* LIGAND DATABASE FILE (OPLS2005)
*
001     104   106    197    291     572
    1     0 S   NP   _N1_     1    30.24949    97.55238   -25.87113
    2     1 S   H    _HN1     2     1.02786   121.43404   -88.66663
    3     1 S   H    _H1_     3     1.02957    60.96045     6.08367
    4     1 S   H    _H2_     4     1.02818    46.12847  -173.67926
    5     1 S   CT   _CA1     5     1.50150   125.72916   101.26871
    6     5 S   HC   _HA1     6     1.09580   105.16394   109.34994
    7     5 S   CO3  _C1_     7     1.53782   112.49721   -10.75201
    8     7 S   O2Z  _O11     8     1.26372   115.00888   -40.89886
    9     7 S   O2Z  _O12     9     1.26254   114.95673   138.10525
   10     5 S   CT   _CB1    10     1.53058   107.35361  -132.76532
   11    10 S   HC   HB11    11     1.09839   109.23268   -50.20007
   12    10 S   HC   HB12    12     1.09820   110.46697    66.34247
   13    10 S   CT   _CG1    13     1.52996   112.71235  -171.25816
   14    13 S   HC   HG11    14     1.09585   110.56886   -67.02865
   15    13 S   HC   HG12    15     1.09672   109.86340    52.25254
   16    13 S   C    _CD1    16     1.51774   112.18905   172.51827
   17    16 S   O    _OE1    17     1.22677   123.25929     4.10141
   18    16 S   N    _N2_    18     1.38563   111.76448  -175.50329
   19    18 S   H    _HN2    19     1.01572   118.85608     1.72737
   20    18 S   CT1  _CA2    20     1.46091   123.42247   177.29325
   21    20 S   HC   _HA2    21     1.09511   109.10954     5.00476
   22    20 S   C    _C2_    22     1.53521   108.53637  -109.89299
   23    22 S   O    _O2_    23     1.23064   122.41438  -142.96194
   24    20 S   CT   _CB2    32     1.53191   111.32261   127.49233
   25    24 S   HC   HB21    33     1.09655   109.70873    50.44242
   26    24 S   HC   HB22    34     1.09442   111.70909   167.91178
   27    22 S   N    _N3_    24     1.38371   113.71814    44.91017
   28    27 S   H    _HN3    25     1.01587   119.69450    -4.38021
   29    24 S   S    _SG2    35     1.82965   113.41477   -69.01956
   30    27 S   CT   _CA3    26     1.45330   122.84895   176.27932
   31    30 S   HC   HA31    27     1.09546   107.72999   -55.79185
   32    30 S   HC   HA32    28     1.09541   107.83083    60.39176
   33    29 S   CT   _C11    36     1.84694   100.26641   -74.78993
   34    33 S   HC   _H7_    37     1.09485   106.91955    65.91580
   35    30 S   CO3  _C3_    29     1.52838   113.84278  -178.48238
   36    35 S   O2Z  _O31    30     1.26385   115.73857   -28.16574
   37    35 S   O2Z  _O32    31     1.26411   114.64571   152.32707
   38    33 S   CT   _C12    38     1.53511   109.95862  -173.41507
   39    38 S   HC   _H8_    39     1.09884   109.03957    54.57609
   40    33 S   OS   _O33    54     1.43051   109.35135   -52.55625
   41    38 S   CT   _C8_    40     1.54649   110.83043   174.35382
   42    41 S   HC   _H4_    41     1.09748   109.95030    76.16360
   43    38 S   CO3  _C13   102     1.54236   111.60900   -66.28866
   44    43 S   O2Z  _O35   103     1.26283   116.10991   -50.80981
   45    43 S   O2Z  _O34   104     1.26464   114.55580   129.45447
   46    41 S   CT   _C7_    42     1.53269   112.76310  -161.12768
   47    46 S   HC   _H19    43     1.09366   113.82301   -36.86818
   48    46 S   HC   _H20    44     1.09744   109.21449  -156.40360
   49    46 S   CT   _C6_    45     1.53003   105.90848    86.53615
   50    49 S   HC   _H17    46     1.09566   110.20626   135.59352
   51    49 S   HC   _H18    47     1.09608   110.51556  -106.15964
   52    49 S   CT   _C5_    48     1.53646   106.42273    13.07953
   53    52 S   HC   _H3_    49     1.09773   108.42792  -104.14259
   54    41 S   CT   _C9_    50     1.53645   112.55634   -46.44412
   55    54 S   HC   _H5_    51     1.09968   108.35877   165.66019
   56    52 S   CT   _C4_    98     1.52313   112.38155   136.73071
   57    56 S   HC   _H14    99     1.09520   111.38362   -60.98124
   58    56 S   HC   _H15   100     1.09435   111.04584   178.63743
