* LIGAND DATABASE FILE (OPLS2005)
*
001     105   107    195    277     554
    1     0 S   NP   _N1_     1    28.80091    94.14245   -21.24591
    2     1 S   H    _HN1     2     1.02829    31.30402   163.02317
    3     1 S   H    _H1_     3     1.02774    92.43642   -75.47318
    4     1 S   H    _H2_     4     1.02943    87.17494    32.87143
    5     1 S   CT   _CA1     5     1.50142   141.65476   152.83601
    6     5 S   HC   _HA1     6     1.09578   105.12470    64.74813
    7     5 S   CO3  _C1_     7     1.53782   112.56309   -55.25386
    8     7 S   O2Z  _O11     8     1.26376   114.95492   -37.43131
    9     7 S   O2Z  _O12     9     1.26231   115.00754   141.59536
   10     5 S   CT   _CB1    10     1.53122   107.41467  -177.28423
   11    10 S   HC   HB11    11     1.09810   109.23158   -48.85258
   12    10 S   HC   HB12    12     1.09810   110.55159    67.82471
   13    10 S   CT   _CG1    13     1.52929   112.50734  -169.90048
   14    13 S   HC   HG11    14     1.09593   110.43309   -66.38468
   15    13 S   HC   HG12    15     1.09582   109.59869    52.78048
   16    13 S   C    _CD1    16     1.51794   112.64325   172.41330
   17    16 S   O    _OE1    17     1.22724   123.27453    -7.18753
   18    16 S   N    _N2_    18     1.38659   111.64715   173.58650
   19    18 S   H    _HN2    19     1.01529   118.94240    -1.03363
   20    18 S   CT1  _CA2    20     1.46263   123.49590   179.56749
   21    20 S   HC   _HA2    21     1.09708   109.33446   -10.13613
   22    20 S   C    _C2_    22     1.53304   108.12519  -126.06275
   23    22 S   O    _O2_    23     1.23026   122.37444  -146.98908
   24    20 S   CT   _CB2    32     1.53396   111.67008   112.02650
   25    24 S   HC   HB21    33     1.09316   109.33569    62.38076
   26    24 S   HC   HB22    34     1.09523   110.57562  -179.73459
   27    22 S   N    _N3_    24     1.38336   113.48719    40.22679
   28    27 S   H    _HN3    25     1.01656   119.50141    -4.36529
   29    24 S   S    _SG2    35     1.82454   111.28702   -59.95380
   30    27 S   CT   _CA3    26     1.45242   123.02632   177.48838
   31    30 S   HC   HA31    27     1.09555   107.88856   -54.39957
   32    30 S   HC   HA32    28     1.09564   107.59497    62.04151
   33    29 S   CT   _C11    36     1.82821   100.39144   148.51152
   34    33 S   HC   _H6_    37     1.09374   105.04190    66.95150
   35    30 S   CO3  _C3_    29     1.52823   114.07707  -176.62298
   36    35 S   O2Z  _O31    30     1.26344   116.01007    -8.47355
   37    35 S   O2Z  _O32    31     1.26412   114.46352   171.98127
   38    33 S   CM   _C12    38     1.52029   110.42602  -174.10282
   39    33 S   OS   _O33    51     1.43039   115.70131   -46.82751
   40    38 S   CT   _C8_    39     1.52536   115.29940    87.48922
   41    40 S   HC   _H3_    40     1.10200   108.44738   146.78873
   42    38 S   CMA  _C13    99     1.36902   122.88020   -94.33684
   43    42 S   OM   _O34   100     1.26983   125.37677  -178.41132
   44    40 S   CT   _C7_    41     1.54008   114.36997   -94.34724
   45    44 S   HC   _H16    42     1.09292   113.96453    32.91574
   46    44 S   HC   _H17    43     1.09496   110.74957   -89.60362
   47    42 S   OS   _O35   101     1.41963   111.72085     0.89787
   48    44 S   CM   _C6_    44     1.49179   102.66413   151.88833
   49    48 S   HC   _H15    45     1.08096   123.27560   166.27742
   50    47 S   CT   _C14   102     1.42723   114.15373   140.56602
   51    50 S   HC   _H18   103     1.09404   107.75138  -171.20460
   52    50 S   HC   _H19   104     1.09478   111.03046    70.86597
   53    50 S   HC   _H20   105     1.09540   111.11001   -53.04359
   54    48 S   CM   _C5_    46     1.33851   112.06269   -14.70982
   55    40 S   CT   _C9_    47     1.54594   115.86465    29.01137
   56    55 S   HC   _H4_    48     1.09858   108.55111    93.29388
   57    54 S   CT   _C4_    95     1.48748   126.22273  -179.89532
   58    57 S   HC   _H12    96     1.09386   110.77533   113.63955
