* LIGAND DATABASE FILE (OPLS2005)
*
001     111   112    200    307     595
    1     0 S   NP   _N1_     1    28.91102    95.01152   -22.90935
    2     1 S   H    _HN1     2     1.02945    82.42291    17.24010
    3     1 S   H    _H1_     3     1.02831    29.88416   162.99190
    4     1 S   H    _H2_     4     1.02781   100.93758   -90.08108
    5     1 S   CT   _CA1     5     1.50104   137.14890   129.21621
    6     5 S   HC   _HA1     6     1.09582   105.18523    76.37293
    7     5 S   CO3  _C1_     7     1.53751   112.41333   -43.74917
    8     7 S   O2Z  _O11     8     1.26369   115.02046   -44.49673
    9     7 S   O2Z  _O12     9     1.26245   114.89321   134.54258
   10     5 S   CT   _CB1    10     1.53072   107.43093  -165.80120
   11    10 S   HC   HB11    11     1.09823   109.25056   -51.10161
   12    10 S   HC   HB12    12     1.09813   110.51698    65.48827
   13    10 S   CT   _CG1    13     1.52958   112.57179  -172.18043
   14    13 S   HC   HG11    14     1.09592   110.44107   -65.96948
   15    13 S   HC   HG12    15     1.09673   109.90701    53.17254
   16    13 S   C    _CD1    16     1.51822   112.39093   173.43114
   17    16 S   O    _OE1    17     1.22727   123.34911     0.59017
   18    16 S   N    _N2_    18     1.38582   111.51479  -179.02743
   19    18 S   H    _HN2    19     1.01598   118.86451     0.35663
   20    18 S   CT1  _CA2    20     1.46246   123.63641   178.63112
   21    20 S   HC   _HA2    21     1.09731   109.43756    -2.41768
   22    20 S   C    _C2_    22     1.53457   108.56491  -117.96483
   23    22 S   O    _O2_    23     1.23051   122.35828  -148.65254
   24    20 S   CT   _CB2    32     1.53231   111.09514   119.70011
   25    24 S   HC   HB21    33     1.09591   109.58171    54.59184
   26    24 S   HC   HB22    34     1.09496   110.96694   173.40019
   27    22 S   N    _N3_    24     1.38368   113.60859    38.95379
   28    27 S   H    _HN3    25     1.01617   119.49657    -3.75984
   29    24 S   S    _SG2    35     1.82753   111.13584   -67.13932
   30    27 S   CT   _CA3    26     1.45279   123.14794   176.94194
   31    30 S   HC   HA31    27     1.09553   107.54433   -63.47562
   32    30 S   HC   HA32    28     1.09560   107.92389    52.92648
   33    29 S   CT   _C21    36     1.82824    99.35601   146.79692
   34    33 S   HC   _H9_    37     1.09251   109.28445   -50.00393
   35    30 S   CO3  _C3_    29     1.52939   114.14770   174.91165
   36    35 S   O2Z  _O31    30     1.26365   116.08057    -0.22029
   37    35 S   O2Z  _O32    31     1.26434   114.40234   179.82641
   38    33 S   CM   _C10    38     1.53523   109.68694  -171.14095
   39    33 S   N    _N13   105     1.45590   109.97578    66.25269
   40    39 S   H    _H31   106     1.01410   116.61289    51.22098
   41    38 S   CMA  _C11    39     1.37318   123.56091   -83.30768
   42    41 S   OM   _O37    40     1.26363   128.98518     0.64437
   43    38 S   N    _N5_    68     1.39649   117.15459   100.42720
   44    43 S   H    _H16    69     1.01429   115.74504   160.96481
   45    39 S   C    _C22   107     1.38147   123.97920  -138.03150
   46    45 S   O    _O38   108     1.22856   125.44572     3.45185
   47    41 S   NE   _N6_    41     1.40201   120.40588   177.40158
   48    47 S   H    _H17    42     1.01262   115.42848   -12.93108
   49    45 S   N    _N14   109     1.37791   112.04603  -177.07457
   50    49 S   H    _H32   110     1.01300   121.73513     1.42985
   51    49 S   H    _H33   111     1.01320   120.59176  -179.65965
   52    47 S   CT1  _C12    43     1.47044   130.20329   164.74070
   53    52 S   HC   _H5_    44     1.09755   112.17937    14.61547
   54    52 S   C    _C13    45     1.53367   106.19850  -102.63393
   55    54 S   O    _O35    46     1.22812   123.37982  -114.15533
   56    52 S   CT   _C17    89     1.55002   109.57315   135.48383
   57    56 S   HC   _H7_    90     1.09902   109.00471    65.84241
   58    54 S   N    _N7_    47     1.38656   111.77456    65.36964
   59    58 S   H    _H18    48     1.01738   118.12863     0.53632
   60    56 S   CT   _C18    91     1.53044   111.56401  -173.21225
   61    60 S   HC   _H24    92     1.09683   111.53023    41.70743
   62    60 S   HC   _H25    93     1.09484   111.06600   -77.79829
   63    58 S   CT   _C14    49     1.45384   124.30685  -172.13618
   64    63 S   HC   _H19    50     1.09524   109.64859   -10.51638
