* LIGAND DATABASE FILE (OPLS2005)
*
001     110   109    197    277     569
    1     0 S   NP   _N1_     1    28.91800    96.83227   -23.48423
    2     1 S   H    _HN1     2     1.02837    34.81354   152.05092
    3     1 S   H    _H1_     3     1.02775   104.23759  -106.96519
    4     1 S   H    _H2_     4     1.02959    75.75838    -1.26176
    5     1 S   CT   _CA1     5     1.50100   137.78118   103.51105
    6     5 S   HC   _HA1     6     1.09581   105.21717    86.26428
    7     5 S   CO3  _C1_     7     1.53803   112.53002   -33.84549
    8     7 S   O2Z  _O11     8     1.26356   114.99023   -41.51215
    9     7 S   O2Z  _O12     9     1.26258   114.93827   137.75477
   10     5 S   CT   _CB1    10     1.53128   107.44849  -155.86683
   11    10 S   HC   HB11    11     1.09814   109.29799   -51.67337
   12    10 S   HC   HB12    12     1.09813   110.45140    64.92363
   13    10 S   CT   _CG1    13     1.52912   112.55169  -172.83675
   14    13 S   HC   HG11    14     1.09598   110.32151   -64.86803
   15    13 S   HC   HG12    15     1.09662   109.98667    54.22021
   16    13 S   C    _CD1    16     1.51781   112.65120   174.59216
   17    16 S   O    _OE1    17     1.22704   123.55020    -4.01425
   18    16 S   N    _N2_    18     1.38470   111.35631   176.35858
   19    18 S   H    _HN2    19     1.01455   118.87697     3.23289
   20    18 S   CT1  _CA2    20     1.45861   123.37089   178.04095
   21    20 S   HC   _HA2    21     1.09546   109.62911    23.09054
   22    20 S   C    _C2_    22     1.52679   103.55413   -95.07333
   23    22 S   O    _O2_    23     1.23028   122.04454   -71.92478
   24    20 S   CT   _CB2    32     1.53142   111.74736   146.43213
   25    24 S   HC   HB21    33     1.09422   110.46535    59.02949
   26    24 S   HC   HB22    34     1.09494   109.92715   178.03497
   27    22 S   N    _N3_    24     1.38500   113.37129   102.89039
   28    27 S   H    _HN3    25     1.01510   119.91383     5.09847
   29    24 S   S    _SG2    35     1.82536   111.59322   -61.12878
   30    27 S   CT   _CA3    26     1.45442   122.40180  -173.56882
   31    30 S   HC   HA31    27     1.09587   109.00204    35.83843
   32    30 S   HC   HA32    28     1.09528   107.17101   152.08351
   33    29 S   CT   _C27    36     1.82692    98.87474   174.92125
   34    33 S   HC   _H42    37     1.09533   107.52336    66.77444
   35    33 S   HC   _H43    38     1.09467   108.45606   -49.30787
   36    30 S   CO3  _C3_    29     1.52603   113.12333   -86.55218
   37    36 S   O2Z  _O31    30     1.26320   115.01366   -90.22432
   38    36 S   O2Z  _O32    31     1.26332   115.33278    90.33968
   39    33 S   CT   _C5_    39     1.53840   114.00656  -170.75169
   40    39 S   HC   _H3_    40     1.09869   107.94002  -176.85502
   41    39 S   CO4  _C6_    41     1.52222   112.21418   -60.23933
   42    41 S   O    _O33    42     1.22361   125.00210   120.16605
   43    39 S   CT   _C4_   107     1.53007   112.60552    65.96637
   44    43 S   HC   _H4_   108     1.09482   112.23489   -66.37655
   45    43 S   HC   _H5_   109     1.09484   110.81635    54.89231
   46    43 S   HC   _H6_   110     1.09587   110.46634   174.20783
   47    41 S   OS   _O34    43     1.36421   109.46693   -60.06448
   48    47 S   CT   _C7_    44     1.44108   117.30177   174.24068
   49    48 S   HC   _H7_    45     1.09540   110.54623    45.50248
   50    48 S   HC   _H8_    46     1.09494   106.21117   162.44413
   51    48 S   CT   _C8_    47     1.52326   110.09006   -78.43710