   59    57 S   HC   _H13    97     1.09483   111.51557    -6.40649
   60    57 S   HC   _H14    98     1.09439   110.35155  -126.03144
   61    55 S   CO   _C10    49     1.53162   114.67909   -29.85684
   62    61 S   HC   _H5_    50     1.09606   111.50017   -79.12590
   63    61 S   OS   _O36    52     1.43470   106.60413   162.70186
   64    63 S   CO   _C15    53     1.43142   114.03157   170.54242
   65    64 S   HC   _H7_    54     1.09681   109.73801    38.43606
   66    64 S   CT   _C16    55     1.53262   106.61720   157.29639
   67    66 S   HC   _H8_    56     1.09794   110.59751    53.82846
   68    66 S   CT   _C17    57     1.52915   110.88040   175.01850
   69    68 S   HC   _H9_    58     1.09801   110.95884    70.99916
   70    66 S   OS   _O44    88     1.44788   108.31726   -67.11328
   71    68 S   CT   _C18    59     1.53223   110.95235   -51.02111
   72    71 S   HC   _H10    60     1.09821   109.42659   -70.26303
   73    68 S   OS   _O42    81     1.44949   108.39996  -168.85883
   74    70 S   CO4  _C27    89     1.36174   118.09860   101.71623
   75    74 S   O    _O45    90     1.22290   126.68643     1.42161
   76    71 S   CT   _C19    61     1.53855   110.72117    50.35990
   77    76 S   HC   _H11    62     1.09837   109.70789    67.01735
   78    71 S   OS   _O40    74     1.44585   107.81466   169.24046
   79    73 S   CO4  _C25    82     1.36167   118.17688   -97.52273
   80    79 S   O    _O43    83     1.22291   126.59625     0.07402
   81    74 S   CT   _C28    91     1.49836   109.33129  -178.69134
   82    81 S   HC   _H32    92     1.09295   109.82293   -60.81800
   83    81 S   HC   _H33    93     1.09376   109.37209  -179.87489
   84    81 S   HC   _H34    94     1.09296   109.79878    61.09145
   85    64 S   OS   _O37    63     1.42727   110.26653   -82.76213
   86    76 S   CT   _C20    64     1.53459   111.79086  -172.98737
   87    86 S   HC   _H21    65     1.09430   109.56195   176.30626
   88    86 S   HC   _H22    66     1.09754   109.94490    58.27293
   89    78 S   CO4  _C23    75     1.36197   118.08983    99.24463
   90    89 S   O    _O41    76     1.22291   126.62436    -0.00000
   91    79 S   CT   _C26    84     1.49830   109.38461  -179.98022
   92    91 S   HC   _H29    85     1.09289   109.80816   -61.48800
   93    91 S   HC   _H30    86     1.09377   109.36953   179.44152
   94    91 S   HC   _H31    87     1.09298   109.82013    60.41833
   95    86 S   OS   _O38    67     1.43209   110.76049   -63.54116
   96    89 S   CT   _C24    77     1.49839   109.38019  -179.59895
   97    96 S   HC   _H26    78     1.09285   109.91508   -57.53788
   98    96 S   HC   _H27    79     1.09374   109.36354  -176.42204
   99    96 S   HC   _H28    80     1.09279   109.76060    64.34655
  100    95 S   CO4  _C21    68     1.36265   115.41804   176.35433
  101   100 S   O    _O39    69     1.22383   126.14982     1.08840
  102   100 S   CT   _C22    70     1.49864   109.89606  -176.27527
  103   102 S   HC   _H23    71     1.09342   109.28754  -151.95703
  104   102 S   HC   _H24    72     1.09237   109.48536    87.52877
  105   102 S   HC   _H25    73     1.09327   110.49014   -33.49324
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   7   5   4   3
  13   5   2   1   1  15   9  16   9   8   2   9   5   4   4   9
   3   3   2   1   1   9   9   4   4   2   1   1   6   2   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    40    61    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    44    55    61    62    39    63    42    43    47  
   38    40    61    39    42  
   36    37  
   37  
    0  
   40    41    44    45    46    48    54    55    56    61    39    42    43    47    50  
   63    64    42    40    54    55    56    61    62  
   41    44    45    46    48    49    54    55    56    61    62    63    57    42    43    47  
   44    45    46    48    54    55    56    61    42  
   43    47    50    51    52    53    44    55  
   47    50  