   65    63 S   HC   _H20    51     1.09578   106.28306  -127.04717
   66    60 S   CD   _C19    94     1.50492   112.87087   161.48138
   67    66 S   HC   _H26    95     1.10286   116.19160   170.83337
   68    63 S   CT1  _C15    52     1.53819   112.27951   112.80281
   69    68 S   HC   _H6_    53     1.09698   108.31408   170.43133
   70    66 S   NI   _N10    96     1.28756   125.55338   -11.91681
   71    68 S   C    _C16    54     1.53045   112.84870   -70.65254
   72    71 S   O    _O36    55     1.22903   123.55113     7.20895
   73    68 S   NT   _N9_    86     1.46593   110.73911    50.65608
   74    73 S   H    _H22    87     1.01821   110.78114   174.12090
   75    73 S   H    _H23    88     1.01879   109.91613    56.74366
   76    70 S   CT   _C20    97     1.46219   117.19053     2.93505
   77    76 S   HC   _H8_    98     1.09674   107.64165    97.37323
   78    71 S   N    _N8_    56     1.38928   112.87361  -171.14144
   79    78 S   H    _H21    57     1.01498   119.33942    -5.33616
   80    56 S   NT   _N11    99     1.47099   110.23299   -53.02896
   81    80 S   H    _H27   100     1.01959   109.25838   -62.15710
   82    76 S   NP   _N12   101     1.48355   110.63095  -150.29213
   83    82 S   H    _H28   102     1.02603   110.37652    62.92249
   84    82 S   H    _H29   103     1.02645   110.92221   -56.78604
   85    82 S   H    _H30   104     1.02691   110.63273  -177.49189
   86    78 S   CT1  _C6_    58     1.45714   122.24973  -179.82196
   87    86 S   HC   _H3_    59     1.09602   108.82293   -31.31902
   88    86 S   C    _C7_    60     1.52739   105.18180    87.25274
   89    88 S   O    _O33    61     1.22915   122.42442    76.34269
   90    86 S   CT   _C5_    79     1.53104   110.49012  -151.94566
   91    90 S   HC   _H13    80     1.09708   110.84408   -63.18166
   92    90 S   HC   _H14    81     1.09723   109.32885    53.82304
   93    88 S   N    _N4_    62     1.38779   112.68629   -99.78755
   94    93 S   H    _H15    63     1.01570   118.87744     0.20367
   95    90 S   CT   _C4_    82     1.52245   112.26628   174.48338
   96    95 S   HC   _H10    83     1.09466   110.98722   -57.89540
   97    95 S   HC   _H11    84     1.09461   110.11797  -177.45516
   98    95 S   HC   _H12    85     1.09437   111.41374    62.92840
   99    93 S   CT1  _C8_    64     1.46174   123.93936  -176.63431
  100    99 S   HC   _H4_    65     1.09885   105.47775   177.30478
  101    99 S   C    _C9_    66     1.53568   110.05939   -68.74108
  102   101 S   O    _O34    67     1.22923   121.20968   139.62985
  103    99 S   CT   _C23    70     1.53759   113.62986    58.73476
  104   103 S   HC   _H34    71     1.09645   110.45785   -66.28084
  105   103 S   HC   _H35    72     1.09683   108.88034   176.38080
  106   103 S   NT   _N15    73     1.46725   110.63755    55.97257
  107   106 S   H    _H36    74     1.01948   109.08296   -59.77557
  108   106 S   CT   _C24    75     1.45627   111.01602   179.66428
  109   108 S   HC   _H37    76     1.09410   111.18322   -62.31574
  110   108 S   HC   _H38    77     1.09440   109.40706   179.20870
  111   108 S   HC   _H39    78     1.09482   111.58940    59.89420
  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
  13   6   2   1   1  13   8   3  10   4   8   3   4   3  10   4
   2   1   1  15   7  11   4  13   7   8   4   8   5   4  10   5
   4   6   2   9   6   8  10   4   3   1   1   7   6  10   4   5
   1   3   2   1   1  13   7  11   4   7   5   4   9   4   3   2
   1   1   9   6   5   1   8   4   3   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    43    39    40    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    47   101    43    44    39    40    45    46    49  
   38    41    43    39    40    45  
   36    37  
   37  
    0  
   41    42    47    48    52    99   101   102    43    44    39    40    45  
   40    45    46    49    50    51    41    43  
   45    46    49  
   42    47    48    52    53    54   101    43    44    56  
   47    48    52    43  
   44   103    47    93    99   100   101   102  
   99   101   102  
   46    49    50    51  
   49    50    51  
   48    52    53    54    55    58    56    57    60    80  
   52    53    54    56  
   50    51  
   51  
    0  
   53    54    55    58    59    63    56    57    60    61    62    66    76    80    81  
   54    55    58    56    57    60    80  