   52    51 S   HC   _H9_    48     1.09473   110.27547  -176.35557
   53    51 S   HC   _H10    49     1.09533   110.51609    62.12890
   54    51 S   OS   _O35    50     1.43804   107.78954   -57.39090
   55    54 S   CO4  _C9_    51     1.36186   116.34354   165.99387
   56    55 S   O    _O36    52     1.22493   124.92812     6.57005
   57    55 S   N    _N4_    53     1.37357   108.99229  -172.60538
   58    57 S   H    _H11    54     1.01421   117.03498     1.28176
   59    57 S   CT   _C10    55     1.45055   124.27655   177.84914
   60    59 S   HC   _H12    56     1.09086   106.35711  -125.21605
   61    59 S   HC   _H13    57     1.09720   108.78681   -11.67805
   62    59 S   CT   _C11    58     1.55058   113.84430   111.39055
   63    62 S   CT   _C25    59     1.53612   108.14086   176.07155
   64    63 S   HC   _H36    60     1.09266   111.60298   -55.11169
   65    63 S   HC   _H37    61     1.09517   111.39749  -176.86050
   66    63 S   HC   _H38    62     1.09664   111.06400    63.57523
   67    62 S   CT   _C26    63     1.55240   107.73961   -68.66901
   68    67 S   HC   _H39    64     1.09555   111.54012    66.28787
   69    67 S   HC   _H40    65     1.09624   111.11250  -173.78839
   70    67 S   HC   _H41    66     1.09609   111.38175   -54.10772
   71    62 S   CT   _C12    67     1.56563   114.33816    49.75770
   72    71 S   HC   _H14    68     1.10119   106.77387  -163.53072
   73    71 S   HC   _H15    69     1.09940   107.02335   -52.88511
   74    71 S   CT   _C13    70     1.57010   124.17304    72.87647
   75    74 S   CT   _C23    71     1.54216   110.96762    75.48108
   76    75 S   HC   _H30    72     1.09104   112.34170   -75.22399
   77    75 S   HC   _H31    73     1.09583   111.49629   165.12517
   78    75 S   HC   _H32    74     1.09578   111.26345    45.91420
   79    74 S   CT   _C24    75     1.55188   105.78485  -169.23367
   80    79 S   HC   _H33    76     1.09593   111.06352    67.63676
   81    79 S   HC   _H34    77     1.09499   112.16439  -171.57927
   82    79 S   HC   _H35    78     1.09649   111.04588   -52.21944
   83    74 S   CT   _C14    79     1.54927   112.79094   -49.29213
   84    83 S   HC   _H16    80     1.09456   109.26356    67.19555
   85    83 S   HC   _H17    81     1.09659   109.17488   -49.30126
   86    83 S   CT   _C15    82     1.53235   116.05055  -171.79812
   87    86 S   HC   _H18    83     1.09392   111.18880    60.91163
   88    86 S   HC   _H19    84     1.09365   111.18865   -60.13935
   89    86 S   N    _N5_    85     1.45279   111.30865  -178.96014
   90    89 S   H    _H20    86     1.01801   118.23003    93.64388
   91    89 S   CO4  _C16    87     1.37589   123.25870   -87.35374
   92    91 S   O    _O37    88     1.22646   125.35922     2.82923
   93    91 S   OS   _O38    89     1.36492   110.04038  -176.82892
   94    93 S   CT   _C17    90     1.43865   115.44809   177.51998
   95    94 S   HC   _H21    91     1.09573   109.01705   -54.37547
   96    94 S   HC   _H22    92     1.09403   108.61812    65.32854
   97    94 S   CT   _C18    93     1.52247   108.89612  -173.43212
   98    97 S   HC   _H23    94     1.09591   111.03368   167.92400
   99    97 S   HC   _H24    95     1.09499   110.33551    48.43445
  100    97 S   OS   _O39    96     1.44085   111.22441   -69.46394
  101   100 S   CO4  _C19    97     1.36005   117.05268   -83.16920
  102   101 S   O    _O40    98     1.22259   126.04388     3.71620
  103   101 S   CM   _C20    99     1.48860   109.55243  -176.15295
  104   103 S   CM   _C21   100     1.34133   117.40483  -165.23897