   59    56 S   HC   _H16   101     1.09506   110.55180    59.00863
   60    54 S   CO   _C10    52     1.52860   112.28430    45.11881
   61    60 S   HC   _H6_    53     1.09539   108.90358  -168.38485
   62    60 S   OS   _O36    55     1.43241   108.15385    74.42420
   63    62 S   CO   _C14    56     1.43196   113.18999   174.72552
   64    63 S   HC   _H9_    57     1.09575   108.64662    51.69684
   65    63 S   CT   _C15    58     1.53150   107.47780   170.64972
   66    65 S   HC   _H10    59     1.09766   109.36212    58.07180
   67    65 S   CT   _C16    60     1.53292   110.17336   178.97913
   68    67 S   HC   _H11    61     1.09609   110.54232    70.68068
   69    65 S   OS   _O44    91     1.44587   107.74292   -62.15661
   70    67 S   CT   _C17    62     1.53663   111.05111   -50.76998
   71    70 S   HC   _H12    63     1.09834   109.54711   -71.66931
   72    67 S   OS   _O42    84     1.44728   109.06766  -169.21655
   73    69 S   CO4  _C26    92     1.36207   117.84496   133.03350
   74    73 S   O    _O45    93     1.22353   126.56242     1.66601
   75    70 S   CT   _C18    64     1.53481   110.78073    49.22747
   76    75 S   HC   _H13    65     1.09798   110.89587    65.83181
   77    70 S   OS   _O40    77     1.44604   108.65597   167.50969
   78    72 S   CO4  _C24    85     1.36230   117.95511   -97.34980
   79    78 S   O    _O43    86     1.22276   126.57164     1.94118
   80    73 S   CT   _C27    94     1.49750   109.66748  -179.75371
   81    80 S   HC   _H32    95     1.09375   109.33926   169.11302
   82    80 S   HC   _H33    96     1.09249   109.97704    50.64403
   83    80 S   HC   _H34    97     1.09238   109.69619   -71.34224
   84    63 S   OS   _O37    66     1.42742   111.53085   -69.55678
   85    75 S   CT   _C19    67     1.53115   111.46536  -173.73193
   86    85 S   HC   _H21    68     1.09642   110.41145    68.47609
   87    85 S   HC   _H22    69     1.09537   110.99760   -53.80194
   88    77 S   CO4  _C22    78     1.36194   118.09084    94.71879
   89    88 S   O    _O41    79     1.22297   126.56370     1.68864
   90    78 S   CT   _C25    87     1.49788   109.41223  -178.53607
   91    90 S   HC   _H29    88     1.09284   109.79335   -62.40298
   92    90 S   HC   _H30    89     1.09376   109.35691   178.46354
   93    90 S   HC   _H31    90     1.09299   109.82917    59.51580
   94    85 S   OS   _O38    70     1.44046   108.12854  -172.82701
   95    88 S   CT   _C23    80     1.49831   109.40250  -178.65827
   96    95 S   HC   _H26    81     1.09281   109.79903   -63.05482
   97    95 S   HC   _H27    82     1.09375   109.36953   177.75023
   98    95 S   HC   _H28    83     1.09267   109.85628    58.82496
   99    94 S   CO4  _C20    71     1.36221   115.55126  -178.64925
  100    99 S   O    _O39    72     1.22332   126.23647    -0.38664
  101    99 S   CT   _C21    73     1.49835   109.58459   179.63309
  102   101 S   HC   _H23    74     1.09295   109.83054   -60.64993
  103   101 S   HC   _H24    75     1.09379   109.36100  -179.67797
  104   101 S   HC   _H25    76     1.09289   109.83195    61.25463
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   8   5   4   3
  14   6   2   1   1  15   8   9  18   9   4   1   1  11   6   5
  11   5   4  10   7   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    60    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    46    54    60    61    40    62    43    44    45  
   38    39    41    60    40    43  
   36    37  
   37  
    0  
   39    41    42    46    47    48    49    52    54    55    60    40    43    44    45  
   41    42    46    54    40    43    44    45  
   62    63    43    41    52    54    55    60    61  
   42    46    47    48    49    50    51    52    53    54    55    60    61    62    56    43    44    45  
   46    47    48    49    52    54    55    60    43  
   44    45    46    54  
   45  
    0  
   47    48    49    50    51    52    53    54    55    60    56  
