* LIGAND DATABASE FILE (OPLS2005)
*
001     108   110    197    300     575
    1     0 S   NP   _N1_     1    29.14597    97.74284   -18.99335
    2     1 S   H    _HN1     2     1.02951    75.63596    27.23249
    3     1 S   H    _H1_     3     1.02831    56.29792   149.57062
    4     1 S   H    _H2_     4     1.02781    75.25537   -86.56698
    5     1 S   CT   _CA1     5     1.50116   167.00867   146.63904
    6     5 S   HC   _HA1     6     1.09573   105.20581    61.79607
    7     5 S   CO3  _C1_     7     1.53786   112.41502   -58.40769
    8     7 S   O2Z  _O11     8     1.26369   115.01238   -42.78690
    9     7 S   O2Z  _O12     9     1.26236   114.95143   136.37354
   10     5 S   CT   _CB1    10     1.53087   107.42204   179.74977
   11    10 S   HC   HB11    11     1.09825   109.37282   -49.87788
   12    10 S   HC   HB12    12     1.09809   110.43885    66.70548
   13    10 S   CT   _CG1    13     1.52971   112.61650  -170.88829
   14    13 S   HC   HG11    14     1.09579   110.53913   -64.12610
   15    13 S   HC   HG12    15     1.09664   109.89792    55.03985
   16    13 S   C    _CD1    16     1.51820   112.33803   175.36874
   17    16 S   O    _OE1    17     1.22718   123.31297     0.55426
   18    16 S   N    _N2_    18     1.38569   111.52826  -179.34568
   19    18 S   H    _HN2    19     1.01597   118.95920     0.85752
   20    18 S   CT1  _CA2    20     1.46338   123.64091   179.20722
   21    20 S   HC   _HA2    21     1.09736   109.37165    -6.73851
   22    20 S   C    _C2_    22     1.53453   108.58841  -122.17462
   23    22 S   O    _O2_    23     1.23028   122.41330  -150.30787
   24    20 S   CT   _CB2    32     1.53318   111.01351   115.36957
   25    24 S   HC   HB21    33     1.09520   109.32810    53.10729
   26    24 S   HC   HB22    34     1.09473   111.00970   172.17170
   27    22 S   N    _N3_    24     1.38390   113.54204    37.41215
   28    27 S   H    _HN3    25     1.01622   119.44691    -3.76093
   29    24 S   S    _SG2    35     1.82914   110.85135   -68.34624
   30    27 S   CT   _CA3    26     1.45269   123.15444   176.93835
   31    30 S   HC   HA31    27     1.09551   107.54116   -63.73043
   32    30 S   HC   HA32    28     1.09558   107.93982    52.68414
   33    29 S   CT   _C24    36     1.84106   100.10923   149.93250
   34    33 S   HC   _H3_    37     1.09463   106.72351   -43.04446
   35    30 S   CO3  _C3_    29     1.52933   114.12049   174.67115
   36    35 S   O2Z  _O31    30     1.26370   116.06518    -0.26095
   37    35 S   O2Z  _O32    31     1.26430   114.41064   179.78878
   38    33 S   CM   _C11    38     1.51725   107.94754    74.86044
   39    38 S   HC   _H45    39     1.08922   115.71071    69.27127
   40    33 S   CT   _C25    87     1.56532   114.24703  -161.98771
   41    40 S   HC   _H58    88     1.10263   105.02532  -151.91434
   42    38 S   CMA  _C15    40     1.35583   125.38413  -113.25066
   43    42 S   OM   _O33    41     1.26095   129.28233     2.94138
   44    40 S   CT   _C28    89     1.53307   116.06643   -38.16006
   45    44 S   HC   _H63    90     1.09006   113.68508    67.00611
   46    44 S   HC   _H64    91     1.09527   110.69944   -54.37458
   47    44 S   HC   _H65    92     1.09580   110.19469  -172.60124
   48    42 S   NE   _N30    42     1.39837   117.90927  -176.62664
   49    48 S   H    _H73    43     1.01566   114.50695     0.03956
   50    48 S   CT   _C20    44     1.45497   130.61307   175.79416
   51    50 S   HC   _H50    45     1.09630   108.36946   163.60402
   52    50 S   HC   _H51    46     1.09600   111.52207    46.96126
   53    50 S   CM   _C8_    47     1.50108   109.67550   -75.61826
   54    53 S   HC   _H42    48     1.08643   115.00089    70.60665
   55    53 S   CM   _C7_    49     1.34295   124.67229  -109.71044
   56    55 S   HC   _H41    50     1.08879   117.84181    -0.24866
   57    55 S   CM   _C13    51     1.46373   125.90504   178.83416