  105   104 S   HC   _H25   101     1.08598   121.00027  -179.35109
  106   104 S   HC   _H26   102     1.08511   122.43925     0.81805
  107   103 S   CT   _C22   103     1.49742   119.98159    15.91970
  108   107 S   HC   _H27   104     1.09410   110.82539   -64.53638
  109   107 S   HC   _H28   105     1.09494   110.47145    55.93999
  110   107 S   HC   _H29   106     1.09540   111.83185   175.58696
  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
  11   5   4   2   1   1   9   7  10   3   4   2   1   1   7   7
   5   4   6   3   2   5   7   3   8   4  15   5   4  15  11   4
   3   2   7   3   2   1  15   5   4  15  11   4   3   2   7   3
   2   1   8   5   4   7   4   3   5   3   6   2   7   7   5   4
   6   3   2   5   9   3   7   6   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    43  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    47    43    44    45    46  
   35    39    40    41    43  
   39    40    41    43  
   37    38  
   38  
    0  
   40    41    42    47    48    43    44    45    46  
   41    42    47    43    44    45    46  
   42    47    48    49    50    51    43    44    45    46  
   47    48    43  
   44    45    46    47  
   45    46  
   46  
    0  
   48    49    50    51    52    53    54  
   49    50    51    52    53    54    55  
   50    51    52    53    54  
   51    52    53    54  
   52    53    54    55    56    57  
   53    54    55  
   54    55  
   55    56    57    58    59  
   56    57    58    59    60    61    62  
   57    58    59  
   58    59    60    61    62    63    67    71  
   59    60    61    62  
   60    61    62    63    64    65    66    67    68    69    70    71    72    73    74  
   61    62    63    67    71  
   62    63    67    71  
   63    64    65    66    67    68    69    70    71    72    73    74    75    79    83  
   64    65    66    67    68    69    70    71    72    73    74  
   65    66    67    71  
   66    67    71  
   67    71  
   68    69    70    71    72    73    74  
   69    70    71  
   70    71  
   71  
   72    73    74    75    76    77    78    79    80    81    82    83    84    85    86  
   73    74    75    79    83  
   74    75    79    83  
   75    76    77    78    79    80    81    82    83    84    85    86    87    88    89  
   76    77    78    79    80    81    82    83    84    85    86  
   77    78    79    83  
   78    79    83  
   79    83  
   80    81    82    83    84    85    86  
   81    82    83  
   82    83  
   83  
   84    85    86    87    88    89    90    91  
   85    86    87    88    89  
   86    87    88    89  
   87    88    89    90    91    92    93  
   88    89    90    91  
   89    90    91  
   90    91    92    93    94  
   91    92    93  
   92    93    94    95    96    97  
   93    94  
   94    95    96    97    98    99   100  
   95    96    97    98    99   100   101  
   96    97    98    99   100  
   97    98    99   100  
   98    99   100   101   102   103  
   99   100   101  
  100   101  
  101   102   103   104   107  
  102   103   104   105   106   107   108   109   110  
  103   104   107  
  104   105   106   107   108   109   110  
  105   106   107   108   109   110  
  106   107  
  107  
  108   109   110  
  109   110  
  110  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   48   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   50   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   53   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   54   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   55   3.7500   0.1050   0.699500   1.9250   1.7000   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.497000   1.5250   1.4250   0.001000000  -1.480495490