   48    49    50    51    52    54  
   49    50    51    52    54  
   50    51    52    53    54    55    60    56    57    58    59  
   51    52    53    54    56  
   52    53    54    56  
   53    54    55    60    61    62    56    57    58    59  
   54    55    60    56    57    58    59  
   55    60    61    62    63    56    57    58    59  
   60    61    62    56  
   57    58    59    60  
   58    59  
   59  
    0  
   61    62    63    64    65    84  
   62    63  
   63    64    65    66    67    75    84    69  
   64    65    66    67    68    70    75    76    84    85    72    69    73  
   65    66    67    75    84    69  
   66    67    68    70    71    75    84    77    72    78    69    73    74    80  
   67    68    70    84    72    69    73  
   68    70    71    75    76    84    85    77    88    72    78    79    90    69    73  
   70    71    75    77    72    78    69  
   73    74    80    81    82    83    70    72    84  
   71    75    76    84    85    86    87    94    77    88    89    95    72    78  
   75    76    84    85    77    88    72  
   78    79    90    91    92    93    75    77  
   74    80    81    82    83  
   80    81    82    83  
   76    84    85    86    87    94    99    77    88  
   84    85    86    87    94    77  
   88    89    95    96    97    98    84    85  
   79    90    91    92    93  
   90    91    92    93  
   81    82    83  
   82    83  
   83  
    0  
   85    86    87    94  
   86    87    94    99   100   101  
   87    94    99  
   94    99  
   89    95    96    97    98  
   95    96    97    98  
   91    92    93  
   92    93  
   93  
    0  
   99   100   101   102   103   104  
   96    97    98  
   97    98  
   98  
    0  
  100   101   102   103   104  
  101   102   103   104  
  102   103   104  
  103   104  
  104  
    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   0.318900   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   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   41   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   62   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   63   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   67   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   69   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   75   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   77   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   78   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   79   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   80   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   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   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   85   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   87   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   88   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   89   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   90   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   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   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   95   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  100   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  101   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  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
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    40   320.000  1.410
   38    39   340.000  1.090
   38    41   268.000  1.529
   38    43   317.000  1.522
   41    42   340.000  1.090
   41    46   268.000  1.529
   41    54   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   268.000  1.529
   52    53   340.000  1.090
   52    54   268.000  1.529
   52    56   268.000  1.529
   54    55   340.000  1.090
   54    60   250.000  1.527
   60    61   340.000  1.090
   60    40   320.000  1.380
   60    62   320.000  1.380
   62    63   320.000  1.380