   45    46    48    49    54    55    56    61    57  
   46    48    49    54    55  
   48    49    54    55  
   50    51    52    53  
   49    54    55    56    61    57    58    59    60  
   54    55    57  
   51    52    53  
   52    53  
   53  
    0  
   55    56    61    62    63    57    58    59    60  
   56    61    62    63    64    57    58    59    60  
   61    62    63    57  
   58    59    60    61  
   59    60  
   60  
    0  
   62    63    64    65    66    85  
   63    64  
   64    65    66    67    68    76    85    70  
   65    66    67    68    69    71    76    77    85    86    73    70    74  
   66    67    68    76    85    70  
   67    68    69    71    72    76    85    78    73    79    70    74    75    81  
   68    69    71    85    73    70    74  
   69    71    72    76    77    85    86    78    89    73    79    80    91    70    74  
   71    72    76    78    73    79    70  
   74    75    81    82    83    84    71    73    85  
   72    76    77    85    86    87    88    95    78    89    90    96    73    79  
   76    77    85    86    78    89    73  
   79    80    91    92    93    94    76    78  
   75    81    82    83    84  
   81    82    83    84  
   77    85    86    87    88    95   100    78    89  
   85    86    87    88    95    78  
   89    90    96    97    98    99    85    86  
   80    91    92    93    94  
   91    92    93    94  
   82    83    84  
   83    84  
   84  
    0  
   86    87    88    95  
   87    88    95   100   101   102  
   88    95   100  
   95   100  
   90    96    97    98    99  
   96    97    98    99  
   92    93    94  
   93    94  
   94  
    0  
  100   101   102   103   104   105  
   97    98    99  
   98    99  
   99  
    0  
  101   102   103   104   105  
  102   103   104   105  
  103   104   105  
  104   105  
  105  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.316400   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.387900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   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  -0.670200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   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   0.460100   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  -0.120000   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   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   63   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   64   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.4200   0.0150   0.030000   1.3810   1.2100   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   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   71   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   73   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   74   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   76   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   78   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   79   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   80   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   81   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   83   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   84   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   85   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   86   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   88   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   89   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   90   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   91   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   93   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   94   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   95   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   96   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   99   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  100   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  102   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  104   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  105   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   317.000  1.510