   57   3.2500   0.1700  -0.565700   1.8100   1.6000   0.054801302  -1.445846770
   58   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   59   3.5000   0.0660   0.032000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   75   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660   0.032000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   3.2500   0.1700  -0.565700   1.8100   1.6000   0.054801302  -1.445846770
   90   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   91   3.7500   0.1050   0.699500   1.9250   1.7000   0.001000000  -0.126889456
   92   2.9600   0.2100  -0.497000   1.5250   1.4250   0.001000000  -1.480495490
   93   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   94   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   96   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   97   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   99   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
  100   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
  101   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  103   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
  104   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
  105   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  106   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    43   268.000  1.529
   41    42   570.000  1.229
   41    47   214.000  1.327
   47    48   320.000  1.410
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   320.000  1.410
   54    55   214.000  1.327
   55    56   570.000  1.229
   55    57   435.000  1.380
   57    58   434.000  1.010
   57    59   337.000  1.449
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   268.000  1.529
   62    63   268.000  1.529
   62    67   268.000  1.529
   62    71   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   268.000  1.529
   74    75   268.000  1.529
   74    79   268.000  1.529
   74    83   268.000  1.529
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   340.000  1.090
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    82   340.000  1.090
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   337.000  1.449
   89    90   434.000  1.010
   89    91   435.000  1.380
   91    92   570.000  1.229
   91    93   214.000  1.327
   93    94   320.000  1.410
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   268.000  1.529
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   320.000  1.410
  100   101   214.000  1.327
  101   102   570.000  1.229
  101   103   320.000  1.462
  103   104   549.000  1.340
  103   107   317.000  1.510
  104   105   340.000  1.080
  104   106   340.000  1.080
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    63.00000  111.10000
   33    39    43    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    80.00000  120.40000
   39    41    47    81.00000  111.40000
   39    43    44    37.50000  110.70000
   39    43    45    37.50000  110.70000
   39    43    46    37.50000  110.70000
   41    39    40    35.00000  109.50000
   41    47    48    83.00000  116.90000
   47    41    42    83.00000  123.40000
   47    48    49    35.00000  109.50000
   47    48    50    35.00000  109.50000
   47    48    51    50.00000  109.50000
   48    51    52    37.50000  110.70000
   48    51    53    37.50000  110.70000
   48    51    54    50.00000  109.50000