   58    57 S   CM   _C9_    52     1.35021   119.06837   179.82196
   59    58 S   HC   _H43    53     1.08974   118.62030     0.38257
   60    57 S   CT   _C27   105     1.50841   117.49903    -1.98278
   61    60 S   HC   _H60   106     1.09535   110.51563    66.81880
   62    60 S   HC   _H61   107     1.09544   110.53853   -53.61930
   63    60 S   HC   _H62   108     1.09225   113.66795  -172.50705
   64    58 S   CT   _C23    54     1.50711   126.56223   179.51867
   65    64 S   HC   _H56    55     1.09335   110.46833    27.84686
   66    64 S   CT   _C21    56     1.53217   111.27999   -96.48117
   67    66 S   HC   _H52    57     1.09552   110.37015    25.56549
   68    66 S   HC   _H53    58     1.09584   112.16103   -94.71436
   69    64 S   OH   _O39   103     1.42967   108.67859   142.79985
   70    69 S   HO   _H74   104     0.97227   108.28785    63.07505
   71    66 S   CO4  _C17    59     1.52291   111.40150   145.08474
   72    71 S   O    _O36    60     1.23170   121.94372    38.09564
   73    71 S   CT   _C18    61     1.51215   117.24119  -143.36662
   74    73 S   HC   _H46    62     1.09454   109.11162   -43.92051
   75    73 S   HC   _H47    63     1.09521   108.96357  -160.73690
   76    73 S   CRA  _C6_    64     1.47770   109.03233    77.82064
   77    76 S   N5B  _N29    65     1.31594   128.63750   -85.53506
   78    77 S   C5B  _C5_    66     1.38287   104.35331   179.64946
   79    78 S   C5A  _C4_    67     1.37713   108.59305     1.81402
   80    79 S   HA   _H40    68     1.07905   135.86632   176.59412
   81    78 S   C    _C12    70     1.45771   120.71490   177.91043
   82    81 S   O    _O34    71     1.23060   118.10105   -25.63772
   83    76 S   OA   _O37    69     1.36543   116.93414    95.26746
   84    81 S   N    _N31    72     1.39996   118.61941   152.07391
   85    84 S   CM   _C14    73     1.38766   125.31937   172.13568
   86    85 S   CM   _C10    74     1.33960   111.92306   166.82486
   87    86 S   HC   _H44    75     1.08082   125.70437   179.19133
   88    85 S   CO4  _C16    82     1.47774   124.99622   -16.00425
   89    88 S   O    _O35    83     1.22169   124.00306   -33.14063
   90    86 S   CT   _C19    76     1.49205   110.99556    -1.80873
   91    90 S   HC   _H48    77     1.09375   112.15556   127.60086
   92    90 S   HC   _H49    78     1.09472   110.48859  -110.67775
   93    88 S   OS   _O38    84     1.36055   109.52559   146.41195
   94    84 S   CT   _C22    79     1.47800   126.31328   -16.70666
   95    94 S   HC   _H54    80     1.09465   108.42356    80.22678
   96    94 S   HC   _H55    81     1.09426   110.78932   -39.91970
   97    93 S   CT   _C26    85     1.45944   118.02139  -170.85121
   98    97 S   HC   _H59    86     1.09773   109.19878   -17.88529
   99    97 S   CT   _C31    93     1.55129   107.27296  -134.34865
  100    99 S   HC   _H72    94     1.09587   109.73475   -64.10778
  101    99 S   CT   _C29    95     1.53929   110.44078    52.33437
  102   101 S   HC   _H66    96     1.09532   111.14209    58.57056
  103   101 S   HC   _H67    97     1.09457   111.52027   -62.29708
  104   101 S   HC   _H68    98     1.09514   110.84048   178.70125
  105    99 S   CT   _C30    99     1.52890   113.35685   173.84515
  106   105 S   HC   _H69   100     1.09503   111.29281   -50.18864
  107   105 S   HC   _H70   101     1.09520   110.95719  -170.09160
  108   105 S   HC   _H71   102     1.09005   111.95896    71.40309
  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   9   5   4   3
  16   7   2   1   1  10   4  14   8   7   3   7   3   2   1   7
   4   7   4   3   6   3   9   3  10  13   5   4   2   1   1   9
   6  10   5   4   2   1   7   4   7   4   3   6   7   8   5   2
  10   3   1  12  12  10   5   7   2   5   4   3   6   2   1   1
  11   4   9   8   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    97    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    48    93    97    98    40    41    44    45    46    47    99  
