* LIGAND DATABASE FILE (OPLS2005)
*
001     107   109    199    289     573
    1     0 S   NP   _N1_     1    29.24784    93.61049   -24.66148
    2     1 S   H    _HN1     2     1.02940    96.47265   -14.60147
    3     1 S   H    _H1_     3     1.02836    15.91761   118.33953
    4     1 S   H    _H2_     4     1.02789   101.08164  -124.76689
    5     1 S   CT   _CA1     5     1.50137   126.36735   106.77211
    6     5 S   HC   _HA1     6     1.09542   105.35465    62.81010
    7     5 S   CO3  _C1_     7     1.53911   112.18954   -57.93252
    8     7 S   O2Z  _O11     8     1.26420   115.00898   -44.92395
    9     7 S   O2Z  _O12     9     1.26212   114.92789   134.14025
   10     5 S   CT   _CB1    10     1.52941   107.39521  -178.80712
   11    10 S   HC   HB11    11     1.09772   109.95755   -45.66520
   12    10 S   HC   HB12    12     1.09585   109.96763    71.00102
   13    10 S   CT   _CG1    13     1.52910   112.92224  -166.71653
   14    13 S   HC   HG11    14     1.09570   110.82908   -55.03620
   15    13 S   HC   HG12    15     1.09610   109.91870    64.39408
   16    13 S   C    _CD1    16     1.51673   111.69589  -174.48545
   17    16 S   O    _OE1    17     1.22736   123.26875     8.60496
   18    16 S   N    _N2_    18     1.38447   112.16739  -172.88517
   19    18 S   H    _HN2    19     1.01568   119.22368     5.78222
   20    18 S   CT1  _CA2    20     1.46169   122.94431  -174.94580
   21    20 S   HC   _HA2    21     1.09625   108.96353     8.22237
   22    20 S   C    _C2_    22     1.53301   109.00795  -107.06450
   23    22 S   O    _O2_    23     1.23025   122.35695  -142.08244
   24    20 S   CT   _CB2    32     1.53386   111.40166   129.58089
   25    24 S   HC   HB21    33     1.09639   109.68080    65.11927
   26    24 S   HC   HB22    34     1.09551   111.25503  -177.02863
   27    22 S   N    _N3_    24     1.38364   113.43722    45.37985
   28    27 S   H    _HN3    25     1.01587   119.67744    -2.86601
   29    24 S   S    _SG2    35     1.82855   113.14203   -53.73147
   30    27 S   CT   _CA3    26     1.45273   123.25070   176.86312
   31    30 S   HC   HA31    27     1.09549   107.63955   -61.47578
   32    30 S   HC   HA32    28     1.09553   107.84594    54.95841
   33    29 S   CT   _C12    36     1.83334   100.53365   -75.37903
   34    33 S   HC   _H8_    37     1.09423   109.24442    24.88791
   35    30 S   CO3  _C3_    29     1.52984   114.03743   176.92044
   36    35 S   O2Z  _O31    30     1.26382   116.06479     1.17570
   37    35 S   O2Z  _O32    31     1.26425   114.41200  -178.79261
   38    33 S   CT   _C8_    38     1.54829   116.09304   147.53778
   39    38 S   HC   _H4_    39     1.10204   105.72937  -163.43007
   40    38 S   CT   _C9_    40     1.54915   106.14814    84.22248
   41    40 S   HC   _H5_    41     1.09839   108.84967   132.82043
   42    40 S   CM   _C5_    42     1.51281   112.59152  -107.91342
   43    40 S   CT   _C10    95     1.55033   104.98332    14.22405
   44    43 S   HC   _H6_    96     1.09863   109.90639  -105.60386
   45    42 S   CM   _C6_    43     1.34168   121.11588     1.59336
   46    45 S   HC   _H17    44     1.08203   123.79687   175.10875
   47    42 S   CT   _C4_    91     1.50078   117.49137  -178.76584
   48    47 S   HC   _H14    92     1.09401   111.00102   -63.73241
   49    47 S   HC   _H15    93     1.09533   111.90904   176.03523
   50    47 S   HC   _H16    94     1.09487   110.13750    56.52762
   51    33 S   CT   _C11    97     1.53430   110.29247   -97.75770
   52    51 S   HC   _H7_    98     1.09469   114.32042    41.67790
   53    43 S   OS   _O35   101     1.43600   109.86713   134.46999
   54    45 S   OS   _O33    45     1.36899   126.25142    -3.72552
   55    51 S   OH   _O34    99     1.42849   109.41313   162.04996
   56    55 S   HO   _H18   100     0.97257   107.43197   -66.76363
   57    53 S   CO4  _C13   102     1.36233   116.71436   166.53878
   58    57 S   O    _O36   103     1.22327   126.41413    -0.62558
   59    38 S   CO   _C7_    46     1.53231   118.36341   -44.33108
   60    59 S   HC   _H3_    47     1.09485   108.91002   -43.84375
   61    57 S   CT   _C14   104     1.49826   109.49779   179.46186
   62    61 S   HC   _H19   105     1.09291   109.82299   -60.83406