   55    58    59    63    64    65    68    56    57    60    80  
   58    59    63    56  
   57    60    61    62    66    67    70    76    77    80    81    82    58  
   60    61    62    66    76    80    81  
   59    63    64    65    68    69    71    73  
   63    64    65    68  
   61    62    66    67    70    76    80    81  
   62    66    67    70    80  
   66    67    70    80  
   64    65    68    69    71    72    78    73    74    75  
   65    68    69    71    73  
   68    69    71    73  
   67    70    76    77    80    82  
   70    76  
   69    71    72    78    79    86    73    74    75  
   71    72    78    73    74    75  
   76    77    80    81    82    83    84    85  
   72    78    79    86    87    88    90    73    74    75  
   78    79    86    73  
   74    75    78  
   75  
    0  
   77    80    81    82    83    84    85  
   80    81    82    83    84    85  
   79    86    87    88    89    93    90    91    92    95  
   86    87    88    90  
   81    82    83    84    85  
   82  
   83    84    85  
   84    85  
   85  
    0  
   87    88    89    93    94    99    90    91    92    95    96    97    98  
   88    89    93    90    91    92    95  
   89    93    94    99   100   101   103    90    91    92    95  
   93    94    99    90  
   91    92    95    96    97    98    93  
   92    95    96    97    98  
   95    96    97    98  
   94    99   100   101   102   103   104   105   106  
   99   100   101   103  
   96    97    98  
   97    98  
   98  
    0  
  100   101   102   103   104   105   106   107   108  
  101   102   103   104   105   106  
  102   103   104   105   106  
  103  
  104   105   106   107   108   109   110   111  
  105   106   107   108  
  106   107   108  
  107   108   109   110   111  
  108   109   110   111  
  109   110   111  
  110   111  
  111  
    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   0.259500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.549900   2.0020   1.7750   0.023028004  -0.852763146
   39   3.2500   0.1700  -0.518100   1.8100   1.6000   0.054801302  -1.445846770
   40   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   41   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   44   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   45   3.7500   0.1050   0.822000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.616300   1.8100   1.6000   0.001000000  -1.480495490
   47   3.2500   0.1700  -0.998700   2.1120   1.8750   0.051222218  -2.220205820
   48   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   49   3.2500   0.1700  -0.959200   1.8100   1.6000   0.054801302  -1.445846770
   50   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
   51   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
   52   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   56   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.2500   0.1700  -0.500000   2.1120   1.8750   0.051222218  -2.220205820
   59   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   60   3.5000   0.0660  -0.083900   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   66   3.7500   0.1050   0.313400   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.040200   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660   0.163900   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   71   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   72   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   73   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
   74   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   75   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   76   3.5000   0.0660   0.495000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   78   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   79   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   80   3.3000   0.1700  -0.702500   2.1120   1.8750   0.051222218  -2.220205820
   81   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   82   3.2500   0.1700  -0.300000   2.2900   2.0360   0.003973653   1.685851020
   83   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   84   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   85   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   86   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   89   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   90   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.2500   0.1700  -0.500000   2.1120   1.8750   0.051222218  -2.220205820