   38    39    42    97    40    41    44  
   36    37  
   37  
    0  
   39    42    43    48    49    50    97    40    41    44  
   42    43    48    40  
   41    44    45    46    47    99   100   101   105    42    88    93    97    98  
   44    45    46    47    99    93    97    98  
   43    48    49    50    51    52    53  
   48    49    50  
   45    46    47    99    93    97    98  
   46    47    97  
   47    97  
   97  
   49    50    51    52    53    54    55  
   50    51    52    53  
   51    52    53    54    55    56    57  
   52    53    54    55  
   53    54    55  
   54    55    56    57    58    60  
   55    56    57  
   56    57    58    59    64    60    61    62    63  
   57    58    60  
   58    59    64    65    66    69    60    61    62    63  
   59    64    65    66    67    68    71    69    70    60    61    62    63  
   64    65    66    69    60  
   61    62    63    64  
   62    63  
   63  
    0  
   65    66    67    68    71    72    73    69    70  
   66    67    68    71    69    70  
   67    68    71    72    73    74    75    76    69    70  
   68    71    72    73    69  
   71    72    73    69  
   70    71  
    0  
   72    73    74    75    76    77    83  
   73    74    75    76  
   74    75    76    77    78    79    83  
   75    76    77    83  
   76    77    83  
   77    78    79    80    83    81  
   78    79    80    83    81    82    84  
   79    80    83    81    82    84    85    94  
   80    83    81    82    84  
   83    81  
   82    84    85    86    90    94    95    96    88    83  
   84    85    94  
    0  
   85    86    87    90    91    92    94    95    96    88    89    93  
   86    87    90    91    92    94    95    96    88    89    93    97  
   87    90    91    92    94    95    96    88    89    93  
   90    91    92    94    88  
   89    93    97    98    99    90    94  
   93    97  
   91    92    94    95    96  
   92    94    95    96  
   94    95    96  
   97    98    99   100   101   105  
   95    96  
   96  
    0  
   98    99   100   101   102   103   104   105   106   107   108  
   99   100   101   105  
  100   101   102   103   104   105   106   107   108  
  101   102   103   104   105   106   107   108  
  102   103   104   105   106   107   108  
  103   104   105  
  104   105  
  105  
  106   107   108  
  107   108  
  108  
    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   0.107500   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   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.2500   0.1700  -1.111500   1.8650   1.6500   0.051222218  -2.220205820
   49   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660   0.115300   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   72   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   73   3.5000   0.0660  -0.005000   2.4950   1.7500   0.005000000  -0.741685710
   74   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   75   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   76   3.5500   0.0700   0.439000   2.5000   1.7750   0.001000000  -0.843144165
   77   3.2500   0.1700  -0.590000   1.8650   1.6500   0.001000000  -0.511443539
   78   3.5500   0.0700   0.145000   2.5000   1.7750   0.001000000  -0.843144165
   79   3.5500   0.0700  -0.148000   2.0020   1.7750   0.001000000  -0.843144165
   80   2.4200   0.0300   0.181000   1.3810   1.2100   0.030040813   0.268726247
   81   3.7500   0.1050   0.615000   1.9250   1.7000   0.001000000  -0.126889456
   82   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   83   2.9000   0.1400  -0.257000   1.6450   1.4500   0.001000000  -0.126889456
   84   3.2500   0.1700   0.003200   1.8100   1.6000   0.054801302  -1.445846770
   85   3.5500   0.0760  -0.073200   2.0020   1.7750   0.023028004  -0.852763146