   63    64   340.000  1.090
   63    65   250.000  1.527
   63    84   320.000  1.380
   65    66   340.000  1.090
   65    67   268.000  1.529
   65    69   320.000  1.410
   67    68   340.000  1.090
   67    70   268.000  1.529
   67    72   320.000  1.410
   70    71   340.000  1.090
   70    75   268.000  1.529
   70    77   320.000  1.410
   75    76   340.000  1.090
   75    84   320.000  1.410
   75    85   268.000  1.529
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    94   320.000  1.410
   94    99   214.000  1.327
   99   100   570.000  1.229
   99   101   317.000  1.522
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   340.000  1.090
   77    88   214.000  1.327
   88    89   570.000  1.229
   88    95   317.000  1.522
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   340.000  1.090
   72    78   214.000  1.327
   78    79   570.000  1.229
   78    90   317.000  1.522
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   340.000  1.090
   69    73   214.000  1.327
   73    74   570.000  1.229
   73    80   317.000  1.522
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   43    44   656.000  1.250
   43    45   656.000  1.250
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    40    85.00000  114.68000
   33    38    39    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    38    43    70.00000  109.69300
   33    40    60    60.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    42    37.50000  110.70000
   38    41    46    58.35000  112.70000
   38    41    54    58.35000  112.70000
   38    43    44    70.00000  117.00000
   38    43    45    70.00000  117.00000
   41    38    39    37.50000  110.70000
   41    46    47    37.50000  110.70000
   41    46    48    37.50000  110.70000
   41    46    49    58.35000  112.70000
   41    54    52    58.35000  112.70000
   41    54    55    37.50000  110.70000
   41    54    60    75.00000  109.43000
   46    41    42    37.50000  110.70000
   46    49    50    37.50000  110.70000
   46    49    51    37.50000  110.70000
   46    49    52    58.35000  112.70000
   48    46    47    33.00000  107.80000
   49    46    47    37.50000  110.70000
   49    46    48    37.50000  110.70000
   49    52    53    37.50000  110.70000
   49    52    54    58.35000  112.70000
   49    52    56    58.35000  112.70000
   51    49    50    33.00000  107.80000
   52    49    50    37.50000  110.70000
   52    49    51    37.50000  110.70000
   52    54    55    37.50000  110.70000
   52    54    60    75.00000  109.43000
   52    56    57    37.50000  110.70000
   52    56    58    37.50000  110.70000
   52    56    59    37.50000  110.70000
   54    41    42    37.50000  110.70000
   54    41    46    58.35000  112.70000
   54    52    53    37.50000  110.70000
   54    60    61    45.00000  112.01100
   54    60    40    90.00000  108.56700
   54    60    62    90.00000  108.56700
   60    54    55    45.00000  108.72000
   60    62    63   100.00000  109.58800
   40    33    34    35.00000  109.50000
   40    33    38    50.00000  109.50000
   40    60    61    35.00000  109.50000
   62    60    61    35.00000  109.50000
   62    60    40    92.60000  111.55000
   62    63    64    35.00000  109.50000
   62    63    65    90.00000  108.56700
   62    63    84    92.60000  111.55000
   63    65    66    45.00000  108.72000
   63    65    67    75.00000  109.43000
   63    65    69    90.00000  109.38000
   63    84    75    60.00000  109.50000
   65    63    64    45.00000  112.01100
   65    67    68    37.50000  110.70000
   65    67    70    58.35000  112.70000
   65    67    72    50.00000  109.50000
   65    69    73    83.00000  116.90000
   67    65    66    37.50000  110.70000
   67    70    71    37.50000  110.70000
   67    70    75    58.35000  112.70000
   67    70    77    50.00000  109.50000
   67    72    78    83.00000  116.90000
   70    67    68    37.50000  110.70000
   70    75    76    37.50000  110.70000
   70    75    84    50.00000  109.50000
