* LIGAND DATABASE FILE (OPLS2005)
*
001     108   110    197    300     575
    1     0 S   NP   _N1_     1    28.63607    94.50042   -24.01217
    2     1 S   H    _HN1     2     1.02835    29.90862  -174.63257
    3     1 S   H    _H1_     3     1.02781   107.00054   -78.16585
    4     1 S   H    _H2_     4     1.02959    79.41688    27.92690
    5     1 S   CT   _CA1     5     1.50124   133.04816   136.02376
    6     5 S   HC   _HA1     6     1.09578   105.21626    83.06090
    7     5 S   CO3  _C1_     7     1.53769   112.35722   -37.11241
    8     7 S   O2Z  _O11     8     1.26359   115.00687   -44.74311
    9     7 S   O2Z  _O12     9     1.26237   114.90772   134.34959
   10     5 S   CT   _CB1    10     1.53086   107.41489  -159.08467
   11    10 S   HC   HB11    11     1.09829   109.26836   -51.00146
   12    10 S   HC   HB12    12     1.09817   110.44743    65.52066
   13    10 S   CT   _CG1    13     1.53028   112.71006  -172.09910
   14    13 S   HC   HG11    14     1.09595   110.48027   -64.89762
   15    13 S   HC   HG12    15     1.09658   109.94155    54.33539
   16    13 S   C    _CD1    16     1.51838   112.26715   174.63984
   17    16 S   O    _OE1    17     1.22730   123.21678     0.06256
   18    16 S   N    _N2_    18     1.38631   111.68989  -179.66428
   19    18 S   H    _HN2    19     1.01586   119.08226     0.96408
   20    18 S   CT1  _CA2    20     1.46155   123.38825   179.10213
   21    20 S   HC   _HA2    21     1.09744   109.35340    -1.70720
   22    20 S   C    _C2_    22     1.53570   109.09004  -117.30624
   23    22 S   O    _O2_    23     1.23076   122.07246  -149.14861
   24    20 S   CT   _CB2    32     1.53278   111.50653   120.20332
   25    24 S   HC   HB21    33     1.09519   110.13611    55.09538
   26    24 S   HC   HB22    34     1.09454   109.85770   174.03826
   27    22 S   N    _N3_    24     1.38454   113.71373    38.45727
   28    27 S   H    _HN3    25     1.01485   118.97568    -0.68700
   29    24 S   S    _SG2    35     1.82760   111.79111   -66.14431
   30    27 S   CT   _CA3    26     1.45441   123.43110   175.21902
   31    30 S   HC   HA31    27     1.09524   109.30618    24.29164
   32    30 S   HC   HA32    28     1.09501   107.13884   141.26123
   33    29 S   CT   _C24    36     1.84841    99.21286  -169.94506
   34    33 S   HC   _H3_    37     1.09187   107.21762    37.95817
   35    30 S   CO3  _C3_    29     1.52890   112.91571   -99.22782
   36    35 S   O2Z  _O31    30     1.26416   115.27076   -49.14150
   37    35 S   O2Z  _O32    31     1.26338   115.06780   131.73313
   38    33 S   CM   _C11    38     1.51334   106.88876   -81.47990
   39    38 S   HC   _H45    39     1.09233   114.27253   -72.18640
   40    33 S   CT   _C25    87     1.56802   111.34058   154.97127
   41    40 S   HC   _H58    88     1.09787   108.15948    59.44424
   42    38 S   CMA  _C15    40     1.35632   128.71526   108.39894
   43    42 S   OM   _O33    41     1.26123   126.59999   179.42325
   44    40 S   CT   _C28    89     1.54350   109.57593   176.36342
   45    44 S   HC   _H63    90     1.09527   111.41361    59.98148
   46    44 S   HC   _H64    91     1.09461   111.44048   -60.53513
   47    44 S   HC   _H65    92     1.09334   111.72203  -179.00319
   48    42 S   NE   _N30    42     1.39585   121.08463    -1.16113
   49    48 S   H    _H73    43     1.01244   115.52505     3.32496
   50    48 S   CT   _C20    44     1.45356   130.63647  -175.03722
   51    50 S   HC   _H50    45     1.09659   108.00658   141.45138
   52    50 S   HC   _H51    46     1.09570   112.71522    24.70708
   53    50 S   CM   _C8_    47     1.49966   109.34775   -98.08054