   86   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   87   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   88   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   89   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   90   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   94   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   99   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   3.5000   0.0660  -0.180000   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   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    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    40   268.000  1.529
   38    39   340.000  1.080
   38    42   465.000  1.376
   42    43   745.000  1.250
   42    48   415.000  1.382
   48    49   434.000  1.010
   48    50   382.000  1.448
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   317.000  1.510
   53    54   340.000  1.080
   53    55   549.000  1.340
   55    56   340.000  1.080
   55    57   380.000  1.444
   57    58   549.000  1.340
   57    60   317.000  1.510
   58    59   340.000  1.080
   58    64   317.000  1.510
   64    65   340.000  1.090
   64    66   268.000  1.529
   64    69   320.000  1.410
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    71   317.000  1.522
   71    72   570.000  1.229
   71    73   317.000  1.522
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   295.000  1.488
   76    77   488.000  1.335
   76    83   462.000  1.357
   77    78   410.000  1.394
   78    79   520.000  1.370
   78    81   310.000  1.477
   79    80   367.000  1.080
   79    83   340.000  1.360
   81    82   570.000  1.229
   81    84   490.000  1.335
   84    85   400.000  1.384
   84    94   337.000  1.449
   85    86   549.000  1.340
   85    88   320.000  1.462
   86    87   340.000  1.080
   86    90   317.000  1.510
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    94   268.000  1.529
   94    95   340.000  1.090
   94    96   340.000  1.090
   88    89   570.000  1.229
   88    93   214.000  1.327
   93    97   320.000  1.410
   97    98   340.000  1.090
   97    40   268.000  1.529
   97    99   268.000  1.529
   40    41   340.000  1.090
   40    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   99   100   340.000  1.090
   99   101   268.000  1.529
   99   105   268.000  1.529
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   340.000  1.090
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   340.000  1.090
   69    70   553.000  0.945
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    75.00000  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    42    70.00000  124.00000
   33    40    97    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    44    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    42    43    65.00000  137.10300
   38    42    48    75.00000  114.40000
   42    38    39    40.00000  120.50800
   42    48    49    50.00000  121.48000
   42    48    50    50.00000  121.00000
   48    42    43   105.00000  113.92000
   48    50    51    35.00000  109.50000
   48    50    52    35.00000  109.50000
   48    50    53    80.00000  112.42400
   50    48    49    35.00000  112.50000
   50    53    54    35.00000  117.00000
   50    53    55    70.00000  124.00000
   52    50    51    33.00000  107.80000
   53    50    51    35.00000  109.50000
   53    50    52    35.00000  109.50000
   53    55    56    35.00000  120.00000
   53    55    57    70.00000  123.01800
   55    53    54    35.00000  120.00000
   55    57    58    70.00000  123.01800
   55    57    60    70.00000  124.00000
   57    55    56    35.00000  120.00000
   57    58    59    35.00000  120.00000
   57    58    64    70.00000  124.00000
   57    60    61    35.00000  109.50000
   57    60    62    35.00000  109.50000
   57    60    63    35.00000  109.50000
   58    64    65    35.00000  109.50000