   70    75    85    58.35000  112.70000
   70    77    88    83.00000  116.90000
   75    70    71    37.50000  110.70000
   75    85    86    37.50000  110.70000
   75    85    87    37.50000  110.70000
   75    85    94    50.00000  109.50000
   84    63    64    35.00000  109.50000
   84    63    65    90.00000  108.56700
   84    75    76    35.00000  109.50000
   85    75    76    37.50000  110.70000
   85    75    84    50.00000  109.50000
   85    94    99    83.00000  116.90000
   87    85    86    33.00000  107.80000
   94    85    86    35.00000  109.50000
   94    85    87    35.00000  109.50000
   94    99   100    83.00000  123.40000
   94    99   101    81.00000  111.40000
   99   101   102    35.00000  109.50000
   99   101   103    35.00000  109.50000
   99   101   104    35.00000  109.50000
  101    99   100    80.00000  120.40000
  103   101   102    33.00000  107.80000
  104   101   102    33.00000  107.80000
  104   101   103    33.00000  107.80000
   77    70    71    35.00000  109.50000
   77    70    75    50.00000  109.50000
   77    88    89    83.00000  123.40000
   77    88    95    81.00000  111.40000
   88    95    96    35.00000  109.50000
   88    95    97    35.00000  109.50000
   88    95    98    35.00000  109.50000
   95    88    89    80.00000  120.40000
   97    95    96    33.00000  107.80000
   98    95    96    33.00000  107.80000
   98    95    97    33.00000  107.80000
   72    67    68    35.00000  109.50000
   72    67    70    50.00000  109.50000
   72    78    79    83.00000  123.40000
   72    78    90    81.00000  111.40000
   78    90    91    35.00000  109.50000
   78    90    92    35.00000  109.50000
   78    90    93    35.00000  109.50000
   90    78    79    80.00000  120.40000
   92    90    91    33.00000  107.80000
   93    90    91    33.00000  107.80000
   93    90    92    33.00000  107.80000
   69    65    66    35.00000  109.50000
   69    65    67    50.00000  109.50000
   69    73    74    83.00000  123.40000
   69    73    80    81.00000  111.40000
   73    80    81    35.00000  109.50000
   73    80    82    35.00000  109.50000
   73    80    83    35.00000  109.50000
   80    73    74    80.00000  120.40000
   82    80    81    33.00000  107.80000
   83    80    81    33.00000  107.80000
   83    80    82    33.00000  107.80000
   56    52    53    37.50000  110.70000
   56    52    54    58.35000  112.70000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   43    38    39    35.00000  109.50000
   43    38    41    70.00000  109.69300
   45    43    44    80.00000  126.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  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    40   0.13850  1.0 1.0
   24    29    33    40  -1.34450 -1.0 2.0
   24    29    33    40   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    39   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    40    60   0.14700  1.0 1.0
   29    33    40    60  -1.16150 -1.0 2.0
   29    33    40    60   0.48700  1.0 3.0
   33    38    41    42   0.15000  1.0 3.0
   33    38    41    46   0.56750  1.0 1.0
   33    38    41    46  -0.07550 -1.0 2.0
   33    38    41    46   0.20000  1.0 3.0
   33    38    41    54   0.56750  1.0 1.0
   33    38    41    54  -0.07550 -1.0 2.0
   33    38    41    54   0.20000  1.0 3.0
   33    38    43    44   0.41150 -1.0 2.0
   33    38    43    45   0.41150 -1.0 2.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    38    43  -0.11250  1.0 3.0
   34    33    40    60   0.37050  1.0 3.0
   38    33    40    60   0.06250  1.0 1.0
   38    33    40    60  -0.01100 -1.0 2.0
   38    33    40    60   0.28050  1.0 3.0
   38    41    46    47   0.15000  1.0 3.0
   38    41    46    48   0.15000  1.0 3.0
   38    41    46    49   0.56750  1.0 1.0
   38    41    46    49  -0.07550 -1.0 2.0
   38    41    46    49   0.20000  1.0 3.0
   38    41    54    52   0.56750  1.0 1.0
   38    41    54    52  -0.07550 -1.0 2.0
   38    41    54    52   0.20000  1.0 3.0