   63    61 S   HC   _H20   106     1.09378   109.36412  -179.86152
   64    61 S   HC   _H21   107     1.09290   109.82722    61.07821
   65    59 S   OS   _O37    48     1.43710   107.14747  -160.85149
   66    65 S   CO   _C15    49     1.43183   113.34301   163.24687
   67    66 S   HC   _H9_    50     1.09774   109.71197    35.01520
   68    66 S   CT   _C16    51     1.53334   107.08975   154.45001
   69    68 S   HC   _H10    52     1.09807   110.57008    52.79691
   70    68 S   CT   _C17    53     1.53170   110.96180   173.86780
   71    70 S   HC   _H11    54     1.09790   111.03566    71.78552
   72    68 S   OS   _O45    84     1.44783   108.68454   -68.05193
   73    70 S   CT   _C18    55     1.53341   110.90151   -50.30508
   74    73 S   HC   _H12    56     1.09839   109.60092   -69.93005
   75    70 S   OS   _O43    77     1.44949   108.29549  -168.07187
   76    72 S   CO4  _C27    85     1.36162   118.14867    99.11899
   77    76 S   O    _O46    86     1.22303   126.68669     0.60620
   78    73 S   CT   _C19    57     1.53367   110.47558    50.82240
   79    78 S   HC   _H13    58     1.09651   110.64305    64.64494
   80    73 S   OS   _O41    70     1.44627   108.64583   169.16130
   81    75 S   CO4  _C25    78     1.36154   118.25431   -97.43239
   82    81 S   O    _O44    79     1.22281   126.65747    -0.02798
   83    76 S   CT   _C28    87     1.49849   109.39142   179.62832
   84    83 S   HC   _H33    88     1.09267   109.71061   -68.38758
   85    83 S   HC   _H34    89     1.09376   109.34432   172.11489
   86    83 S   HC   _H35    90     1.09300   110.01797    53.43918
   87    66 S   OS   _O38    59     1.42852   109.64299   -85.87860
   88    78 S   CT   _C20    60     1.53320   110.98713  -175.03785
   89    88 S   HC   _H22    61     1.09655   110.24431    68.69603
   90    88 S   HC   _H23    62     1.09550   110.81489   -53.17297
   91    80 S   CO4  _C23    71     1.36243   117.92985    96.17647
   92    91 S   O    _O42    72     1.22283   126.60190     0.83697
   93    81 S   CT   _C26    80     1.49837   109.35766   179.96574
   94    93 S   HC   _H30    81     1.09290   109.81160   -61.31553
   95    93 S   HC   _H31    82     1.09377   109.36990   179.62570
   96    93 S   HC   _H32    83     1.09297   109.82071    60.59368
   97    88 S   OS   _O39    63     1.44003   108.90661  -172.43174
   98    91 S   CT   _C24    73     1.49838   109.39687  -179.14522
   99    98 S   HC   _H27    74     1.09292   109.83204   -60.63710
  100    98 S   HC   _H28    75     1.09378   109.36782  -179.67857
  101    98 S   HC   _H29    76     1.09291   109.80576    61.27451
  102    97 S   CO4  _C21    64     1.36338   115.22537   179.66370
  103   102 S   O    _O40    65     1.22389   126.03547    -0.61612
  104   102 S   CT   _C22    66     1.49836   110.05756   178.63456
  105   104 S   HC   _H24    67     1.09231   109.79788   -69.99589
  106   104 S   HC   _H25    68     1.09387   109.29223   170.66276
  107   104 S   HC   _H26    69     1.09263   110.08054    52.17953
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  17   8   2   1   1  17   9  19   8  12  12   5   9   3   4   2
   1   1   6   3   7   4   1   1   5   4   6   2   3   2   1   1
   8  13   6  14   7  15   7   9  14   7   8   5   4   9   6   8
   5   4   3   2   1   1   4   6   3   2   5   4   3   2   1   1
   6   3   2   1   1   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    51    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    59    43    51    52    55  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    54    59    60    65    43    44    51    52    55    56    53  
   38    39    40    59    43    51    52    55  
   36    37  
   37  
    0  
   39    40    41    42    45    54    59    60    65    66    47    43    44    51    52    55    53  
   40    41    42    54    59    60    65    43    51  
   41    42    45    46    54    59    60    65    47    48    49    50    43    44    51    52    55    53    57  
   42    45    59    47    43    44    51    53  
   45    46    54    59    47    48    49    50    43    44    51    53  
   44    51    52    55    56    53    57    58    61    45    47    59  
   51    52    55    53    57  