   58    64    66    70.00000  112.02700
   58    64    69    90.00000  110.39200
   64    58    59    35.00000  117.00000
   64    66    67    37.50000  110.70000
   64    66    68    37.50000  110.70000
   64    66    71    63.00000  111.10000
   64    69    70    55.00000  108.50000
   66    64    65    37.50000  110.70000
   66    71    72    80.00000  120.40000
   66    71    73    70.00000  116.00000
   68    66    67    33.00000  107.80000
   71    66    67    35.00000  109.50000
   71    66    68    35.00000  109.50000
   71    73    74    35.00000  109.50000
   71    73    75    35.00000  109.50000
   71    73    76    75.00000  105.85400
   73    71    72    80.00000  120.40000
   73    76    77    65.00000  125.57700
   73    76    83    80.00000  117.62500
   75    73    74    33.00000  107.80000
   76    73    74    45.00000  109.19200
   76    73    75    45.00000  109.19200
   76    77    78    70.00000  110.00000
   76    83    79    70.00000  104.00000
   77    78    79    70.00000  111.00000
   77    78    81    65.00000  122.69000
   78    79    80    35.00000  130.70000
   78    79    83    70.00000  108.00000
   78    81    82    80.00000  122.33200
   78    81    84    75.00000  113.48100
   83    76    77    70.00000  115.00000
   83    79    80    35.00000  113.40000
   81    78    79    60.00000  124.35000
   81    84    85    70.00000  120.89900
   81    84    94    50.00000  121.90000
   84    81    82    80.00000  122.90000
   84    85    86    75.00000  120.83300
   84    85    88    70.00000  117.92000
   84    94    90    70.00000  110.72300
   84    94    95    35.00000  109.50000
   84    94    96    35.00000  109.50000
   85    86    87    35.00000  120.00000
   85    86    90    70.00000  124.00000
   85    88    89    80.00000  123.72100
   85    88    93    90.00000  111.29400
   86    90    91    35.00000  109.50000
   86    90    92    35.00000  109.50000
   86    90    94    70.00000  112.02700
   90    86    87    35.00000  117.00000
   90    94    95    37.50000  110.70000
   90    94    96    37.50000  110.70000
   92    90    91    33.00000  107.80000
   94    84    85    70.00000  119.94800
   94    90    91    37.50000  110.70000
   94    90    92    37.50000  110.70000
   96    94    95    33.00000  107.80000
   88    85    86    65.00000  118.96000
   88    93    97    83.00000  116.90000
   93    88    89    83.00000  123.40000
   93    97    98    35.00000  109.50000
   93    97    40    50.00000  109.50000
   93    97    99    50.00000  109.50000
   97    40    41    37.50000  110.70000
   97    40    44    58.35000  112.70000
   97    99   100    37.50000  110.70000
   97    99   101    58.35000  112.70000
   97    99   105    58.35000  112.70000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    97    98    37.50000  110.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    47    37.50000  110.70000
   44    40    41    37.50000  110.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   99    97    98    37.50000  110.70000
   99    97    40    58.35000  112.70000
   99   101   102    37.50000  110.70000
   99   101   103    37.50000  110.70000
   99   101   104    37.50000  110.70000
   99   105   106    37.50000  110.70000
   99   105   107    37.50000  110.70000
   99   105   108    37.50000  110.70000
  101    99   100    37.50000  110.70000
  103   101   102    33.00000  107.80000
  104   101   102    33.00000  107.80000
  104   101   103    33.00000  107.80000
  105    99   100    37.50000  110.70000
  105    99   101    58.35000  112.70000
  107   105   106    33.00000  107.80000
  108   105   106    33.00000  107.80000
  108   105   107    33.00000  107.80000
   69    64    65    35.00000  109.50000
   69    64    66    50.00000  109.50000
   60    57    58    70.00000  124.00000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    40    97   0.44750  1.0 1.0
   29    33    40    97  -0.17800 -1.0 2.0