   50    48    49    33.00000  107.80000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    54    55    83.00000  116.90000
   53    51    52    33.00000  107.80000
   54    51    52    35.00000  109.50000
   54    51    53    35.00000  109.50000
   54    55    56    83.00000  123.40000
   54    55    57   110.00000  108.75700
   55    57    58    50.00000  116.34900
   55    57    59    70.00000  120.44000
   57    55    56    85.00000  125.96000
   57    59    60    35.00000  109.50000
   57    59    61    35.00000  109.50000
   57    59    62    70.00000  110.72300
   59    57    58    38.00000  118.40000
   59    62    63    58.35000  112.70000
   59    62    67    58.35000  112.70000
   59    62    71    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    59    60    37.50000  110.70000
   62    59    61    37.50000  110.70000
   62    63    64    37.50000  110.70000
   62    63    65    37.50000  110.70000
   62    63    66    37.50000  110.70000
   62    67    68    37.50000  110.70000
   62    67    69    37.50000  110.70000
   62    67    70    37.50000  110.70000
   62    71    72    37.50000  110.70000
   62    71    73    37.50000  110.70000
   62    71    74    58.35000  112.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   67    62    63    58.35000  112.70000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   71    62    63    58.35000  112.70000
   71    62    67    58.35000  112.70000
   71    74    75    58.35000  112.70000
   71    74    79    58.35000  112.70000
   71    74    83    58.35000  112.70000
   73    71    72    33.00000  107.80000
   74    71    72    37.50000  110.70000
   74    71    73    37.50000  110.70000
   74    75    76    37.50000  110.70000
   74    75    77    37.50000  110.70000
   74    75    78    37.50000  110.70000
   74    79    80    37.50000  110.70000
   74    79    81    37.50000  110.70000
   74    79    82    37.50000  110.70000
   74    83    84    37.50000  110.70000
   74    83    85    37.50000  110.70000
   74    83    86    58.35000  112.70000
   77    75    76    33.00000  107.80000
   78    75    76    33.00000  107.80000
   78    75    77    33.00000  107.80000
   79    74    75    58.35000  112.70000
   81    79    80    33.00000  107.80000
   82    79    80    33.00000  107.80000
   82    79    81    33.00000  107.80000
   83    74    75    58.35000  112.70000
   83    74    79    58.35000  112.70000
   83    86    87    37.50000  110.70000
   83    86    88    37.50000  110.70000
   83    86    89    70.00000  110.72300
   85    83    84    33.00000  107.80000
   86    83    84    37.50000  110.70000
   86    83    85    37.50000  110.70000
   86    89    90    38.00000  118.40000
   86    89    91    70.00000  120.44000
   88    86    87    33.00000  107.80000
   89    86    87    35.00000  109.50000
   89    86    88    35.00000  109.50000
   89    91    92    85.00000  125.96000
   89    91    93   110.00000  108.75700
   91    89    90    50.00000  116.34900
   91    93    94    83.00000  116.90000
   93    91    92    83.00000  123.40000
   93    94    95    35.00000  109.50000
   93    94    96    35.00000  109.50000
   93    94    97    50.00000  109.50000
   94    97    98    37.50000  110.70000
   94    97    99    37.50000  110.70000
   94    97   100    50.00000  109.50000
   96    94    95    33.00000  107.80000
   97    94    95    37.50000  110.70000
   97    94    96    37.50000  110.70000
   97   100   101    83.00000  116.90000
   99    97    98    33.00000  107.80000
  100    97    98    35.00000  109.50000