   94   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   95   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  101   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  103   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.3000   0.1700  -0.780000   2.1120   1.8750   0.051222218  -2.220205820
  107   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
  108   3.5000   0.0660   0.020000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   337.000  1.449
   38    41   465.000  1.376
   38    43   400.000  1.384
   41    42   745.000  1.250
   41    47   415.000  1.382
   47    48   434.000  1.010
   47    52   382.000  1.448
   52    53   340.000  1.090
   52    54   317.000  1.522
   52    56   268.000  1.529
   54    55   570.000  1.229
   54    58   490.000  1.335
   58    59   434.000  1.010
   58    63   337.000  1.449
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    68   268.000  1.529
   68    69   340.000  1.090
   68    71   317.000  1.522
   68    73   305.000  1.457
   71    72   570.000  1.229
   71    78   490.000  1.335
   78    79   434.000  1.010
   78    86   337.000  1.449
   86    87   340.000  1.090
   86    88   317.000  1.522
   86    90   268.000  1.529
   88    89   570.000  1.229
   88    93   490.000  1.335
   93    94   434.000  1.010
   93    99   337.000  1.449
   99   100   340.000  1.090
   99   101   317.000  1.522
   99   103   268.000  1.529
  101   102   570.000  1.229
  101    43   490.000  1.335
   43    44   434.000  1.010
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   382.000  1.448
  106   107   434.000  1.010
  106   108   382.000  1.448
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   111   340.000  1.090
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    95   268.000  1.529
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   340.000  1.090
   73    74   434.000  1.010
   73    75   434.000  1.010
   56    57   340.000  1.090
   56    60   268.000  1.529
   56    80   382.000  1.448
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    66   270.000  1.508
   66    67   370.000  1.093
   66    70   500.000  1.261
   70    76   315.000  1.435
   76    77   340.000  1.090
   76    80   382.000  1.448
   76    82   367.000  1.471
   80    81   434.000  1.010
   82    83   434.000  1.010
   82    84   434.000  1.010
   82    85   434.000  1.010
   39    40   434.000  1.010
   39    45   490.000  1.335
   45    46   570.000  1.229
   45    49   490.000  1.335
   49    50   434.000  1.010
   49    51   434.000  1.010
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    39    80.00000  108.62000
   33    38    41    70.00000  124.00000
   33    38    43    70.00000  113.82800
   33    39    40    38.00000  118.40000
   33    39    45    50.00000  121.90000
   38    33    34    35.00000  109.50000
   38    41    42    65.00000  137.10300
   38    41    47    75.00000  114.40000
   38    43   101    70.00000  120.89900
   38    43    44    45.00000  117.55000
   41    47    48    50.00000  121.48000
   41    47    52    50.00000  121.00000
   47    41    42   105.00000  113.92000
   47    52    53    35.00000  109.50000
   47    52    54    70.00000  113.51500
   47    52    56    80.00000  111.61500
   52    47    48    35.00000  112.50000
   52    54    55    80.00000  120.40000
   52    54    58    70.00000  116.60000
   52    56    57    37.50000  110.70000
   52    56    60    58.35000  112.70000
   52    56    80    56.20000  109.47000
   54    52    53    35.00000  109.50000
   54    58    59    35.00000  119.80000
   54    58    63    50.00000  121.90000
   58    54    55    80.00000  122.90000
   58    63    64    35.00000  109.50000
   58    63    65    35.00000  109.50000
   58    63    68    70.00000  110.72300
   63    58    59    38.00000  118.40000
   63    68    69    37.50000  110.70000
   63    68    71    63.00000  111.10000
   63    68    73    80.00000  111.22000
   65    63    64    33.00000  107.80000
   68    63    64    37.50000  110.70000
   68    63    65    37.50000  110.70000
   68    71    72    80.00000  120.40000
   68    71    78    70.00000  116.60000
   68    73    74    50.00000  111.55300
   68    73    75    50.00000  111.55300
   71    68    69    35.00000  109.50000
   71    78    79    35.00000  119.80000