   29    33    40    97   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    44   0.44750  1.0 1.0
   29    33    40    44  -0.17800 -1.0 2.0
   29    33    40    44   0.20200  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    48   7.00000 -1.0 2.0
   33    40    44    45   0.15000  1.0 3.0
   33    40    44    46   0.15000  1.0 3.0
   33    40    44    47   0.15000  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    40    97   0.15000  1.0 3.0
   34    33    40    41   0.15000  1.0 3.0
   34    33    40    44   0.15000  1.0 3.0
   38    33    40    97   0.34400  1.0 1.0
   38    33    40    97   0.09450 -1.0 2.0
   38    33    40    97   0.11100  1.0 3.0
   38    33    40    41   0.15000  1.0 3.0
   38    33    40    44   0.34400  1.0 1.0
   38    33    40    44   0.09450 -1.0 2.0
   38    33    40    44   0.11100  1.0 3.0
   38    42    48    49   1.00000 -1.0 2.0
   38    42    48    50  -0.54700  1.0 1.0
   38    42    48    50   1.23000 -1.0 2.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    48   7.00000 -1.0 2.0
   42    48    50    51   0.00000  1.0 1.0
   42    48    50    52   0.00000  1.0 1.0
   42    48    50    53  -0.12500  1.0 1.0
   42    48    50    53  -0.12500 -1.0 2.0
   42    48    50    53   0.25000  1.0 3.0
   43    42    48    49   1.00000 -1.0 2.0
   43    42    48    50   1.00000 -1.0 2.0
   48    50    53    54   0.00000  1.0 1.0
   48    50    53    55   0.62150  1.0 1.0
   48    50    53    55   0.42850 -1.0 2.0
   48    50    53    55  -0.68200  1.0 3.0
   49    48    50    51   0.00000  1.0 1.0
   49    48    50    52   0.00000  1.0 1.0
   49    48    50    53  -0.12500  1.0 1.0
   49    48    50    53  -0.12500 -1.0 2.0
   49    48    50    53   0.25000  1.0 3.0
   50    53    55    56   7.00000 -1.0 2.0
   50    53    55    57   7.00000 -1.0 2.0
   51    50    53    54   0.33100  1.0 3.0
   51    50    53    55   0.00000  1.0 1.0
   52    50    53    54   0.33100  1.0 3.0
   52    50    53    55   0.00000  1.0 1.0
   53    55    57    58   0.28850  1.0 1.0
   53    55    57    58   2.61350 -1.0 2.0
   53    55    57    58   0.78400  1.0 3.0
   53    55    57    60  -0.18600  1.0 3.0
   54    53    55    56   7.00000 -1.0 2.0
   54    53    55    57   7.00000 -1.0 2.0
   55    57    58    59   7.00000 -1.0 2.0
   55    57    58    64   7.00000 -1.0 2.0
   55    57    60    61   0.00000  1.0 1.0
   55    57    60    62   0.00000  1.0 1.0
   55    57    60    63   0.00000  1.0 1.0
   56    55    57    58  -0.18600  1.0 3.0
   56    55    57    60   0.00000  1.0 1.0
   57    58    64    65   0.00000  1.0 1.0
   57    58    64    66   0.09850  1.0 1.0
   57    58    64    66   0.15250 -1.0 2.0
   57    58    64    66  -0.50650  1.0 3.0
   57    58    64    69   0.67800  1.0 1.0
   57    58    64    69   0.47050 -1.0 2.0
   57    58    64    69  -0.62500  1.0 3.0
   58    57    60    61   0.00000  1.0 1.0
   58    57    60    62   0.00000  1.0 1.0
   58    57    60    63   0.00000  1.0 1.0
   58    64    66    67   0.15000  1.0 3.0
   58    64    66    68   0.15000  1.0 3.0
   58    64    66    71  -0.98800  1.0 1.0
   58    64    66    71   0.48800 -1.0 2.0
   58    64    66    71   0.76800  1.0 3.0
   58    64    69    70  -0.07800  1.0 1.0
   58    64    69    70  -0.21500 -1.0 2.0
   58    64    69    70  -0.03150  1.0 3.0
   59    58    64    65   0.33100  1.0 3.0
   59    58    64    66   0.00000  1.0 1.0
   59    58    64    69   0.00000  1.0 1.0
   64    66    71    72   0.30150 -1.0 2.0
   64    66    71    73   0.60050  1.0 1.0
   64    66    71    73   0.05600 -1.0 2.0
   64    66    71    73   0.26150  1.0 3.0
   65    64    66    67   0.15000  1.0 3.0
   65    64    66    68   0.15000  1.0 3.0
   65    64    66    71  -0.11250  1.0 3.0
   65    64    69    70   0.19450  1.0 3.0
   66    64    69    70  -0.11600  1.0 1.0
   66    64    69    70  -0.09450 -1.0 2.0