  100    97    99    35.00000  109.50000
  100   101   102    83.00000  123.40000
  100   101   103    90.00000  111.29400
  101   103   104    65.00000  118.96000
  101   103   107    65.00000  116.34900
  103   101   102    80.00000  123.72100
  103   104   105    35.00000  120.00000
  103   104   106    35.00000  120.00000
  103   107   108    35.00000  109.50000
  103   107   109    35.00000  109.50000
  103   107   110    35.00000  109.50000
  106   104   105    35.00000  117.00000
  107   103   104    70.00000  124.00000
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
   43    39    40    37.50000  110.70000
   43    39    41    63.00000  111.10000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    43   0.44750  1.0 1.0
   29    33    39    43  -0.17800 -1.0 2.0
   29    33    39    43   0.20200  1.0 3.0
   33    39    41    42   0.30150 -1.0 2.0
   33    39    41    47   0.36750  1.0 3.0
   33    39    43    44   0.15000  1.0 3.0
   33    39    43    45   0.15000  1.0 3.0
   33    39    43    46   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    43   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    43   0.15000  1.0 3.0
   39    41    47    48   1.63150  1.0 1.0
   39    41    47    48   2.92000 -1.0 2.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    47   0.00000  1.0 1.0
   40    39    43    44   0.15000  1.0 3.0
   40    39    43    45   0.15000  1.0 3.0
   40    39    43    46   0.15000  1.0 3.0
   41    39    43    44  -0.11250  1.0 3.0
   41    39    43    45  -0.11250  1.0 3.0
   41    39    43    46  -0.11250  1.0 3.0
   41    47    48    49   0.08050  1.0 3.0
   41    47    48    50   0.08050  1.0 3.0
   41    47    48    51  -0.25900  1.0 1.0
   41    47    48    51  -0.47000 -1.0 2.0
   41    47    48    51   0.11750  1.0 3.0
   42    41    47    48   3.00000 -1.0 2.0
   47    48    51    52   0.23400  1.0 3.0
   47    48    51    53   0.23400  1.0 3.0
   47    48    51    54   1.11900  1.0 1.0
   47    48    51    54  -1.16350 -1.0 2.0
   47    48    51    54  -0.34150  1.0 3.0
   48    51    54    55  -0.25900  1.0 1.0
   48    51    54    55  -0.47000 -1.0 2.0
   48    51    54    55   0.11750  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    53   0.15000  1.0 3.0
   49    48    51    54   0.23400  1.0 3.0
   50    48    51    52   0.15000  1.0 3.0
   50    48    51    53   0.15000  1.0 3.0
   50    48    51    54   0.23400  1.0 3.0
   51    54    55    56   3.00000 -1.0 2.0
   51    54    55    57  -0.80800  1.0 1.0
   51    54    55    57   2.06850 -1.0 2.0
   52    51    54    55   0.08050  1.0 3.0
   53    51    54    55   0.08050  1.0 3.0
   54    55    57    58   2.56700 -1.0 2.0
   54    55    57    59   2.45000 -1.0 2.0
   55    57    59    60   0.00000  1.0 1.0
   55    57    59    61   0.00000  1.0 1.0
   55    57    59    62  -0.43950  1.0 1.0
   55    57    59    62  -0.08100 -1.0 2.0
   55    57    59    62   0.03350  1.0 3.0
   56    55    57    58   2.45000 -1.0 2.0
   56    55    57    59   3.04450 -1.0 2.0
   57    59    62    63   0.43900  1.0 1.0
   57    59    62    63   0.49100 -1.0 2.0
   57    59    62    63   0.28400  1.0 3.0
   57    59    62    67   0.43900  1.0 1.0
   57    59    62    67   0.49100 -1.0 2.0
   57    59    62    67   0.28400  1.0 3.0
   57    59    62    71   0.43900  1.0 1.0
   57    59    62    71   0.49100 -1.0 2.0
   57    59    62    71   0.28400  1.0 3.0
   58    57    59    60   0.00000  1.0 1.0
   58    57    59    61   0.00000  1.0 1.0
   58    57    59    62   0.00000  1.0 1.0