   38    41    54    55   0.15000  1.0 3.0
   38    41   -54    60   3.97050  1.0 1.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    46   0.15000  1.0 3.0
   39    38    41    54   0.15000  1.0 3.0
   39    38    43    44   0.00000  1.0 1.0
   39    38    43    45   0.00000  1.0 1.0
   41    38    43    44   0.41150 -1.0 2.0
   41    38    43    45   0.41150 -1.0 2.0
   41    46    49    50   0.15000  1.0 3.0
   41    46    49    51   0.15000  1.0 3.0
   41    46   -49    52   0.56750  1.0 1.0
   41    46   -49    52  -0.07550 -1.0 2.0
   41    46   -49    52   0.20000  1.0 3.0
   41    54    60    61   0.15000  1.0 3.0
   41    54    60    40   0.62750  1.0 1.0
   41    54    60    40  -0.30950 -1.0 2.0
   41    54    60    40   0.27300  1.0 3.0
   41    54    60    62   0.62750  1.0 1.0
   41    54    60    62  -0.30950 -1.0 2.0
   41    54    60    62   0.27300  1.0 3.0
   42    41    46    47   0.15000  1.0 3.0
   42    41    46    48   0.15000  1.0 3.0
   42    41    46    49   0.15000  1.0 3.0
   42    41    54    52   0.15000  1.0 3.0
   42    41    54    55   0.15000  1.0 3.0
   42    41    54    60   0.15000  1.0 3.0
   46    41   -54    52   0.56750  1.0 1.0
   46    41   -54    52  -0.07550 -1.0 2.0
   46    41   -54    52   0.20000  1.0 3.0
   46    41    54    55   0.15000  1.0 3.0
   46    41    54    60   3.97050  1.0 1.0
   46    49    52    53   0.15000  1.0 3.0
   46    49   -52    54   0.56750  1.0 1.0
   46    49   -52    54  -0.07550 -1.0 2.0
   46    49   -52    54   0.20000  1.0 3.0
   46    49    52    56   0.56750  1.0 1.0
   46    49    52    56  -0.07550 -1.0 2.0
   46    49    52    56   0.20000  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    51   0.15000  1.0 3.0
   47    46    49    52   0.15000  1.0 3.0
   48    46    49    50   0.15000  1.0 3.0
   48    46    49    51   0.15000  1.0 3.0
   48    46    49    52   0.15000  1.0 3.0
   49    52   -54    41   0.56750  1.0 1.0
   49    52   -54    41  -0.07550 -1.0 2.0
   49    52   -54    41   0.20000  1.0 3.0
   49    52    54    55   0.15000  1.0 3.0
   49    52    54    60   3.97050  1.0 1.0
   49    52    56    57   0.15000  1.0 3.0
   49    52    56    58   0.15000  1.0 3.0
   49    52    56    59   0.15000  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    54   0.15000  1.0 3.0
   50    49    52    56   0.15000  1.0 3.0
   51    49    52    53   0.15000  1.0 3.0
   51    49    52    54   0.15000  1.0 3.0
   51    49    52    56   0.15000  1.0 3.0
   52    54    60    61   0.15000  1.0 3.0
   52    54    60    40   0.62750  1.0 1.0
   52    54    60    40  -0.30950 -1.0 2.0
   52    54    60    40   0.27300  1.0 3.0
   52    54    60    62   0.62750  1.0 1.0
   52    54    60    62  -0.30950 -1.0 2.0
   52    54    60    62   0.27300  1.0 3.0
   53    52    54    41   0.15000  1.0 3.0
   53    52    54    55   0.15000  1.0 3.0
   53    52    54    60   0.15000  1.0 3.0
   53    52    56    57   0.15000  1.0 3.0
   53    52    56    58   0.15000  1.0 3.0
   53    52    56    59   0.15000  1.0 3.0
   54    41    46    47   0.15000  1.0 3.0
   54    41    46    48   0.15000  1.0 3.0
   54    41   -46    49   0.56750  1.0 1.0
   54    41   -46    49  -0.07550 -1.0 2.0
   54    41   -46    49   0.20000  1.0 3.0
   54    52    56    57   0.15000  1.0 3.0
   54    52    56    58   0.15000  1.0 3.0
   54    52    56    59   0.15000  1.0 3.0
   54    60   -40    33   0.06250  1.0 1.0
   54    60   -40    33  -0.01100 -1.0 2.0
   54    60   -40    33   0.28050  1.0 3.0
   54    60    62    63   0.06250  1.0 1.0
   54    60    62    63  -0.01100 -1.0 2.0
   54    60    62    63   0.28050  1.0 3.0
   55    54    60    61   0.15000  1.0 3.0
   55    54    60    40   0.23400  1.0 3.0
   55    54    60    62   0.23400  1.0 3.0
   60    62    63    64   0.37050  1.0 3.0
   60    62    63    65   0.06250  1.0 1.0
   60    62    63    65  -0.01100 -1.0 2.0
   60    62    63    65   0.28050  1.0 3.0
   60    62    63    84  -0.53350  1.0 1.0