   46    54    59    60    65    47    48    49    50  
   54    59    47  
   48    49    50    54  
   49    50  
   50  
    0  
   52    55    56    53    57    59  
   55    56    53  
   57    58    61    62    63    64    55  
   59    60    65    66  
   56  
    0  
   58    61    62    63    64  
   61    62    63    64  
   60    65    66    67    68    87  
   65    66  
   62    63    64  
   63    64  
   64  
    0  
   66    67    68    69    70    78    87    72  
   67    68    69    70    71    73    78    79    87    88    75    72    76  
   68    69    70    78    87    72  
   69    70    71    73    74    78    87    80    75    81    72    76    77    83  
   70    71    73    87    75    72    76  
   71    73    74    78    79    87    88    80    91    75    81    82    93    72    76  
   73    74    78    80    75    81    72  
   76    77    83    84    85    86    73    75    87  
   74    78    79    87    88    89    90    97    80    91    92    98    75    81  
   78    79    87    88    80    91    75  
   81    82    93    94    95    96    78    80  
   77    83    84    85    86  
   83    84    85    86  
   79    87    88    89    90    97   102    80    91  
   87    88    89    90    97    80  
   91    92    98    99   100   101    87    88  
   82    93    94    95    96  
   93    94    95    96  
   84    85    86  
   85    86  
   86  
    0  
   88    89    90    97  
   89    90    97   102   103   104  
   90    97   102  
   97   102  
   92    98    99   100   101  
   98    99   100   101  
   94    95    96  
   95    96  
   96  
    0  
  102   103   104   105   106   107  
   99   100   101  
  100   101  
  101  
    0  
  103   104   105   106   107  
  104   105   106   107  
  105   106   107  
  106   107  
  107  
    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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   45   3.5500   0.0760  -0.030000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   54   2.8500   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   55   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   57   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   59   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   63   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   64   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   65   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   66   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   70   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   72   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   73   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   75   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   76   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   77   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   78   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   80   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   81   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   82   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   83   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   85   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   86   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   87   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   88   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   90   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   91   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   92   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   93   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   95   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   96   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   98   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  100   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  101   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  102   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  103   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  104   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  106   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  107   2.4200   0.0150   0.060000   1.3810   1.2100   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   268.000  1.529