   66    64    69    70   0.21250  1.0 3.0
   66    71    73    74   0.00000  1.0 1.0
   66    71    73    75   0.00000  1.0 1.0
   66    71    73    76   0.65300  1.0 1.0
   66    71    73    76  -0.03850 -1.0 2.0
   66    71    73    76   0.33900  1.0 3.0
   67    66    71    72   0.00000  1.0 1.0
   67    66    71    73   0.00000  1.0 1.0
   68    66    71    72   0.00000  1.0 1.0
   68    66    71    73   0.00000  1.0 1.0
   71    73    76    77   0.04300 -1.0 2.0
   71    73    76    83   0.04300 -1.0 2.0
   72    71    73    74   0.00000  1.0 1.0
   72    71    73    75   0.00000  1.0 1.0
   72    71    73    76   0.30150 -1.0 2.0
   73    76    77    78   3.62500 -1.0 2.0
   73    76    83    79   3.62500 -1.0 2.0
   74    73    76    77   0.00000  1.0 1.0
   74    73    76    83   0.00000  1.0 1.0
   75    73    76    77   0.00000  1.0 1.0
   75    73    76    83   0.00000  1.0 1.0
   76    77   -78    79   2.40000 -1.0 2.0
   76    77    78    81   3.62500 -1.0 2.0
   77    76   -83    79   3.62500 -1.0 2.0
   77    78    79    80   3.62500 -1.0 2.0
   77    78   -79    83   3.62500 -1.0 2.0
   77    78    81    82   1.05000 -1.0 2.0
   77    78    81    84   1.61600  1.0 1.0
   77    78    81    84  -0.04750 -1.0 2.0
   77    78    81    84   0.11700  1.0 3.0
   78    79   -83    76   3.62500 -1.0 2.0
   78    81    84    85   2.45000 -1.0 2.0
   78    81    84    94   1.49850  1.0 1.0
   78    81    84    94   1.53950 -1.0 2.0
   79    78    81    82   1.05000 -1.0 2.0
   79    78    81    84   0.75700  1.0 1.0
   79    78    81    84   0.34650 -1.0 2.0
   79    78    81    84   0.33000  1.0 3.0
   79    78    81    84  -0.28100 -1.0 4.0
   80    79    83    76   3.62500 -1.0 2.0
   83    76   -77    78   3.62500 -1.0 2.0
   81    78    79    80   3.62500 -1.0 2.0
   81    78    79    83   3.62500 -1.0 2.0
   81    84    85    86  -0.18900  1.0 1.0
   81    84    85    86   1.70900 -1.0 2.0
   81    84    85    88  -0.56400  1.0 1.0
   81    84    85    88   0.77500 -1.0 2.0
   81    84    85    88   0.18700  1.0 3.0
   81    84    94    90  -0.43950  1.0 1.0
   81    84    94    90  -0.08100 -1.0 2.0
   81    84    94    90   0.03350  1.0 3.0
   81    84    94    95   0.00000  1.0 1.0
   81    84    94    96   0.00000  1.0 1.0
   82    81    84    85   2.67200 -1.0 2.0
   82    81    84    94   3.04450 -1.0 2.0
   84    85    86    87   7.00000 -1.0 2.0
   84    85   -86    90   7.00000 -1.0 2.0
   84    85    88    89  -0.52200  1.0 1.0
   84    85    88    89   0.82950 -1.0 2.0
   84    85    88    93   1.50000 -1.0 2.0
   85    84   -94    90  -0.05900 -1.0 2.0
   85    84    94    95   0.00000  1.0 1.0
   85    84    94    96   0.00000  1.0 1.0
   85    86    90    91   0.00000  1.0 1.0
   85    86    90    92   0.00000  1.0 1.0
   85    86   -90    94   0.09850  1.0 1.0
   85    86   -90    94   0.15250 -1.0 2.0
   85    86   -90    94  -0.50650  1.0 3.0
   85    88    93    97   2.00000 -1.0 2.0
   86    85    88    89   1.00000 -1.0 2.0
   86    85    88    93  -0.56150  1.0 1.0
   86    85    88    93   2.19150 -1.0 2.0
   86    90   -94    84   0.21700  1.0 1.0
   86    90   -94    84   0.68550 -1.0 2.0
   86    90   -94    84  -0.27950  1.0 3.0
   86    90    94    95   0.15000  1.0 3.0
   86    90    94    96   0.15000  1.0 3.0
   87    86    90    91   0.33100  1.0 3.0
   87    86    90    92   0.33100  1.0 3.0
   87    86    90    94   0.00000  1.0 1.0
   91    90    94    84   0.15000  1.0 3.0
   91    90    94    95   0.15000  1.0 3.0
   91    90    94    96   0.15000  1.0 3.0
   92    90    94    84   0.15000  1.0 3.0
   92    90    94    95   0.15000  1.0 3.0
   92    90    94    96   0.15000  1.0 3.0
   94    84   -85    86  -0.88150  1.0 1.0
   94    84   -85    86   2.95600 -1.0 2.0
   94    84    85    88   1.00000 -1.0 2.0
   88    85    86    87   7.00000 -1.0 2.0
   88    85    86    90   7.00000 -1.0 2.0
   88    93    97    98   0.08050  1.0 3.0