   33    39   320.000  1.410
   38    40   317.000  1.510
   38    42   465.000  1.376
   40    41   340.000  1.090
   40    44   268.000  1.529
   40    55   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    48   317.000  1.510
   48    49   340.000  1.080
   48    54   549.000  1.340
   54    55   317.000  1.510
   54    57   317.000  1.510
   55    56   340.000  1.090
   55    61   250.000  1.527
   61    62   340.000  1.090
   61    39   320.000  1.380
   61    63   320.000  1.380
   63    64   320.000  1.380
   64    65   340.000  1.090
   64    66   250.000  1.527
   64    85   320.000  1.380
   66    67   340.000  1.090
   66    68   268.000  1.529
   66    70   320.000  1.410
   68    69   340.000  1.090
   68    71   268.000  1.529
   68    73   320.000  1.410
   71    72   340.000  1.090
   71    76   268.000  1.529
   71    78   320.000  1.410
   76    77   340.000  1.090
   76    85   320.000  1.410
   76    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    95   320.000  1.410
   95   100   214.000  1.327
  100   101   570.000  1.229
  100   102   317.000  1.522
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   340.000  1.090
   78    89   214.000  1.327
   89    90   570.000  1.229
   89    96   317.000  1.522
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   340.000  1.090
   73    79   214.000  1.327
   79    80   570.000  1.229
   79    91   317.000  1.522
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   340.000  1.090
   70    74   214.000  1.327
   74    75   570.000  1.229
   74    81   317.000  1.522
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   42    43   745.000  1.250
   42    47   440.000  1.360
   47    50   320.000  1.410
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   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    39    85.00000  114.68000
   33    38    40    65.00000  117.92700
   33    38    42    70.00000  124.00000
   33    39    61    60.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  109.50000
   38    40    44    70.00000  112.02700
   38    40    55    70.00000  112.02700
   38    42    43    65.00000  137.10300
   38    42    47    80.00000  120.01400
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    48    70.00000  112.02700
   40    55    54    70.00000  112.02700
   40    55    56    37.50000  110.70000
   40    55    61    75.00000  109.43000
   44    40    41    37.50000  110.70000
   44    48    49    35.00000  117.00000
   44    48    54    70.00000  124.00000
   46    44    45    33.00000  107.80000
   48    44    45    35.00000  109.50000
   48    44    46    35.00000  109.50000
   48    54    55    70.00000  124.00000
   48    54    57    70.00000  124.00000
   54    48    49    35.00000  120.00000
   54    55    56    35.00000  109.50000
   54    55    61    70.00000  112.02700
   54    57    58    35.00000  109.50000
   54    57    59    35.00000  109.50000
   54    57    60    35.00000  109.50000
   55    40    41    37.50000  110.70000
   55    40    44    58.35000  112.70000
   55    61    62    45.00000  112.01100
   55    61    39    90.00000  108.56700
   55    61    63    90.00000  108.56700
   61    55    56    45.00000  108.72000
   61    63    64   100.00000  109.58800
   39    33    34    35.00000  109.50000
   39    33    38    85.00000  110.90400
   39    61    62    35.00000  109.50000
   63    61    62    35.00000  109.50000
   63    61    39    92.60000  111.55000
   63    64    65    35.00000  109.50000
   63    64    66    90.00000  108.56700
   63    64    85    92.60000  111.55000
   64    66    67    45.00000  108.72000
   64    66    68    75.00000  109.43000
   64    66    70    90.00000  109.38000
   64    85    76    60.00000  109.50000
   66    64    65    45.00000  112.01100
   66    68    69    37.50000  110.70000