   71    78    86    50.00000  121.90000
   78    71    72    80.00000  122.90000
   78    86    87    35.00000  109.50000
   78    86    88    63.00000  110.10000
   78    86    90    80.00000  109.70000
   86    78    79    38.00000  118.40000
   86    88    89    80.00000  120.40000
   86    88    93    70.00000  116.60000
   86    90    91    37.50000  110.70000
   86    90    92    37.50000  110.70000
   86    90    95    58.35000  112.70000
   88    86    87    35.00000  109.50000
   88    93    94    35.00000  119.80000
   88    93    99    50.00000  121.90000
   93    88    89    80.00000  122.90000
   93    99   100    35.00000  109.50000
   93    99   101    63.00000  110.10000
   93    99   103    80.00000  109.70000
   99    93    94    38.00000  118.40000
   99   101   102    80.00000  120.40000
   99   101    43    70.00000  116.60000
   99   103   104    37.50000  110.70000
   99   103   105    37.50000  110.70000
   99   103   106    56.20000  109.47000
  101    99   100    35.00000  109.50000
  101    43    44    35.00000  119.80000
   43    38    41    75.00000  120.83300
   43   101   102    80.00000  122.90000
  103    99   100    37.50000  110.70000
  103    99   101    63.00000  111.10000
  103   106   107    35.00000  109.50000
  103   106   108    51.80000  107.20000
  105   103   104    33.00000  107.80000
  106   103   104    35.00000  109.50000
  106   103   105    35.00000  109.50000
  106   108   109    35.00000  109.50000
  106   108   110    35.00000  109.50000
  106   108   111    35.00000  109.50000
  108   106   107    35.00000  109.50000
  110   108   109    33.00000  107.80000
  111   108   109    33.00000  107.80000
  111   108   110    33.00000  107.80000
   90    86    87    37.50000  110.70000
   90    86    88    63.00000  111.10000
   90    95    96    37.50000  110.70000
   90    95    97    37.50000  110.70000
   90    95    98    37.50000  110.70000
   92    90    91    33.00000  107.80000
   95    90    91    37.50000  110.70000
   95    90    92    37.50000  110.70000
   97    95    96    33.00000  107.80000
   98    95    96    33.00000  107.80000
   98    95    97    33.00000  107.80000
   73    68    69    50.00000  109.55000
   73    68    71    75.00000  111.54000
   75    73    74    43.60000  106.40000
   56    52    53    37.50000  110.70000
   56    52    54    63.00000  111.10000
   56    60    61    37.50000  110.70000
   56    60    62    37.50000  110.70000
   56    60    66    70.00000  111.76100
   56    80    76    51.80000  107.20000
   56    80    81    35.00000  109.50000
   60    56    57    37.50000  110.70000
   60    66    67    40.00000  113.58700
   60    66    70    65.00000  122.10100
   62    60    61    33.00000  107.80000
   66    60    61    45.00000  109.49600
   66    60    62    45.00000  109.49600
   66    70    76    70.00000  113.48600
   70    66    67    45.00000  120.55300
   70    76    77    50.00000  110.29200
   70    76    80    85.00000  109.00000
   70    76    82    85.00000  109.00000
   76    80    81    35.00000  109.50000
   76    82    83    35.00000  109.50000
   76    82    84    35.00000  109.50000
   76    82    85    35.00000  109.50000
   80    56    57    35.00000  109.50000
   80    56    60    56.20000  109.47000
   80    76    77    35.00000  109.50000
   82    76    77    35.00000  109.50000
   82    76    80    85.00000  109.00000
   84    82    83    35.00000  109.50000
   85    82    83    35.00000  109.50000
   85    82    84    35.00000  109.50000
   39    33    34    35.00000  109.50000
   39    33    38    75.00000  110.78400
   39    45    46    80.00000  122.90000
   39    45    49    90.00000  111.91700
   45    39    40    35.00000  119.80000
   45    49    50    35.00000  119.80000
   45    49    51    35.00000  119.80000
   49    45    46    80.00000  122.90000
   51    49    50    35.00000  120.00000
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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    39   0.01700  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    38    41   0.42700  1.0 1.0
   29    33    38    41  -0.70350 -1.0 2.0
   29    33    38    41  -0.43150  1.0 3.0
   29    33    38    43   0.09700  1.0 1.0
   29    33    38    43   0.15600 -1.0 2.0
   29    33    38    43  -0.50800  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    45  -0.42300  1.0 1.0
   29    33    39    45  -0.07000 -1.0 2.0