   59    62    63    64   0.15000  1.0 3.0
   59    62    63    65   0.15000  1.0 3.0
   59    62    63    66   0.15000  1.0 3.0
   59    62    67    68   0.15000  1.0 3.0
   59    62    67    69   0.15000  1.0 3.0
   59    62    67    70   0.15000  1.0 3.0
   59    62    71    72   0.15000  1.0 3.0
   59    62    71    73   0.15000  1.0 3.0
   59    62    71    74   0.56750  1.0 1.0
   59    62    71    74  -0.07550 -1.0 2.0
   59    62    71    74   0.20000  1.0 3.0
   60    59    62    63   0.15000  1.0 3.0
   60    59    62    67   0.15000  1.0 3.0
   60    59    62    71   0.15000  1.0 3.0
   61    59    62    63   0.15000  1.0 3.0
   61    59    62    67   0.15000  1.0 3.0
   61    59    62    71   0.15000  1.0 3.0
   62    71    74    75   0.56750  1.0 1.0
   62    71    74    75  -0.07550 -1.0 2.0
   62    71    74    75   0.20000  1.0 3.0
   62    71    74    79   0.56750  1.0 1.0
   62    71    74    79  -0.07550 -1.0 2.0
   62    71    74    79   0.20000  1.0 3.0
   62    71    74    83   0.56750  1.0 1.0
   62    71    74    83  -0.07550 -1.0 2.0
   62    71    74    83   0.20000  1.0 3.0
   63    62    67    68   0.15000  1.0 3.0
   63    62    67    69   0.15000  1.0 3.0
   63    62    67    70   0.15000  1.0 3.0
   63    62    71    72   0.15000  1.0 3.0
   63    62    71    73   0.15000  1.0 3.0
   63    62    71    74   0.56750  1.0 1.0
   63    62    71    74  -0.07550 -1.0 2.0
   63    62    71    74   0.20000  1.0 3.0
   67    62    63    64   0.15000  1.0 3.0
   67    62    63    65   0.15000  1.0 3.0
   67    62    63    66   0.15000  1.0 3.0
   67    62    71    72   0.15000  1.0 3.0
   67    62    71    73   0.15000  1.0 3.0
   67    62    71    74   0.56750  1.0 1.0
   67    62    71    74  -0.07550 -1.0 2.0
   67    62    71    74   0.20000  1.0 3.0
   71    62    63    64   0.15000  1.0 3.0
   71    62    63    65   0.15000  1.0 3.0
   71    62    63    66   0.15000  1.0 3.0
   71    62    67    68   0.15000  1.0 3.0
   71    62    67    69   0.15000  1.0 3.0
   71    62    67    70   0.15000  1.0 3.0
   71    74    75    76   0.15000  1.0 3.0
   71    74    75    77   0.15000  1.0 3.0
   71    74    75    78   0.15000  1.0 3.0
   71    74    79    80   0.15000  1.0 3.0
   71    74    79    81   0.15000  1.0 3.0
   71    74    79    82   0.15000  1.0 3.0
   71    74    83    84   0.15000  1.0 3.0
   71    74    83    85   0.15000  1.0 3.0
   71    74    83    86   0.56750  1.0 1.0
   71    74    83    86  -0.07550 -1.0 2.0
   71    74    83    86   0.20000  1.0 3.0
   72    71    74    75   0.15000  1.0 3.0
   72    71    74    79   0.15000  1.0 3.0
   72    71    74    83   0.15000  1.0 3.0
   73    71    74    75   0.15000  1.0 3.0
   73    71    74    79   0.15000  1.0 3.0
   73    71    74    83   0.15000  1.0 3.0
   74    83    86    87   0.15000  1.0 3.0
   74    83    86    88   0.15000  1.0 3.0
   74    83    86    89   0.43900  1.0 1.0
   74    83    86    89   0.49100 -1.0 2.0
   74    83    86    89   0.28400  1.0 3.0
   75    74    79    80   0.15000  1.0 3.0
   75    74    79    81   0.15000  1.0 3.0
   75    74    79    82   0.15000  1.0 3.0
   75    74    83    84   0.15000  1.0 3.0
   75    74    83    85   0.15000  1.0 3.0
   75    74    83    86   0.56750  1.0 1.0
   75    74    83    86  -0.07550 -1.0 2.0
   75    74    83    86   0.20000  1.0 3.0
   79    74    75    76   0.15000  1.0 3.0
   79    74    75    77   0.15000  1.0 3.0
   79    74    75    78   0.15000  1.0 3.0
   79    74    83    84   0.15000  1.0 3.0
   79    74    83    85   0.15000  1.0 3.0