   66    68    71    58.35000  112.70000
   66    68    73    50.00000  109.50000
   66    70    74    83.00000  116.90000
   68    66    67    37.50000  110.70000
   68    71    72    37.50000  110.70000
   68    71    76    58.35000  112.70000
   68    71    78    50.00000  109.50000
   68    73    79    83.00000  116.90000
   71    68    69    37.50000  110.70000
   71    76    77    37.50000  110.70000
   71    76    85    50.00000  109.50000
   71    76    86    58.35000  112.70000
   71    78    89    83.00000  116.90000
   76    71    72    37.50000  110.70000
   76    86    87    37.50000  110.70000
   76    86    88    37.50000  110.70000
   76    86    95    50.00000  109.50000
   85    64    65    35.00000  109.50000
   85    64    66    90.00000  108.56700
   85    76    77    35.00000  109.50000
   86    76    77    37.50000  110.70000
   86    76    85    50.00000  109.50000
   86    95   100    83.00000  116.90000
   88    86    87    33.00000  107.80000
   95    86    87    35.00000  109.50000
   95    86    88    35.00000  109.50000
   95   100   101    83.00000  123.40000
   95   100   102    81.00000  111.40000
  100   102   103    35.00000  109.50000
  100   102   104    35.00000  109.50000
  100   102   105    35.00000  109.50000
  102   100   101    80.00000  120.40000
  104   102   103    33.00000  107.80000
  105   102   103    33.00000  107.80000
  105   102   104    33.00000  107.80000
   78    71    72    35.00000  109.50000
   78    71    76    50.00000  109.50000
   78    89    90    83.00000  123.40000
   78    89    96    81.00000  111.40000
   89    96    97    35.00000  109.50000
   89    96    98    35.00000  109.50000
   89    96    99    35.00000  109.50000
   96    89    90    80.00000  120.40000
   98    96    97    33.00000  107.80000
   99    96    97    33.00000  107.80000
   99    96    98    33.00000  107.80000
   73    68    69    35.00000  109.50000
   73    68    71    50.00000  109.50000
   73    79    80    83.00000  123.40000
   73    79    91    81.00000  111.40000
   79    91    92    35.00000  109.50000
   79    91    93    35.00000  109.50000
   79    91    94    35.00000  109.50000
   91    79    80    80.00000  120.40000
   93    91    92    33.00000  107.80000
   94    91    92    33.00000  107.80000
   94    91    93    33.00000  107.80000
   70    66    67    35.00000  109.50000
   70    66    68    50.00000  109.50000
   70    74    75    83.00000  123.40000
   70    74    81    81.00000  111.40000
   74    81    82    35.00000  109.50000
   74    81    83    35.00000  109.50000
   74    81    84    35.00000  109.50000
   81    74    75    80.00000  120.40000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   57    54    55    65.00000  117.92700
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   42    38    40    70.00000  124.00000
   42    47    50    90.00000  111.18400
   47    42    43    65.00000  121.00000
   47    50    51    35.00000  109.50000
   47    50    52    35.00000  109.50000
   47    50    53    35.00000  109.50000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    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    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  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    40   0.30250  1.0 1.0
   29    33    38    40  -0.14950 -1.0 2.0
   29    33    38    40   0.36900  1.0 3.0
   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    39    61   0.14700  1.0 1.0
   29    33    39    61  -1.16150 -1.0 2.0
   29    33    39    61   0.48700  1.0 3.0
   33    38    40    41   0.34800  1.0 3.0
   33    38    40    44   0.46850  1.0 1.0
   33    38    40    44   0.08550 -1.0 2.0
   33    38    40    44   0.09800  1.0 3.0
   33    38    40    55   0.46850  1.0 1.0
   33    38    40    55   0.08550 -1.0 2.0
   33    38    40    55   0.09800  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    47   7.00000 -1.0 2.0
   34    33    38    40   0.34800  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    39    61   0.37050  1.0 3.0