   60    62    63    84  -0.78350 -1.0 2.0
   60    62    63    84   0.33750  1.0 3.0
   61    60    40    33   0.37050  1.0 3.0
   61    60    62    63   0.37050  1.0 3.0
   40    33    38    39   0.23400  1.0 3.0
   40    33   -38    41   0.62750  1.0 1.0
   40    33   -38    41  -0.30950 -1.0 2.0
   40    33   -38    41   0.27300  1.0 3.0
   40    33    38    43  -3.35100  1.0 1.0
   40    33    38    43  -0.37050 -1.0 2.0
   40    33    38    43   0.22400  1.0 3.0
   40    60    62    63  -0.53350  1.0 1.0
   40    60    62    63  -0.78350 -1.0 2.0
   40    60    62    63   0.33750  1.0 3.0
   62    60    40    33  -0.81800  1.0 1.0
   62    63    65    66   0.23400  1.0 3.0
   62    63    65    67   0.62750  1.0 1.0
   62    63    65    67  -0.30950 -1.0 2.0
   62    63    65    67   0.27300  1.0 3.0
   62    63    65    69   1.11900  1.0 1.0
   62    63    65    69  -1.16350 -1.0 2.0
   62    63    65    69  -0.34150  1.0 3.0
   62    63    84    75  -0.81800  1.0 1.0
   63    65    67    68   0.15000  1.0 3.0
   63    65    67    70   3.97050  1.0 1.0
   63    65    67    72   0.62750  1.0 1.0
   63    65    67    72  -0.30950 -1.0 2.0
   63    65    67    72   0.27300  1.0 3.0
   63    65    69    73  -0.25900  1.0 1.0
   63    65    69    73  -0.47000 -1.0 2.0
   63    65    69    73   0.11750  1.0 3.0
   64    63    65    66   0.15000  1.0 3.0
   64    63    65    67   0.15000  1.0 3.0
   64    63    65    69   0.23400  1.0 3.0
   64    63    84    75   0.37050  1.0 3.0
   65    63    84    75   0.06250  1.0 1.0
   65    63    84    75  -0.01100 -1.0 2.0
   65    63    84    75   0.28050  1.0 3.0
   65    67    70    71   0.15000  1.0 3.0
   65    67   -70    75   0.56750  1.0 1.0
   65    67   -70    75  -0.07550 -1.0 2.0
   65    67   -70    75   0.20000  1.0 3.0
   65    67    70    77   0.62750  1.0 1.0
   65    67    70    77  -0.30950 -1.0 2.0
   65    67    70    77   0.27300  1.0 3.0
   65    67    72    78  -0.25900  1.0 1.0
   65    67    72    78  -0.47000 -1.0 2.0
   65    67    72    78   0.11750  1.0 3.0
   65    69    73    74   3.00000 -1.0 2.0
   65    69    73    80   1.63150  1.0 1.0
   65    69    73    80   2.92000 -1.0 2.0
   66    65    67    68   0.15000  1.0 3.0
   66    65    67    70   0.15000  1.0 3.0
   66    65    67    72   0.23400  1.0 3.0
   66    65    69    73   0.08050  1.0 3.0
   67    65    69    73  -0.25900  1.0 1.0
   67    65    69    73  -0.47000 -1.0 2.0
   67    65    69    73   0.11750  1.0 3.0
   67    70    75    76   0.15000  1.0 3.0
   67    70    75    84   0.62750  1.0 1.0
   67    70    75    84  -0.30950 -1.0 2.0
   67    70    75    84   0.27300  1.0 3.0
   67    70    75    85   0.56750  1.0 1.0
   67    70    75    85  -0.07550 -1.0 2.0
   67    70    75    85   0.20000  1.0 3.0
   67    70    77    88  -0.25900  1.0 1.0
   67    70    77    88  -0.47000 -1.0 2.0
   67    70    77    88   0.11750  1.0 3.0
   67    72    78    79   3.00000 -1.0 2.0
   67    72    78    90   1.63150  1.0 1.0
   67    72    78    90   2.92000 -1.0 2.0
   68    67    70    71   0.15000  1.0 3.0
   68    67    70    75   0.15000  1.0 3.0
   68    67    70    77   0.23400  1.0 3.0
   68    67    72    78   0.08050  1.0 3.0
   70    67    72    78  -0.25900  1.0 1.0
   70    67    72    78  -0.47000 -1.0 2.0
   70    67    72    78   0.11750  1.0 3.0
   70    75   -84    63   0.06250  1.0 1.0
   70    75   -84    63  -0.01100 -1.0 2.0
   70    75   -84    63   0.28050  1.0 3.0
   70    75    85    86   0.15000  1.0 3.0
   70    75    85    87   0.15000  1.0 3.0
   70    75    85    94   0.62750  1.0 1.0
   70    75    85    94  -0.30950 -1.0 2.0
   70    75    85    94   0.27300  1.0 3.0
   70    77    88    89   3.00000 -1.0 2.0
   70    77    88    95   1.63150  1.0 1.0
   70    77    88    95   2.92000 -1.0 2.0
   71    70    75    76   0.15000  1.0 3.0
   71    70    75    84   0.23400  1.0 3.0
   71    70    75    85   0.15000  1.0 3.0
   71    70    77    88   0.08050  1.0 3.0