   33    51   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    59   250.000  1.527
   40    41   340.000  1.090
   40    42   317.000  1.510
   40    43   268.000  1.529
   42    45   549.000  1.340
   42    47   317.000  1.510
   45    46   340.000  1.080
   45    54   440.000  1.360
   54    59   320.000  1.380
   59    60   340.000  1.090
   59    65   320.000  1.380
   65    66   320.000  1.380
   66    67   340.000  1.090
   66    68   250.000  1.527
   66    87   320.000  1.380
   68    69   340.000  1.090
   68    70   268.000  1.529
   68    72   320.000  1.410
   70    71   340.000  1.090
   70    73   268.000  1.529
   70    75   320.000  1.410
   73    74   340.000  1.090
   73    78   268.000  1.529
   73    80   320.000  1.410
   78    79   340.000  1.090
   78    87   320.000  1.410
   78    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    97   320.000  1.410
   97   102   214.000  1.327
  102   103   570.000  1.229
  102   104   317.000  1.522
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   340.000  1.090
   80    91   214.000  1.327
   91    92   570.000  1.229
   91    98   317.000  1.522
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
   75    81   214.000  1.327
   81    82   570.000  1.229
   81    93   317.000  1.522
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   340.000  1.090
   72    76   214.000  1.327
   76    77   570.000  1.229
   76    83   317.000  1.522
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    86   340.000  1.090
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   340.000  1.090
   43    44   340.000  1.090
   43    51   268.000  1.529
   43    53   320.000  1.410
   51    52   340.000  1.090
   51    55   320.000  1.410
   55    56   553.000  0.945
   53    57   214.000  1.327
   57    58   570.000  1.229
   57    61   317.000  1.522
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   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  111.63000
   29    33    51    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    59    75.00000  109.43000
   33    51    43    58.35000  112.70000
   33    51    52    37.50000  110.70000
   33    51    55    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    42    70.00000  112.02700
   38    40    43    58.35000  112.70000
   38    59    54    90.00000  108.56700
   38    59    60    45.00000  112.01100
   38    59    65    90.00000  108.56700
   40    38    39    37.50000  110.70000
   40    42    45    70.00000  124.00000
   40    42    47    65.00000  117.92700
   40    43    44    37.50000  110.70000
   40    43    51    58.35000  112.70000
   40    43    53    50.00000  109.50000
   42    40    41    35.00000  109.50000
   42    45    46    35.00000  120.00000
   42    45    54    80.00000  120.01400
   42    47    48    35.00000  109.50000
   42    47    49    35.00000  109.50000
   42    47    50    35.00000  109.50000
   45    54    59    85.00000  113.97000
   54    45    46    55.00000  109.52600
   54    59    60    35.00000  109.50000
   54    59    65    92.60000  111.55000
   59    38    39    45.00000  108.72000
   59    38    40    75.00000  109.43000
   59    65    66   100.00000  109.58800
   65    59    60    35.00000  109.50000
   65    66    67    35.00000  109.50000
   65    66    68    90.00000  108.56700
   65    66    87    92.60000  111.55000
   66    68    69    45.00000  108.72000
   66    68    70    75.00000  109.43000
   66    68    72    90.00000  109.38000
   66    87    78    60.00000  109.50000
   68    66    67    45.00000  112.01100
   68    70    71    37.50000  110.70000
   68    70    73    58.35000  112.70000
   68    70    75    50.00000  109.50000
   68    72    76    83.00000  116.90000
   70    68    69    37.50000  110.70000
   70    73    74    37.50000  110.70000
   70    73    78    58.35000  112.70000
   70    73    80    50.00000  109.50000
   70    75    81    83.00000  116.90000
   73    70    71    37.50000  110.70000
   73    78    79    37.50000  110.70000
   73    78    87    50.00000  109.50000
   73    78    88    58.35000  112.70000
   73    80    91    83.00000  116.90000
   78    73    74    37.50000  110.70000
   78    88    89    37.50000  110.70000