   79    74    83    86   0.56750  1.0 1.0
   79    74    83    86  -0.07550 -1.0 2.0
   79    74    83    86   0.20000  1.0 3.0
   83    74    75    76   0.15000  1.0 3.0
   83    74    75    77   0.15000  1.0 3.0
   83    74    75    78   0.15000  1.0 3.0
   83    74    79    80   0.15000  1.0 3.0
   83    74    79    81   0.15000  1.0 3.0
   83    74    79    82   0.15000  1.0 3.0
   83    86    89    90   0.00000  1.0 1.0
   83    86    89    91  -0.43950  1.0 1.0
   83    86    89    91  -0.08100 -1.0 2.0
   83    86    89    91   0.03350  1.0 3.0
   84    83    86    87   0.15000  1.0 3.0
   84    83    86    88   0.15000  1.0 3.0
   84    83    86    89   0.15000  1.0 3.0
   85    83    86    87   0.15000  1.0 3.0
   85    83    86    88   0.15000  1.0 3.0
   85    83    86    89   0.15000  1.0 3.0
   86    89    91    92   3.04450 -1.0 2.0
   86    89    91    93   2.45000 -1.0 2.0
   87    86    89    90   0.00000  1.0 1.0
   87    86    89    91   0.00000  1.0 1.0
   88    86    89    90   0.00000  1.0 1.0
   88    86    89    91   0.00000  1.0 1.0
   89    91    93    94  -0.80800  1.0 1.0
   89    91    93    94   2.06850 -1.0 2.0
   90    89    91    92   2.45000 -1.0 2.0
   90    89    91    93   2.56700 -1.0 2.0
   91    93    94    95   0.08050  1.0 3.0
   91    93    94    96   0.08050  1.0 3.0
   91    93    94    97  -0.25900  1.0 1.0
   91    93    94    97  -0.47000 -1.0 2.0
   91    93    94    97   0.11750  1.0 3.0
   92    91    93    94   3.00000 -1.0 2.0
   93    94    97    98   0.23400  1.0 3.0
   93    94    97    99   0.23400  1.0 3.0
   93    94    97   100   1.11900  1.0 1.0
   93    94    97   100  -1.16350 -1.0 2.0
   93    94    97   100  -0.34150  1.0 3.0
   94    97   100   101  -0.25900  1.0 1.0
   94    97   100   101  -0.47000 -1.0 2.0
   94    97   100   101   0.11750  1.0 3.0
   95    94    97    98   0.15000  1.0 3.0
   95    94    97    99   0.15000  1.0 3.0
   95    94    97   100   0.23400  1.0 3.0
   96    94    97    98   0.15000  1.0 3.0
   96    94    97    99   0.15000  1.0 3.0
   96    94    97   100   0.23400  1.0 3.0
   97   100   101   102   3.00000 -1.0 2.0
   97   100   101   103   2.00000 -1.0 2.0
   98    97   100   101   0.08050  1.0 3.0
   99    97   100   101   0.08050  1.0 3.0
  100   101   103   104  -0.56150  1.0 1.0
  100   101   103   104   2.19150 -1.0 2.0
  100   101   103   107  -0.15000  1.0 1.0
  100   101   103   107   0.89550 -1.0 2.0
  100   101   103   107  -0.06900  1.0 3.0
  101   103   104   105   7.00000 -1.0 2.0
  101   103   104   106   7.00000 -1.0 2.0
  101   103   107   108   0.15000  1.0 3.0
  101   103   107   109   0.15000  1.0 3.0
  101   103   107   110   0.15000  1.0 3.0
  102   101   103   104   1.00000 -1.0 2.0
  102   101   103   107  -0.64400  1.0 1.0
  102   101   103   107   0.26850 -1.0 2.0
  104   103   107   108   0.00000  1.0 1.0
  104   103   107   109   0.00000  1.0 1.0
  104   103   107   110   0.00000  1.0 1.0
  107   103   104   105   7.00000 -1.0 2.0
  107   103   104   106   7.00000 -1.0 2.0
   43    39    41    42   0.30150 -1.0 2.0
   43    39    41    47   0.36750  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
   37    30    36    38  10.50000 -1.0 2.0
   39    47    41    42  10.50000 -1.0 2.0
   54    57    55    56  10.50000 -1.0 2.0
   58    55    57    59   1.00000 -1.0 2.0
   90    91    89    86   1.00000 -1.0 2.0
   89    93    91    92  10.50000 -1.0 2.0
  100   103   101   102  10.50000 -1.0 2.0
  101   107   103   104  15.00000 -1.0 2.0
  105   106   104   103  15.00000 -1.0 2.0
END