   29    33    39    45   0.04150  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    47   7.00000 -1.0 2.0
   33    38    43   101  -0.45200  1.0 1.0
   33    38    43   101   0.85900 -1.0 2.0
   33    38    43   101   0.16650  1.0 3.0
   33    38    43    44   2.40850 -1.0 2.0
   33    39    45    46   3.04450 -1.0 2.0
   33    39    45    49   4.56800  1.0 1.0
   33    39    45    49   0.31650 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    43  -0.18050  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    45   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    45  -0.19250  1.0 1.0
   38    33    39    45  -0.00500 -1.0 2.0
   38    33    39    45   0.17000  1.0 3.0
   38    41    47    48   1.00000 -1.0 2.0
   38    41    47    52  -0.54700  1.0 1.0
   38    41    47    52   1.23000 -1.0 2.0
   41    38    43   101  -0.18900  1.0 1.0
   41    38    43   101   1.70900 -1.0 2.0
   41    38    43    44   0.78350 -1.0 2.0
   41    47    52    53   0.00000  1.0 1.0
   41    47    52    54  -0.12500  1.0 1.0
   41    47    52    54  -0.12500 -1.0 2.0
   41    47    52    54   0.25000  1.0 3.0
   41    47    52    56   0.25450  1.0 1.0
   41    47    52    56  -0.61700 -1.0 2.0
   41    47    52    56  -0.23550  1.0 3.0
   42    41    47    48   1.00000 -1.0 2.0
   42    41    47    52   1.00000 -1.0 2.0
   47    52    54    55   0.00000  1.0 1.0
   47    52    54    58   0.37150  1.0 1.0
   47    52    54    58   1.25400 -1.0 2.0
   47    52    54    58  -0.40250  1.0 3.0
   47    52    56    57   0.22950  1.0 3.0
   47    52    56    60   1.26750  1.0 1.0
   47    52    56    60  -0.00950 -1.0 2.0
   47    52    56    60   0.30600  1.0 3.0
   47    52    56    80   4.29400  1.0 1.0
   47    52    56    80   0.12050 -1.0 2.0
   48    47    52    53   0.00000  1.0 1.0
   48    47    52    54   0.00000  1.0 1.0
   48    47    52    56   0.00000  1.0 1.0
   52    54    58    59   2.45000 -1.0 2.0
   52    54    58    63   1.15000  1.0 1.0
   52    54    58    63   3.04450 -1.0 2.0
   52    56    60    61   0.15000  1.0 3.0
   52    56    60    62   0.15000  1.0 3.0
   52    56    60    66   0.34400  1.0 1.0
   52    56    60    66   0.09450 -1.0 2.0
   52    56    60    66   0.11100  1.0 3.0
   52    56    80    76   0.23450  1.0 1.0
   52    56    80    76   0.02050 -1.0 2.0
   52    56    80    76   0.25250  1.0 3.0
   52    56    80    81  -0.05950  1.0 1.0
   52    56    80    81   0.08850 -1.0 2.0
   52    56    80    81   0.11750  1.0 3.0
   53    52    54    55   0.00000  1.0 1.0
   53    52    54    58   0.00000  1.0 1.0
   53    52    56    57   0.15000  1.0 3.0
   53    52    56    60   0.15000  1.0 3.0
   53    52    56    80   0.15000  1.0 3.0
   54    52    56    57  -0.03800  1.0 3.0
   54    52    56    60  -0.84850  1.0 1.0
   54    52    56    60  -0.22800 -1.0 2.0
   54    52    56    60   0.29250  1.0 3.0
   54    52    56    80  -3.56550  1.0 1.0
   54    52    56    80  -0.67500 -1.0 2.0
   54    52    56    80   1.11300  1.0 3.0
   54    58    63    64   0.00000  1.0 1.0
   54    58    63    65   0.00000  1.0 1.0
   54    58    63    68  -0.43950  1.0 1.0
   54    58    63    68  -0.08100 -1.0 2.0
   54    58    63    68   0.03350  1.0 3.0
   55    54    58    59   2.45000 -1.0 2.0
   55    54    58    63   3.04450 -1.0 2.0
   58    63    68    69   0.15000  1.0 3.0
   58    63    68    71  -2.10200  1.0 1.0
   58    63    68    71  -0.31600 -1.0 2.0
   58    63    68    71   0.13050  1.0 3.0
   58    63    68    73   2.65250  1.0 1.0
   58    63    68    73   0.86150 -1.0 2.0
   59    58    63    64   0.00000  1.0 1.0
   59    58    63    65   0.00000  1.0 1.0
   59    58    63    68   0.00000  1.0 1.0
   63    68    71    72   0.00000  1.0 1.0
   63    68    71    78   0.93250  1.0 1.0
   63    68    71    78   0.04450 -1.0 2.0
   63    68    71    78   0.17550  1.0 3.0
   63    68    73    74  -0.05950  1.0 1.0
   63    68    73    74   0.08850 -1.0 2.0
   63    68    73    74   0.11750  1.0 3.0
   63    68    73    75  -0.05950  1.0 1.0
   63    68    73    75   0.08850 -1.0 2.0
   63    68    73    75   0.11750  1.0 3.0
   64    63    68    69   0.15000  1.0 3.0
   64    63    68    71  -0.03800  1.0 3.0
   64    63    68    73   0.15000  1.0 3.0
   65    63    68    69   0.15000  1.0 3.0
   65    63    68    71  -0.03800  1.0 3.0
   65    63    68    73   0.15000  1.0 3.0
   68    71    78    79   2.45000 -1.0 2.0