   38    33    39    61  -0.77900  1.0 1.0
   38    33    39    61  -0.36900 -1.0 2.0
   38    33    39    61   0.40400  1.0 3.0
   38    40    44    45   0.15000  1.0 3.0
   38    40    44    46   0.15000  1.0 3.0
   38    40    44    48   0.31000  1.0 1.0
   38    40    44    48   0.14700 -1.0 2.0
   38    40    44    48   0.07550  1.0 3.0
   38    40    55    54   0.31000  1.0 1.0
   38    40    55    54   0.14700 -1.0 2.0
   38    40    55    54   0.07550  1.0 3.0
   38    40    55    56   0.15000  1.0 3.0
   38    40   -55    61   0.34400  1.0 1.0
   38    40   -55    61   0.09450 -1.0 2.0
   38    40   -55    61   0.11100  1.0 3.0
   38    42    47    50  -2.26850  1.0 1.0
   38    42    47    50   3.39050 -1.0 2.0
   40    38    42    43   7.00000 -1.0 2.0
   40    38    42    47   7.00000 -1.0 2.0
   40    44    48    49   0.00000  1.0 1.0
   40    44   -48    54   0.09850  1.0 1.0
   40    44   -48    54   0.15250 -1.0 2.0
   40    44   -48    54  -0.50650  1.0 3.0
   40    55    61    62   0.15000  1.0 3.0
   40    55    61    39   0.62750  1.0 1.0
   40    55    61    39  -0.30950 -1.0 2.0
   40    55    61    39   0.27300  1.0 3.0
   40    55    61    63   0.62750  1.0 1.0
   40    55    61    63  -0.30950 -1.0 2.0
   40    55    61    63   0.27300  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    48   0.15000  1.0 3.0
   41    40    55    54   0.15000  1.0 3.0
   41    40    55    56   0.15000  1.0 3.0
   41    40    55    61   0.15000  1.0 3.0
   44    40   -55    54   0.34400  1.0 1.0
   44    40   -55    54   0.09450 -1.0 2.0
   44    40   -55    54   0.11100  1.0 3.0
   44    40    55    56   0.15000  1.0 3.0
   44    40    55    61   3.97050  1.0 1.0
   44    48   -54    55   7.00000 -1.0 2.0
   44    48    54    57   7.00000 -1.0 2.0
   45    44    48    49   0.33100  1.0 3.0
   45    44    48    54   0.00000  1.0 1.0
   46    44    48    49   0.33100  1.0 3.0
   46    44    48    54   0.00000  1.0 1.0
   48    54   -55    40   0.09850  1.0 1.0
   48    54   -55    40   0.15250 -1.0 2.0
   48    54   -55    40  -0.50650  1.0 3.0
   48    54    55    56   0.00000  1.0 1.0
   48    54    55    61   0.09850  1.0 1.0
   48    54    55    61   0.15250 -1.0 2.0
   48    54    55    61  -0.50650  1.0 3.0
   48    54    57    58   0.00000  1.0 1.0
   48    54    57    59   0.00000  1.0 1.0
   48    54    57    60   0.00000  1.0 1.0
   49    48    54    55   7.00000 -1.0 2.0
   49    48    54    57   7.00000 -1.0 2.0
   54    55    61    62   0.15000  1.0 3.0
   54    55    61    39   0.61850  1.0 1.0
   54    55    61    39  -0.22750 -1.0 2.0
   54    55    61    39   0.15300  1.0 3.0
   54    55    61    63   0.61850  1.0 1.0
   54    55    61    63  -0.22750 -1.0 2.0
   54    55    61    63   0.15300  1.0 3.0
   55    40    44    45   0.15000  1.0 3.0
   55    40    44    46   0.15000  1.0 3.0
   55    40   -44    48   0.34400  1.0 1.0
   55    40   -44    48   0.09450 -1.0 2.0
   55    40   -44    48   0.11100  1.0 3.0
   55    54    57    58   0.34800  1.0 3.0
   55    54    57    59   0.34800  1.0 3.0
   55    54    57    60   0.34800  1.0 3.0
   55    61   -39    33   0.06250  1.0 1.0
   55    61   -39    33  -0.01100 -1.0 2.0
   55    61   -39    33   0.28050  1.0 3.0
   55    61    63    64   0.06250  1.0 1.0
   55    61    63    64  -0.01100 -1.0 2.0
   55    61    63    64   0.28050  1.0 3.0
   56    55    61    62   0.15000  1.0 3.0
   56    55    61    39   0.23400  1.0 3.0
   56    55    61    63   0.23400  1.0 3.0
   61    63    64    65   0.37050  1.0 3.0
   61    63    64    66   0.06250  1.0 1.0
   61    63    64    66  -0.01100 -1.0 2.0
   61    63    64    66   0.28050  1.0 3.0
   61    63    64    85  -0.53350  1.0 1.0
   61    63    64    85  -0.78350 -1.0 2.0
   61    63    64    85   0.33750  1.0 3.0
   62    61    39    33   0.37050  1.0 3.0
   62    61    63    64   0.37050  1.0 3.0
   39    33   -38    40   0.09700  1.0 1.0
   39    33   -38    40   0.15600 -1.0 2.0