   78    88    90    37.50000  110.70000
   78    88    97    50.00000  109.50000
   87    66    67    35.00000  109.50000
   87    66    68    90.00000  108.56700
   87    78    79    35.00000  109.50000
   88    78    79    37.50000  110.70000
   88    78    87    50.00000  109.50000
   88    97   102    83.00000  116.90000
   90    88    89    33.00000  107.80000
   97    88    89    35.00000  109.50000
   97    88    90    35.00000  109.50000
   97   102   103    83.00000  123.40000
   97   102   104    81.00000  111.40000
  102   104   105    35.00000  109.50000
  102   104   106    35.00000  109.50000
  102   104   107    35.00000  109.50000
  104   102   103    80.00000  120.40000
  106   104   105    33.00000  107.80000
  107   104   105    33.00000  107.80000
  107   104   106    33.00000  107.80000
   80    73    74    35.00000  109.50000
   80    73    78    50.00000  109.50000
   80    91    92    83.00000  123.40000
   80    91    98    81.00000  111.40000
   91    98    99    35.00000  109.50000
   91    98   100    35.00000  109.50000
   91    98   101    35.00000  109.50000
   98    91    92    80.00000  120.40000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
   75    70    71    35.00000  109.50000
   75    70    73    50.00000  109.50000
   75    81    82    83.00000  123.40000
   75    81    93    81.00000  111.40000
   81    93    94    35.00000  109.50000
   81    93    95    35.00000  109.50000
   81    93    96    35.00000  109.50000
   93    81    82    80.00000  120.40000
   95    93    94    33.00000  107.80000
   96    93    94    33.00000  107.80000
   96    93    95    33.00000  107.80000
   72    68    69    35.00000  109.50000
   72    68    70    50.00000  109.50000
   72    76    77    83.00000  123.40000
   72    76    83    81.00000  111.40000
   76    83    84    35.00000  109.50000
   76    83    85    35.00000  109.50000
   76    83    86    35.00000  109.50000
   83    76    77    80.00000  120.40000
   85    83    84    33.00000  107.80000
   86    83    84    33.00000  107.80000
   86    83    85    33.00000  107.80000
   47    42    45    70.00000  124.00000
   49    47    48    33.00000  107.80000
   50    47    48    33.00000  107.80000
   50    47    49    33.00000  107.80000
   43    40    41    37.50000  110.70000
   43    40    42    70.00000  112.02700
   43    51    52    37.50000  110.70000
   43    51    55    50.00000  109.50000
   43    53    57    83.00000  116.90000
   51    33    34    37.50000  110.70000
   51    33    38    58.35000  112.70000
   51    43    44    37.50000  110.70000
   51    55    56    55.00000  108.50000
   55    51    52    35.00000  109.50000
   53    43    44    35.00000  109.50000
   53    43    51    50.00000  109.50000
   53    57    58    83.00000  123.40000
   53    57    61    81.00000  111.40000
   57    61    62    35.00000  109.50000
   57    61    63    35.00000  109.50000
   57    61    64    35.00000  109.50000
   61    57    58    80.00000  120.40000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   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   0.15000  1.0 3.0
   29    33    38    40   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    59   0.44750  1.0 1.0
   29    33    38    59  -0.17800 -1.0 2.0
   29    33    38    59   0.20200  1.0 3.0
   29    33    51    43   0.44750  1.0 1.0
   29    33    51    43  -0.17800 -1.0 2.0
   29    33    51    43   0.20200  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    55   0.56750  1.0 1.0
   29    33    51    55  -0.07550 -1.0 2.0
   29    33    51    55   0.20000  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    42   0.34400  1.0 1.0
   33    38    40    42   0.09450 -1.0 2.0
   33    38    40    42   0.11100  1.0 3.0
   33    38   -40    43   0.56750  1.0 1.0
   33    38   -40    43  -0.07550 -1.0 2.0
   33    38   -40    43   0.20000  1.0 3.0
   33    38    59    54   0.62750  1.0 1.0
   33    38    59    54  -0.30950 -1.0 2.0
   33    38    59    54   0.27300  1.0 3.0
   33    38    59    60   0.15000  1.0 3.0
   33    38    59    65   0.62750  1.0 1.0
   33    38    59    65  -0.30950 -1.0 2.0
   33    38    59    65   0.27300  1.0 3.0
   33    51    55    56  -0.11600  1.0 1.0