   68    71    78    86   1.15000  1.0 1.0
   68    71    78    86   3.04450 -1.0 2.0
   69    68    71    72   0.00000  1.0 1.0
   69    68    71    78   0.00000  1.0 1.0
   69    68    73    74   0.20000  1.0 3.0
   69    68    73    75   0.20000  1.0 3.0
   71    68    73    74   0.21900  1.0 1.0
   71    68    73    74  -0.24900 -1.0 2.0
   71    68    73    74   0.15200  1.0 3.0
   71    68    73    75   0.21900  1.0 1.0
   71    68    73    75  -0.24900 -1.0 2.0
   71    68    73    75   0.15200  1.0 3.0
   71    78    86    87   0.00000  1.0 1.0
   71    78    86    88  -0.29800  1.0 1.0
   71    78    86    88   0.13950 -1.0 2.0
   71    78    86    88  -2.45650  1.0 3.0
   71    78    86    90   0.25950  1.0 1.0
   71    78    86    90   0.43850 -1.0 2.0
   71    78    86    90   2.61650  1.0 3.0
   72    71    78    79   2.45000 -1.0 2.0
   72    71    78    86   3.04450 -1.0 2.0
   78    86    88    89   0.00000  1.0 1.0
   78    86    88    93   0.37150  1.0 1.0
   78    86    88    93   1.25400 -1.0 2.0
   78    86    88    93  -0.40250  1.0 3.0
   78    86    90    91   0.23200  1.0 3.0
   78    86    90    92   0.23200  1.0 3.0
   78    86    90    95   0.42250  1.0 1.0
   78    86    90    95  -0.48100 -1.0 2.0
   78    86    90    95   0.35650  1.0 3.0
   79    78    86    87   0.00000  1.0 1.0
   79    78    86    88   0.00000  1.0 1.0
   79    78    86    90   0.00000  1.0 1.0
   86    88    93    94   2.45000 -1.0 2.0
   86    88    93    99   1.15000  1.0 1.0
   86    88    93    99   3.04450 -1.0 2.0
   86    90    95    96   0.15000  1.0 3.0
   86    90    95    97   0.15000  1.0 3.0
   86    90    95    98   0.15000  1.0 3.0
   87    86    88    89   0.00000  1.0 1.0
   87    86    88    93   0.00000  1.0 1.0
   87    86    90    91   0.15000  1.0 3.0
   87    86    90    92   0.15000  1.0 3.0
   87    86    90    95   0.15000  1.0 3.0
   88    86    90    91  -0.03800  1.0 3.0
   88    86    90    92  -0.03800  1.0 3.0
   88    86    90    95  -0.84850  1.0 1.0
   88    86    90    95  -0.22800 -1.0 2.0
   88    86    90    95   0.29250  1.0 3.0
   88    93    99   100   0.00000  1.0 1.0
   88    93    99   101  -0.29800  1.0 1.0
   88    93    99   101   0.13950 -1.0 2.0
   88    93    99   101  -2.45650  1.0 3.0
   88    93    99   103   0.25950  1.0 1.0
   88    93    99   103   0.43850 -1.0 2.0
   88    93    99   103   2.61650  1.0 3.0
   89    88    93    94   2.45000 -1.0 2.0
   89    88    93    99   3.04450 -1.0 2.0
   93    99   101   102   0.00000  1.0 1.0
   93    99   101    43   0.37150  1.0 1.0
   93    99   101    43   1.25400 -1.0 2.0
   93    99   101    43  -0.40250  1.0 3.0
   93    99   103   104   0.23200  1.0 3.0
   93    99   103   105   0.23200  1.0 3.0
   93    99   103   106   2.65250  1.0 1.0
   93    99   103   106   0.86150 -1.0 2.0
   94    93    99   100   0.00000  1.0 1.0
   94    93    99   101   0.00000  1.0 1.0
   94    93    99   103   0.00000  1.0 1.0
   99   101    43    38   0.67100  1.0 1.0
   99   101    43    38   1.42150 -1.0 2.0
   99   101    43    38   0.18700  1.0 3.0
   99   101    43    44   2.45000 -1.0 2.0
   99   103   106   107  -0.05950  1.0 1.0
   99   103   106   107   0.08850 -1.0 2.0
   99   103   106   107   0.11750  1.0 3.0
   99   103   106   108   0.23450  1.0 1.0
   99   103   106   108   0.02050 -1.0 2.0
   99   103   106   108   0.25250  1.0 3.0
  100    99   101   102   0.00000  1.0 1.0
  100    99   101    43   0.00000  1.0 1.0
  100    99   103   104   0.15000  1.0 3.0
  100    99   103   105   0.15000  1.0 3.0
  100    99   103   106   0.15000  1.0 3.0
  101    99   103   104  -0.03800  1.0 3.0
  101    99   103   105  -0.03800  1.0 3.0
  101    99   103   106  -3.56550  1.0 1.0
  101    99   103   106  -0.67500 -1.0 2.0
  101    99   103   106   1.11300  1.0 3.0
  102   101    43    38   2.67200 -1.0 2.0
  102   101    43    44   2.45000 -1.0 2.0
   43    38    41    42   7.00000 -1.0 2.0
   43    38    41    47   7.00000 -1.0 2.0
  103    99   101   102   0.00000  1.0 1.0
  103    99   101    43   0.93250  1.0 1.0
  103    99   101    43   0.04450 -1.0 2.0
  103    99   101    43   0.17550  1.0 3.0
  103   106   108   109   0.28000  1.0 3.0
  103   106   108   110   0.28000  1.0 3.0
  103   106   108   111   0.28000  1.0 3.0
  104   103   106   107   0.20000  1.0 3.0
  104   103   106   108   0.28000  1.0 3.0
  105   103   106   107   0.20000  1.0 3.0