   39    33   -38    40  -0.50800  1.0 3.0
   39    33    38    42   0.39000  1.0 1.0
   39    33    38    42  -0.05800 -1.0 2.0
   39    33    38    42  -0.55150  1.0 3.0
   39    61    63    64  -0.53350  1.0 1.0
   39    61    63    64  -0.78350 -1.0 2.0
   39    61    63    64   0.33750  1.0 3.0
   63    61    39    33  -0.81800  1.0 1.0
   63    64    66    67   0.23400  1.0 3.0
   63    64    66    68   0.62750  1.0 1.0
   63    64    66    68  -0.30950 -1.0 2.0
   63    64    66    68   0.27300  1.0 3.0
   63    64    66    70   1.11900  1.0 1.0
   63    64    66    70  -1.16350 -1.0 2.0
   63    64    66    70  -0.34150  1.0 3.0
   63    64    85    76  -0.81800  1.0 1.0
   64    66    68    69   0.15000  1.0 3.0
   64    66    68    71   3.97050  1.0 1.0
   64    66    68    73   0.62750  1.0 1.0
   64    66    68    73  -0.30950 -1.0 2.0
   64    66    68    73   0.27300  1.0 3.0
   64    66    70    74  -0.25900  1.0 1.0
   64    66    70    74  -0.47000 -1.0 2.0
   64    66    70    74   0.11750  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    70   0.23400  1.0 3.0
   65    64    85    76   0.37050  1.0 3.0
   66    64    85    76   0.06250  1.0 1.0
   66    64    85    76  -0.01100 -1.0 2.0
   66    64    85    76   0.28050  1.0 3.0
   66    68    71    72   0.15000  1.0 3.0
   66    68   -71    76   0.56750  1.0 1.0
   66    68   -71    76  -0.07550 -1.0 2.0
   66    68   -71    76   0.20000  1.0 3.0
   66    68    71    78   0.62750  1.0 1.0
   66    68    71    78  -0.30950 -1.0 2.0
   66    68    71    78   0.27300  1.0 3.0
   66    68    73    79  -0.25900  1.0 1.0
   66    68    73    79  -0.47000 -1.0 2.0
   66    68    73    79   0.11750  1.0 3.0
   66    70    74    75   3.00000 -1.0 2.0
   66    70    74    81   1.63150  1.0 1.0
   66    70    74    81   2.92000 -1.0 2.0
   67    66    68    69   0.15000  1.0 3.0
   67    66    68    71   0.15000  1.0 3.0
   67    66    68    73   0.23400  1.0 3.0
   67    66    70    74   0.08050  1.0 3.0
   68    66    70    74  -0.25900  1.0 1.0
   68    66    70    74  -0.47000 -1.0 2.0
   68    66    70    74   0.11750  1.0 3.0
   68    71    76    77   0.15000  1.0 3.0
   68    71    76    85   0.62750  1.0 1.0
   68    71    76    85  -0.30950 -1.0 2.0
   68    71    76    85   0.27300  1.0 3.0
   68    71    76    86   0.56750  1.0 1.0
   68    71    76    86  -0.07550 -1.0 2.0
   68    71    76    86   0.20000  1.0 3.0
   68    71    78    89  -0.25900  1.0 1.0
   68    71    78    89  -0.47000 -1.0 2.0
   68    71    78    89   0.11750  1.0 3.0
   68    73    79    80   3.00000 -1.0 2.0
   68    73    79    91   1.63150  1.0 1.0
   68    73    79    91   2.92000 -1.0 2.0
   69    68    71    72   0.15000  1.0 3.0
   69    68    71    76   0.15000  1.0 3.0
   69    68    71    78   0.23400  1.0 3.0
   69    68    73    79   0.08050  1.0 3.0
   71    68    73    79  -0.25900  1.0 1.0
   71    68    73    79  -0.47000 -1.0 2.0
   71    68    73    79   0.11750  1.0 3.0
   71    76   -85    64   0.06250  1.0 1.0
   71    76   -85    64  -0.01100 -1.0 2.0
   71    76   -85    64   0.28050  1.0 3.0
   71    76    86    87   0.15000  1.0 3.0
   71    76    86    88   0.15000  1.0 3.0
   71    76    86    95   0.62750  1.0 1.0
   71    76    86    95  -0.30950 -1.0 2.0
   71    76    86    95   0.27300  1.0 3.0
   71    78    89    90   3.00000 -1.0 2.0
   71    78    89    96   1.63150  1.0 1.0
   71    78    89    96   2.92000 -1.0 2.0
   72    71    76    77   0.15000  1.0 3.0
   72    71    76    85   0.23400  1.0 3.0
   72    71    76    86   0.15000  1.0 3.0
   72    71    78    89   0.08050  1.0 3.0
   76    71    78    89  -0.25900  1.0 1.0
   76    71    78    89  -0.47000 -1.0 2.0
   76    71    78    89   0.11750  1.0 3.0
   76    86    95   100  -0.25900  1.0 1.0
   76    86    95   100  -0.47000 -1.0 2.0
   76    86    95   100   0.11750  1.0 3.0
   77    76    85    64   0.37050  1.0 3.0
   77    76    86    87   0.15000  1.0 3.0