   33    51    55    56  -0.09450 -1.0 2.0
   33    51    55    56   0.21250  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    59   0.15000  1.0 3.0
   34    33    51    43   0.15000  1.0 3.0
   34    33    51    52   0.15000  1.0 3.0
   34    33    51    55   0.23400  1.0 3.0
   38    33   -51    43   0.56750  1.0 1.0
   38    33   -51    43  -0.07550 -1.0 2.0
   38    33   -51    43   0.20000  1.0 3.0
   38    33    51    52   0.15000  1.0 3.0
   38    33    51    55   0.86500  1.0 1.0
   38    33    51    55  -0.17500 -1.0 2.0
   38    33    51    55   0.20800  1.0 3.0
   38    40    42    45   0.09850  1.0 1.0
   38    40    42    45   0.15250 -1.0 2.0
   38    40    42    45  -0.50650  1.0 3.0
   38    40    42    47   0.46850  1.0 1.0
   38    40    42    47   0.08550 -1.0 2.0
   38    40    42    47   0.09800  1.0 3.0
   38    40    43    44   0.15000  1.0 3.0
   38    40   -43    51   0.56750  1.0 1.0
   38    40   -43    51  -0.07550 -1.0 2.0
   38    40   -43    51   0.20000  1.0 3.0
   38    40    43    53   0.62750  1.0 1.0
   38    40    43    53  -0.30950 -1.0 2.0
   38    40    43    53   0.27300  1.0 3.0
   38    59    65    66   0.06250  1.0 1.0
   38    59    65    66  -0.01100 -1.0 2.0
   38    59    65    66   0.28050  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    42   0.15000  1.0 3.0
   39    38    40    43   0.15000  1.0 3.0
   39    38    59    54   0.23400  1.0 3.0
   39    38    59    60   0.15000  1.0 3.0
   39    38    59    65   0.23400  1.0 3.0
   40    38    59    54   0.62750  1.0 1.0
   40    38    59    54  -0.30950 -1.0 2.0
   40    38    59    54   0.27300  1.0 3.0
   40    38    59    60   0.15000  1.0 3.0
   40    38    59    65   0.62750  1.0 1.0
   40    38    59    65  -0.30950 -1.0 2.0
   40    38    59    65   0.27300  1.0 3.0
   40    42    45    46   7.00000 -1.0 2.0
   40    42   -45    54   7.00000 -1.0 2.0
   40    42    47    48   0.34800  1.0 3.0
   40    42    47    49   0.34800  1.0 3.0
   40    42    47    50   0.34800  1.0 3.0
   40    43   -51    33   0.56750  1.0 1.0
   40    43   -51    33  -0.07550 -1.0 2.0
   40    43   -51    33   0.20000  1.0 3.0
   40    43    51    52   0.15000  1.0 3.0
   40    43    51    55   0.86500  1.0 1.0
   40    43    51    55  -0.17500 -1.0 2.0
   40    43    51    55   0.20800  1.0 3.0
   40    43    53    57  -0.25900  1.0 1.0
   40    43    53    57  -0.47000 -1.0 2.0
   40    43    53    57   0.11750  1.0 3.0
   41    40    42    45   0.00000  1.0 1.0
   41    40    42    47   0.34800  1.0 3.0
   41    40    43    44   0.15000  1.0 3.0
   41    40    43    51   0.15000  1.0 3.0
   41    40    43    53   0.23400  1.0 3.0
   42    40    43    44   0.15000  1.0 3.0
   42    40    43    51   0.34400  1.0 1.0
   42    40    43    51   0.09450 -1.0 2.0
   42    40    43    51   0.11100  1.0 3.0
   42    40    43    53   0.61850  1.0 1.0
   42    40    43    53  -0.22750 -1.0 2.0
   42    40    43    53   0.15300  1.0 3.0
   42    45    54    59  -2.26850  1.0 1.0
   42    45    54    59   3.39050 -1.0 2.0
   45    42    47    48   0.00000  1.0 1.0
   45    42    47    49   0.00000  1.0 1.0
   45    42    47    50   0.00000  1.0 1.0
   45    54   -59    38  -0.46850  1.0 1.0
   45    54   -59    38   0.09300 -1.0 2.0
   45    54   -59    38  -0.12850  1.0 3.0
   45    54    59    60   0.08050  1.0 3.0
   45    54    59    65  -0.48150  1.0 1.0
   45    54    59    65   0.09250 -1.0 2.0
   45    54    59    65  -0.12850  1.0 3.0
   46    45    54    59   0.50000 -1.0 2.0
   54    59    65    66  -0.53350  1.0 1.0
   54    59    65    66  -0.78350 -1.0 2.0
   54    59    65    66   0.33750  1.0 3.0
   59    38    40    41   0.15000  1.0 3.0
   59    38   -40    42   0.34400  1.0 1.0
   59    38   -40    42   0.09450 -1.0 2.0
   59    38   -40    42   0.11100  1.0 3.0
   59    38    40    43   3.97050  1.0 1.0
   59    65    66    67   0.37050  1.0 3.0
   59    65    66    68   0.06250  1.0 1.0
   59    65    66    68  -0.01100 -1.0 2.0
   59    65    66    68   0.28050  1.0 3.0
   59    65    66    87  -0.53350  1.0 1.0
   59    65    66    87  -0.78350 -1.0 2.0
   59    65    66    87   0.33750  1.0 3.0
   60    59    65    66   0.37050  1.0 3.0
   65    66    68    69   0.23400  1.0 3.0
   65    66    68    70   0.62750  1.0 1.0