  105   103   106   108   0.28000  1.0 3.0
  107   106   108   109   0.20000  1.0 3.0
  107   106   108   110   0.20000  1.0 3.0
  107   106   108   111   0.20000  1.0 3.0
   90    86    88    89   0.00000  1.0 1.0
   90    86    88    93   0.93250  1.0 1.0
   90    86    88    93   0.04450 -1.0 2.0
   90    86    88    93   0.17550  1.0 3.0
   91    90    95    96   0.15000  1.0 3.0
   91    90    95    97   0.15000  1.0 3.0
   91    90    95    98   0.15000  1.0 3.0
   92    90    95    96   0.15000  1.0 3.0
   92    90    95    97   0.15000  1.0 3.0
   92    90    95    98   0.15000  1.0 3.0
   73    68    71    72   0.30150 -1.0 2.0
   73    68    71    78   0.00000  1.0 1.0
   56    52    54    55   0.00000  1.0 1.0
   56    52    54    58   0.93250  1.0 1.0
   56    52    54    58   0.04450 -1.0 2.0
   56    52    54    58   0.17550  1.0 3.0
   56    60    66    67   0.00000  1.0 1.0
   56    60    66    70   0.00000  1.0 1.0
   57    56    60    61   0.15000  1.0 3.0
   57    56    60    62   0.15000  1.0 3.0
   57    56    60    66   0.15000  1.0 3.0
   57    56    80    76   0.28000  1.0 3.0
   57    56    80    81   0.20000  1.0 3.0
   60    56    80    76   0.23450  1.0 1.0
   60    56    80    76   0.02050 -1.0 2.0
   60    56    80    76   0.25250  1.0 3.0
   60    56    80    81  -0.15950  1.0 1.0
   60    56    80    81   0.34650 -1.0 2.0
   60    56    80    81   0.05750  1.0 3.0
   60    66   -70    76   6.00000 -1.0 2.0
   61    60    66    67   0.00000  1.0 1.0
   61    60    66    70   0.00000  1.0 1.0
   62    60    66    67   0.00000  1.0 1.0
   62    60    66    70   0.00000  1.0 1.0
   66    70    76    77  -0.15000  1.0 3.0
   66    70    76    80  -0.12500  1.0 1.0
   66    70    76    80  -0.12500 -1.0 2.0
   66    70    76    80   0.25000  1.0 3.0
   66    70    76    82  -0.12500  1.0 1.0
   66    70    76    82  -0.12500 -1.0 2.0
   66    70    76    82   0.25000  1.0 3.0
   67    66    70    76  -0.02700  1.0 1.0
   67    66    70    76   5.27600 -1.0 2.0
   70    76   -80    56   0.23200  1.0 1.0
   70    76   -80    56   0.02100 -1.0 2.0
   70    76   -80    56   0.24950  1.0 3.0
   70    76    80    81  -0.05900  1.0 1.0
   70    76    80    81   0.08350 -1.0 2.0
   70    76    80    81   0.12500  1.0 3.0
   70    76    82    83   0.17350  1.0 3.0
   70    76    82    84   0.17350  1.0 3.0
   70    76    82    85   0.17350  1.0 3.0
   77    76    80    56   0.28000  1.0 3.0
   77    76    80    81   0.20000  1.0 3.0
   77    76    82    83   0.13050  1.0 3.0
   77    76    82    84   0.13050  1.0 3.0
   77    76    82    85   0.13050  1.0 3.0
   80    56    60    61   0.15000  1.0 3.0
   80    56    60    62   0.15000  1.0 3.0
   80    56   -60    66   0.59950  1.0 1.0
   80    56   -60    66  -0.21400 -1.0 2.0
   80    56   -60    66   0.56200  1.0 3.0
   80    76    82    83   0.17350  1.0 3.0
   80    76    82    84   0.17350  1.0 3.0
   80    76    82    85   0.17350  1.0 3.0
   82    76    80    56   0.23200  1.0 1.0
   82    76    80    56   0.02100 -1.0 2.0
   82    76    80    56   0.24950  1.0 3.0
   82    76    80    81  -0.05900  1.0 1.0
   82    76    80    81   0.08350 -1.0 2.0
   82    76    80    81   0.12500  1.0 3.0
   39    33    38    41   0.62150  1.0 1.0
   39    33    38    41   0.42850 -1.0 2.0
   39    33    38    41  -0.68200  1.0 3.0
   39    33    38    43   0.09700  1.0 1.0
   39    33    38    43   0.15600 -1.0 2.0
   39    33    38    43  -0.50800  1.0 3.0
   39    45    49    50   2.56700 -1.0 2.0
   39    45    49    51   2.56700 -1.0 2.0
   40    39    45    46   2.45000 -1.0 2.0
   40    39    45    49   2.56700 -1.0 2.0
   46    45    49    50   2.45000 -1.0 2.0
   46    45    49    51   2.45000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    43    38    41   1.10000 -1.0 2.0
   47    42    41    38   1.10000 -1.0 2.0
   48    41    47    52   1.00000 -1.0 2.0
   52    58    54    55  10.50000 -1.0 2.0
   59    54    58    63   1.00000 -1.0 2.0
   68    78    71    72  10.50000 -1.0 2.0
   79    71    78    86   1.00000 -1.0 2.0
   86    93    88    89  10.50000 -1.0 2.0
   94    88    93    99   1.00000 -1.0 2.0
   99    43   101   102  10.50000 -1.0 2.0
   44   101    43    38   1.00000 -1.0 2.0
   60    67    66    70  10.50000 -1.0 2.0
   40    45    39    33   1.00000 -1.0 2.0
   39    49    45    46  10.50000 -1.0 2.0
   51    45    49    50   1.00000 -1.0 2.0
END