   77    76    86    88   0.15000  1.0 3.0
   77    76    86    95   0.23400  1.0 3.0
   85    64    66    67   0.23400  1.0 3.0
   85    64   -66    68   0.62750  1.0 1.0
   85    64   -66    68  -0.30950 -1.0 2.0
   85    64   -66    68   0.27300  1.0 3.0
   85    64    66    70   1.11900  1.0 1.0
   85    64    66    70  -1.16350 -1.0 2.0
   85    64    66    70  -0.34150  1.0 3.0
   85    76    86    87   0.23400  1.0 3.0
   85    76    86    88   0.23400  1.0 3.0
   85    76    86    95   1.11900  1.0 1.0
   85    76    86    95  -1.16350 -1.0 2.0
   85    76    86    95  -0.34150  1.0 3.0
   86    76    85    64   0.06250  1.0 1.0
   86    76    85    64  -0.01100 -1.0 2.0
   86    76    85    64   0.28050  1.0 3.0
   86    95   100   101   3.00000 -1.0 2.0
   86    95   100   102   1.63150  1.0 1.0
   86    95   100   102   2.92000 -1.0 2.0
   87    86    95   100   0.08050  1.0 3.0
   88    86    95   100   0.08050  1.0 3.0
   95   100   102   103   0.00000  1.0 1.0
   95   100   102   104   0.00000  1.0 1.0
   95   100   102   105   0.00000  1.0 1.0
  101   100   102   103   0.00000  1.0 1.0
  101   100   102   104   0.00000  1.0 1.0
  101   100   102   105   0.00000  1.0 1.0
   78    71    76    77   0.23400  1.0 3.0
   78    71    76    85   1.11900  1.0 1.0
   78    71    76    85  -1.16350 -1.0 2.0
   78    71    76    85  -0.34150  1.0 3.0
   78    71    76    86   0.62750  1.0 1.0
   78    71    76    86  -0.30950 -1.0 2.0
   78    71    76    86   0.27300  1.0 3.0
   78    89    96    97   0.00000  1.0 1.0
   78    89    96    98   0.00000  1.0 1.0
   78    89    96    99   0.00000  1.0 1.0
   90    89    96    97   0.00000  1.0 1.0
   90    89    96    98   0.00000  1.0 1.0
   90    89    96    99   0.00000  1.0 1.0
   73    68    71    72   0.23400  1.0 3.0
   73    68    71    76   0.62750  1.0 1.0
   73    68    71    76  -0.30950 -1.0 2.0
   73    68    71    76   0.27300  1.0 3.0
   73    68    71    78   1.11900  1.0 1.0
   73    68    71    78  -1.16350 -1.0 2.0
   73    68    71    78  -0.34150  1.0 3.0
   73    79    91    92   0.00000  1.0 1.0
   73    79    91    93   0.00000  1.0 1.0
   73    79    91    94   0.00000  1.0 1.0
   80    79    91    92   0.00000  1.0 1.0
   80    79    91    93   0.00000  1.0 1.0
   80    79    91    94   0.00000  1.0 1.0
   70    66    68    69   0.23400  1.0 3.0
   70    66    68    71   0.62750  1.0 1.0
   70    66    68    71  -0.30950 -1.0 2.0
   70    66    68    71   0.27300  1.0 3.0
   70    66    68    73   1.11900  1.0 1.0
   70    66    68    73  -1.16350 -1.0 2.0
   70    66    68    73  -0.34150  1.0 3.0
   70    74    81    82   0.00000  1.0 1.0
   70    74    81    83   0.00000  1.0 1.0
   70    74    81    84   0.00000  1.0 1.0
   75    74    81    82   0.00000  1.0 1.0
   75    74    81    83   0.00000  1.0 1.0
   75    74    81    84   0.00000  1.0 1.0
   57    54    55    40   0.46850  1.0 1.0
   57    54    55    40   0.08550 -1.0 2.0
   57    54    55    40   0.09800  1.0 3.0
   57    54    55    56   0.34800  1.0 3.0
   57    54    55    61   0.46850  1.0 1.0
   57    54    55    61   0.08550 -1.0 2.0
   57    54    55    61   0.09800  1.0 3.0
   42    38    40    41   0.00000  1.0 1.0
   42    38    40    44   0.09850  1.0 1.0
   42    38    40    44   0.15250 -1.0 2.0
   42    38    40    44  -0.50650  1.0 3.0
   42    38    40    55   0.09850  1.0 1.0
   42    38    40    55   0.15250 -1.0 2.0
   42    38    40    55  -0.50650  1.0 3.0
   42    47    50    51   0.08050  1.0 3.0
   42    47    50    52   0.08050  1.0 3.0
   42    47    50    53   0.08050  1.0 3.0
   43    42    47    50   2.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    40    38    42   1.10000 -1.0 2.0
   44    49    48    54   1.10000 -1.0 2.0
   55    57    54    48   1.10000 -1.0 2.0
   95   102   100   101  10.50000 -1.0 2.0
   78    96    89    90  10.50000 -1.0 2.0
   73    91    79    80  10.50000 -1.0 2.0
   70    81    74    75  10.50000 -1.0 2.0
   43    47    42    38   1.10000 -1.0 2.0
END