   65    66    68    70  -0.30950 -1.0 2.0
   65    66    68    70   0.27300  1.0 3.0
   65    66    68    72   1.11900  1.0 1.0
   65    66    68    72  -1.16350 -1.0 2.0
   65    66    68    72  -0.34150  1.0 3.0
   65    66    87    78  -0.81800  1.0 1.0
   66    68    70    71   0.15000  1.0 3.0
   66    68    70    73   3.97050  1.0 1.0
   66    68    70    75   0.62750  1.0 1.0
   66    68    70    75  -0.30950 -1.0 2.0
   66    68    70    75   0.27300  1.0 3.0
   66    68    72    76  -0.25900  1.0 1.0
   66    68    72    76  -0.47000 -1.0 2.0
   66    68    72    76   0.11750  1.0 3.0
   67    66    68    69   0.15000  1.0 3.0
   67    66    68    70   0.15000  1.0 3.0
   67    66    68    72   0.23400  1.0 3.0
   67    66    87    78   0.37050  1.0 3.0
   68    66    87    78   0.06250  1.0 1.0
   68    66    87    78  -0.01100 -1.0 2.0
   68    66    87    78   0.28050  1.0 3.0
   68    70    73    74   0.15000  1.0 3.0
   68    70   -73    78   0.56750  1.0 1.0
   68    70   -73    78  -0.07550 -1.0 2.0
   68    70   -73    78   0.20000  1.0 3.0
   68    70    73    80   0.62750  1.0 1.0
   68    70    73    80  -0.30950 -1.0 2.0
   68    70    73    80   0.27300  1.0 3.0
   68    70    75    81  -0.25900  1.0 1.0
   68    70    75    81  -0.47000 -1.0 2.0
   68    70    75    81   0.11750  1.0 3.0
   68    72    76    77   3.00000 -1.0 2.0
   68    72    76    83   1.63150  1.0 1.0
   68    72    76    83   2.92000 -1.0 2.0
   69    68    70    71   0.15000  1.0 3.0
   69    68    70    73   0.15000  1.0 3.0
   69    68    70    75   0.23400  1.0 3.0
   69    68    72    76   0.08050  1.0 3.0
   70    68    72    76  -0.25900  1.0 1.0
   70    68    72    76  -0.47000 -1.0 2.0
   70    68    72    76   0.11750  1.0 3.0
   70    73    78    79   0.15000  1.0 3.0
   70    73    78    87   0.62750  1.0 1.0
   70    73    78    87  -0.30950 -1.0 2.0
   70    73    78    87   0.27300  1.0 3.0
   70    73    78    88   0.56750  1.0 1.0
   70    73    78    88  -0.07550 -1.0 2.0
   70    73    78    88   0.20000  1.0 3.0
   70    73    80    91  -0.25900  1.0 1.0
   70    73    80    91  -0.47000 -1.0 2.0
   70    73    80    91   0.11750  1.0 3.0
   70    75    81    82   3.00000 -1.0 2.0
   70    75    81    93   1.63150  1.0 1.0
   70    75    81    93   2.92000 -1.0 2.0
   71    70    73    74   0.15000  1.0 3.0
   71    70    73    78   0.15000  1.0 3.0
   71    70    73    80   0.23400  1.0 3.0
   71    70    75    81   0.08050  1.0 3.0
   73    70    75    81  -0.25900  1.0 1.0
   73    70    75    81  -0.47000 -1.0 2.0
   73    70    75    81   0.11750  1.0 3.0
   73    78   -87    66   0.06250  1.0 1.0
   73    78   -87    66  -0.01100 -1.0 2.0
   73    78   -87    66   0.28050  1.0 3.0
   73    78    88    89   0.15000  1.0 3.0
   73    78    88    90   0.15000  1.0 3.0
   73    78    88    97   0.62750  1.0 1.0
   73    78    88    97  -0.30950 -1.0 2.0
   73    78    88    97   0.27300  1.0 3.0
   73    80    91    92   3.00000 -1.0 2.0
   73    80    91    98   1.63150  1.0 1.0
   73    80    91    98   2.92000 -1.0 2.0
   74    73    78    79   0.15000  1.0 3.0
   74    73    78    87   0.23400  1.0 3.0
   74    73    78    88   0.15000  1.0 3.0
   74    73    80    91   0.08050  1.0 3.0
   78    73    80    91  -0.25900  1.0 1.0
   78    73    80    91  -0.47000 -1.0 2.0
   78    73    80    91   0.11750  1.0 3.0
   78    88    97   102  -0.25900  1.0 1.0
   78    88    97   102  -0.47000 -1.0 2.0
   78    88    97   102   0.11750  1.0 3.0
   79    78    87    66   0.37050  1.0 3.0
   79    78    88    89   0.15000  1.0 3.0
   79    78    88    90   0.15000  1.0 3.0
   79    78    88    97   0.23400  1.0 3.0
   87    66    68    69   0.23400  1.0 3.0
   87    66   -68    70   0.62750  1.0 1.0
   87    66   -68    70  -0.30950 -1.0 2.0
   87    66   -68    70   0.27300  1.0 3.0
   87    66    68    72   1.11900  1.0 1.0
   87    66    68    72  -1.16350 -1.0 2.0
   87    66    68    72  -0.34150  1.0 3.0
   87    78    88    89   0.23400  1.0 3.0
   87    78    88    90   0.23400  1.0 3.0
   87    78    88    97   1.11900  1.0 1.0
   87    78    88    97  -1.16350 -1.0 2.0
   87    78    88    97  -0.34150  1.0 3.0
   88    78    87    66   0.06250  1.0 1.0