   75    70    77    88  -0.25900  1.0 1.0
   75    70    77    88  -0.47000 -1.0 2.0
   75    70    77    88   0.11750  1.0 3.0
   75    85    94    99  -0.25900  1.0 1.0
   75    85    94    99  -0.47000 -1.0 2.0
   75    85    94    99   0.11750  1.0 3.0
   76    75    84    63   0.37050  1.0 3.0
   76    75    85    86   0.15000  1.0 3.0
   76    75    85    87   0.15000  1.0 3.0
   76    75    85    94   0.23400  1.0 3.0
   84    63    65    66   0.23400  1.0 3.0
   84    63   -65    67   0.62750  1.0 1.0
   84    63   -65    67  -0.30950 -1.0 2.0
   84    63   -65    67   0.27300  1.0 3.0
   84    63    65    69   1.11900  1.0 1.0
   84    63    65    69  -1.16350 -1.0 2.0
   84    63    65    69  -0.34150  1.0 3.0
   84    75    85    86   0.23400  1.0 3.0
   84    75    85    87   0.23400  1.0 3.0
   84    75    85    94   1.11900  1.0 1.0
   84    75    85    94  -1.16350 -1.0 2.0
   84    75    85    94  -0.34150  1.0 3.0
   85    75    84    63   0.06250  1.0 1.0
   85    75    84    63  -0.01100 -1.0 2.0
   85    75    84    63   0.28050  1.0 3.0
   85    94    99   100   3.00000 -1.0 2.0
   85    94    99   101   1.63150  1.0 1.0
   85    94    99   101   2.92000 -1.0 2.0
   86    85    94    99   0.08050  1.0 3.0
   87    85    94    99   0.08050  1.0 3.0
   94    99   101   102   0.00000  1.0 1.0
   94    99   101   103   0.00000  1.0 1.0
   94    99   101   104   0.00000  1.0 1.0
  100    99   101   102   0.00000  1.0 1.0
  100    99   101   103   0.00000  1.0 1.0
  100    99   101   104   0.00000  1.0 1.0
   77    70    75    76   0.23400  1.0 3.0
   77    70    75    84   1.11900  1.0 1.0
   77    70    75    84  -1.16350 -1.0 2.0
   77    70    75    84  -0.34150  1.0 3.0
   77    70    75    85   0.62750  1.0 1.0
   77    70    75    85  -0.30950 -1.0 2.0
   77    70    75    85   0.27300  1.0 3.0
   77    88    95    96   0.00000  1.0 1.0
   77    88    95    97   0.00000  1.0 1.0
   77    88    95    98   0.00000  1.0 1.0
   89    88    95    96   0.00000  1.0 1.0
   89    88    95    97   0.00000  1.0 1.0
   89    88    95    98   0.00000  1.0 1.0
   72    67    70    71   0.23400  1.0 3.0
   72    67    70    75   0.62750  1.0 1.0
   72    67    70    75  -0.30950 -1.0 2.0
   72    67    70    75   0.27300  1.0 3.0
   72    67    70    77   1.11900  1.0 1.0
   72    67    70    77  -1.16350 -1.0 2.0
   72    67    70    77  -0.34150  1.0 3.0
   72    78    90    91   0.00000  1.0 1.0
   72    78    90    92   0.00000  1.0 1.0
   72    78    90    93   0.00000  1.0 1.0
   79    78    90    91   0.00000  1.0 1.0
   79    78    90    92   0.00000  1.0 1.0
   79    78    90    93   0.00000  1.0 1.0
   69    65    67    68   0.23400  1.0 3.0
   69    65    67    70   0.62750  1.0 1.0
   69    65    67    70  -0.30950 -1.0 2.0
   69    65    67    70   0.27300  1.0 3.0
   69    65    67    72   1.11900  1.0 1.0
   69    65    67    72  -1.16350 -1.0 2.0
   69    65    67    72  -0.34150  1.0 3.0
   69    73    80    81   0.00000  1.0 1.0
   69    73    80    82   0.00000  1.0 1.0
   69    73    80    83   0.00000  1.0 1.0
   74    73    80    81   0.00000  1.0 1.0
   74    73    80    82   0.00000  1.0 1.0
   74    73    80    83   0.00000  1.0 1.0
   56    52    54    41   0.56750  1.0 1.0
   56    52    54    41  -0.07550 -1.0 2.0
   56    52    54    41   0.20000  1.0 3.0
   56    52    54    55   0.15000  1.0 3.0
   56    52    54    60   3.97050  1.0 1.0
   43    38    41    42  -0.11250  1.0 3.0
   43    38    41    46  -1.63150  1.0 1.0
   43    38    41    46  -0.43550 -1.0 2.0
   43    38    41    46   0.24500  1.0 3.0
   43    38    41    54  -1.63150  1.0 1.0
   43    38    41    54  -0.43550 -1.0 2.0
   43    38    41    54   0.24500  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   94   101    99   100  10.50000 -1.0 2.0
   77    95    88    89  10.50000 -1.0 2.0
   72    90    78    79  10.50000 -1.0 2.0
   69    80    73    74  10.50000 -1.0 2.0
   44    38    43    45  10.50000 -1.0 2.0
END