   88    93    97    40  -0.25900  1.0 1.0
   88    93    97    40  -0.47000 -1.0 2.0
   88    93    97    40   0.11750  1.0 3.0
   88    93    97    99  -0.25900  1.0 1.0
   88    93    97    99  -0.47000 -1.0 2.0
   88    93    97    99   0.11750  1.0 3.0
   89    88    93    97   3.00000 -1.0 2.0
   93    97    40    33   0.62750  1.0 1.0
   93    97    40    33  -0.30950 -1.0 2.0
   93    97    40    33   0.27300  1.0 3.0
   93    97    40    41   0.23400  1.0 3.0
   93    97    40    44   0.62750  1.0 1.0
   93    97    40    44  -0.30950 -1.0 2.0
   93    97    40    44   0.27300  1.0 3.0
   93    97    99   100   0.23400  1.0 3.0
   93    97    99   101   0.62750  1.0 1.0
   93    97    99   101  -0.30950 -1.0 2.0
   93    97    99   101   0.27300  1.0 3.0
   93    97    99   105   0.62750  1.0 1.0
   93    97    99   105  -0.30950 -1.0 2.0
   93    97    99   105   0.27300  1.0 3.0
   97    40    44    45   0.15000  1.0 3.0
   97    40    44    46   0.15000  1.0 3.0
   97    40    44    47   0.15000  1.0 3.0
   97    99   101   102   0.15000  1.0 3.0
   97    99   101   103   0.15000  1.0 3.0
   97    99   101   104   0.15000  1.0 3.0
   97    99   105   106   0.15000  1.0 3.0
   97    99   105   107   0.15000  1.0 3.0
   97    99   105   108   0.15000  1.0 3.0
   98    97    40    33   0.15000  1.0 3.0
   98    97    40    41   0.15000  1.0 3.0
   98    97    40    44   0.15000  1.0 3.0
   98    97    99   100   0.15000  1.0 3.0
   98    97    99   101   0.15000  1.0 3.0
   98    97    99   105   0.15000  1.0 3.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    42   0.09850  1.0 1.0
   40    33    38    42   0.15250 -1.0 2.0
   40    33    38    42  -0.50650  1.0 3.0
   40    97    99   100   0.15000  1.0 3.0
   40    97    99   101   0.56750  1.0 1.0
   40    97    99   101  -0.07550 -1.0 2.0
   40    97    99   101   0.20000  1.0 3.0
   40    97    99   105   0.56750  1.0 1.0
   40    97    99   105  -0.07550 -1.0 2.0
   40    97    99   105   0.20000  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    47   0.15000  1.0 3.0
   99    97    40    33   0.56750  1.0 1.0
   99    97    40    33  -0.07550 -1.0 2.0
   99    97    40    33   0.20000  1.0 3.0
   99    97    40    41   0.15000  1.0 3.0
   99    97    40    44   0.56750  1.0 1.0
   99    97    40    44  -0.07550 -1.0 2.0
   99    97    40    44   0.20000  1.0 3.0
  100    99   101   102   0.15000  1.0 3.0
  100    99   101   103   0.15000  1.0 3.0
  100    99   101   104   0.15000  1.0 3.0
  100    99   105   106   0.15000  1.0 3.0
  100    99   105   107   0.15000  1.0 3.0
  100    99   105   108   0.15000  1.0 3.0
  101    99   105   106   0.15000  1.0 3.0
  101    99   105   107   0.15000  1.0 3.0
  101    99   105   108   0.15000  1.0 3.0
  105    99   101   102   0.15000  1.0 3.0
  105    99   101   103   0.15000  1.0 3.0
  105    99   101   104   0.15000  1.0 3.0
   69    64    66    67   0.23400  1.0 3.0
   69    64    66    68   0.23400  1.0 3.0
   69    64    66    71  -0.09450  1.0 1.0
   69    64    66    71  -1.12950 -1.0 2.0
   69    64    66    71   0.54000  1.0 3.0
   60    57    58    59   7.00000 -1.0 2.0
   60    57    58    64   7.00000 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    42   1.10000 -1.0 2.0
   48    43    42    38   1.10000 -1.0 2.0
   49    42    48    50   1.00000 -1.0 2.0
   50    54    53    55   1.10000 -1.0 2.0
   57    56    55    53   1.10000 -1.0 2.0
   55    60    57    58   1.10000 -1.0 2.0
   64    59    58    57   1.10000 -1.0 2.0
   66    73    71    72  10.50000 -1.0 2.0
   77    83    76    73   4.00000 -1.0 2.0
   79    81    78    77   4.00000 -1.0 2.0
   83    80    79    78   1.10000 -1.0 2.0
   78    84    81    82  10.50000 -1.0 2.0
   94    81    84    85   1.00000 -1.0 2.0
   84    88    85    86   1.10000 -1.0 2.0
   90    87    86    85   1.10000 -1.0 2.0
   85    93    88    89  10.50000 -1.0 2.0
END