   88    78    87    66  -0.01100 -1.0 2.0
   88    78    87    66   0.28050  1.0 3.0
   88    97   102   103   3.00000 -1.0 2.0
   88    97   102   104   1.63150  1.0 1.0
   88    97   102   104   2.92000 -1.0 2.0
   89    88    97   102   0.08050  1.0 3.0
   90    88    97   102   0.08050  1.0 3.0
   97   102   104   105   0.00000  1.0 1.0
   97   102   104   106   0.00000  1.0 1.0
   97   102   104   107   0.00000  1.0 1.0
  103   102   104   105   0.00000  1.0 1.0
  103   102   104   106   0.00000  1.0 1.0
  103   102   104   107   0.00000  1.0 1.0
   80    73    78    79   0.23400  1.0 3.0
   80    73    78    87   1.11900  1.0 1.0
   80    73    78    87  -1.16350 -1.0 2.0
   80    73    78    87  -0.34150  1.0 3.0
   80    73    78    88   0.62750  1.0 1.0
   80    73    78    88  -0.30950 -1.0 2.0
   80    73    78    88   0.27300  1.0 3.0
   80    91    98    99   0.00000  1.0 1.0
   80    91    98   100   0.00000  1.0 1.0
   80    91    98   101   0.00000  1.0 1.0
   92    91    98    99   0.00000  1.0 1.0
   92    91    98   100   0.00000  1.0 1.0
   92    91    98   101   0.00000  1.0 1.0
   75    70    73    74   0.23400  1.0 3.0
   75    70    73    78   0.62750  1.0 1.0
   75    70    73    78  -0.30950 -1.0 2.0
   75    70    73    78   0.27300  1.0 3.0
   75    70    73    80   1.11900  1.0 1.0
   75    70    73    80  -1.16350 -1.0 2.0
   75    70    73    80  -0.34150  1.0 3.0
   75    81    93    94   0.00000  1.0 1.0
   75    81    93    95   0.00000  1.0 1.0
   75    81    93    96   0.00000  1.0 1.0
   82    81    93    94   0.00000  1.0 1.0
   82    81    93    95   0.00000  1.0 1.0
   82    81    93    96   0.00000  1.0 1.0
   72    68    70    71   0.23400  1.0 3.0
   72    68    70    73   0.62750  1.0 1.0
   72    68    70    73  -0.30950 -1.0 2.0
   72    68    70    73   0.27300  1.0 3.0
   72    68    70    75   1.11900  1.0 1.0
   72    68    70    75  -1.16350 -1.0 2.0
   72    68    70    75  -0.34150  1.0 3.0
   72    76    83    84   0.00000  1.0 1.0
   72    76    83    85   0.00000  1.0 1.0
   72    76    83    86   0.00000  1.0 1.0
   77    76    83    84   0.00000  1.0 1.0
   77    76    83    85   0.00000  1.0 1.0
   77    76    83    86   0.00000  1.0 1.0
   47    42    45    46   7.00000 -1.0 2.0
   47    42    45    54   7.00000 -1.0 2.0
   43    40    42    45   0.09850  1.0 1.0
   43    40    42    45   0.15250 -1.0 2.0
   43    40    42    45  -0.50650  1.0 3.0
   43    40    42    47   0.46850  1.0 1.0
   43    40    42    47   0.08550 -1.0 2.0
   43    40    42    47   0.09800  1.0 3.0
   43    51    55    56  -0.11600  1.0 1.0
   43    51    55    56  -0.09450 -1.0 2.0
   43    51    55    56   0.21250  1.0 3.0
   43    53    57    58   3.00000 -1.0 2.0
   43    53    57    61   1.63150  1.0 1.0
   43    53    57    61   2.92000 -1.0 2.0
   44    43    51    33   0.15000  1.0 3.0
   44    43    51    52   0.15000  1.0 3.0
   44    43    51    55   0.23400  1.0 3.0
   44    43    53    57   0.08050  1.0 3.0
   51    33    38    39   0.15000  1.0 3.0
   51    33   -38    40   0.56750  1.0 1.0
   51    33   -38    40  -0.07550 -1.0 2.0
   51    33   -38    40   0.20000  1.0 3.0
   51    33    38    59   3.97050  1.0 1.0
   51    43    53    57  -0.25900  1.0 1.0
   51    43    53    57  -0.47000 -1.0 2.0
   51    43    53    57   0.11750  1.0 3.0
   52    51    55    56   0.19450  1.0 3.0
   53    43    51    33   0.62750  1.0 1.0
   53    43    51    33  -0.30950 -1.0 2.0
   53    43    51    33   0.27300  1.0 3.0
   53    43    51    52   0.23400  1.0 3.0
   53    43    51    55   3.69350  1.0 1.0
   53    43    51    55  -1.82950 -1.0 2.0
   53    57    61    62   0.00000  1.0 1.0
   53    57    61    63   0.00000  1.0 1.0
   53    57    61    64   0.00000  1.0 1.0
   58    57    61    62   0.00000  1.0 1.0
   58    57    61    63   0.00000  1.0 1.0
   58    57    61    64   0.00000  1.0 1.0
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
   40    47    42    45   1.10000 -1.0 2.0
   54    46    45    42   1.10000 -1.0 2.0
   97   104   102   103  10.50000 -1.0 2.0
   80    98    91    92  10.50000 -1.0 2.0
   75    93    81    82  10.50000 -1.0 2.0
   72    83    76    77  10.50000 -1.0 2.0
   53    61    57    58  10.50000 -1.0 2.0
END
