.0 2.0
   80    79    85    93   1.50000 -1.0 2.0
   90    85    93    94   1.50000 -1.0 2.0
   90    85    93    95   1.50000 -1.0 2.0
   93    85    90    91   1.50000 -1.0 2.0
   93    85    90    92   1.50000 -1.0 2.0
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
   36    30    35    37  10.50000 -1.0 2.0
   41    57    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   48    70    45    41   4.00000 -1.0 2.0
   52    53    48    45   4.00000 -1.0 2.0
   57    59    52    48   4.00000 -1.0 2.0
   52    58    57    38   1.10000 -1.0 2.0
   75   103    69    60   4.00000 -1.0 2.0
   81    76    75    69   1.10000 -1.0 2.0
   86    82    81    75   1.10000 -1.0 2.0
   96    98    86    81   4.00000 -1.0 2.0
  103    97    96    86   1.10000 -1.0 2.0
   96   104   103    69   1.10000 -1.0 2.0
   70    83    77    78  10.50000 -1.0 2.0
   84    77    83    87   1.00000 -1.0 2.0
  112   113   111   108   1.00000 -1.0 2.0
  111   114   113   117  10.50000 -1.0 2.0
  116   113   114   115   1.00000 -1.0 2.0
  118   119   117   113   1.00000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   46    44    43    39  15.00000 -1.0 2.0
   47    43    46    49   1.00000 -1.0 2.0
   80    85    79    72   1.00000 -1.0 2.0
   79    90    85    93  10.50000 -1.0 2.0
   92    85    90    91   1.00000 -1.0 2.0
   94    95    93    85   1.00000 -1.0 2.0
END