   54    53 S   HC   _H42    48     1.08763   116.21669    66.11391
   55    53 S   CM   _C7_    49     1.34303   123.54845  -115.91268
   56    55 S   HC   _H41    50     1.08805   119.09459     0.16071
   57    55 S   CM   _C13    51     1.45886   125.21026  -177.22589
   58    57 S   CM   _C9_    52     1.34890   121.44443   -47.18742
   59    58 S   HC   _H43    53     1.09102   117.88727    -0.71628
   60    57 S   CT   _C27   105     1.50505   113.41492   136.00688
   61    60 S   HC   _H60   106     1.09630   110.90158    45.58862
   62    60 S   HC   _H61   107     1.09527   110.21958   -74.21933
   63    60 S   HC   _H62   108     1.09241   113.22261   164.57678
   64    58 S   CT   _C23    54     1.50986   129.27490   179.02141
   65    64 S   HC   _H56    55     1.09674   107.59853  -153.50749
   66    64 S   CT   _C21    56     1.53052   112.46992    84.80439
   67    66 S   HC   _H52    57     1.09596   109.80730   -55.26653
   68    66 S   HC   _H53    58     1.09636   110.54704  -172.33802
   69    64 S   OH   _O39   103     1.42504   110.68537   -38.13949
   70    69 S   HO   _H74   104     0.97225   107.56824  -173.43012
   71    66 S   CO4  _C17    59     1.51897   112.77861    67.16988
   72    71 S   O    _O36    60     1.23207   121.32532    32.45590
   73    71 S   CT   _C18    61     1.51634   116.60725  -151.55073
   74    73 S   HC   _H46    62     1.09436   109.81618    26.40795
   75    73 S   HC   _H47    63     1.09402   108.60687   -91.89447
   76    73 S   CRA  _C6_    64     1.47799   109.07353   145.59001
   77    76 S   N5B  _N29    65     1.31658   128.40528   -75.83428
   78    77 S   C5B  _C5_    66     1.37611   104.14977   177.55367
   79    78 S   C5A  _C4_    67     1.37918   108.84853     0.40542
   80    79 S   HA   _H40    68     1.08008   135.01014  -178.97168
   81    78 S   C    _C12    70     1.45638   125.62827  -176.26765
   82    81 S   O    _O34    71     1.23077   119.02095   163.65140
   83    76 S   OA   _O37    69     1.36567   116.91148   102.56396
   84    81 S   N    _N31    72     1.39747   117.72138   -17.14774
   85    84 S   CM   _C14    73     1.38314   125.47578   168.72308
   86    85 S   CM   _C10    74     1.33833   112.26087   168.35060
   87    86 S   HC   _H44    75     1.08109   125.63466   178.09074
   88    85 S   CO4  _C16    82     1.47406   126.92615   -17.31455
   89    88 S   O    _O35    83     1.22156   123.90004   146.62377
   90    86 S   CT   _C19    76     1.49283   110.78347    -0.85798
   91    90 S   HC   _H48    77     1.09390   112.04063   126.55835
   92    90 S   HC   _H49    78     1.09458   110.58002  -111.73416
   93    88 S   OS   _O38    84     1.35746   108.72083   -39.62701
   94    84 S   CT   _C22    79     1.47829   126.39038   -17.68143
   95    94 S   HC   _H54    80     1.09592   108.48789    77.46112
   96    94 S   HC   _H55    81     1.09481   110.47567   -42.55636
   97    93 S   CT   _C26    85     1.45054   119.19222  -164.08242
   98    97 S   HC   _H59    86     1.09582   110.17255     7.97486
   99    97 S   CT   _C31    93     1.55196   108.69419  -109.20634
  100    99 S   HC   _H72    94     1.09679   109.36720   -51.31196
  101    99 S   CT   _C29    95     1.53573   110.93526    65.53237
  102   101 S   HC   _H66    96     1.09535   111.19019    59.77736
  103   101 S   HC   _H67    97     1.09314   111.59588   -61.02116
  104   101 S   HC   _H68    98     1.09552   110.73383   179.72804
  105    99 S   CT   _C30    99     1.53073   112.49772  -172.47319
  106   105 S   HC   _H69   100     1.09527   111.15859   -55.26044
  107   105 S   HC   _H70   101     1.09554   110.84150  -175.28034
  108   105 S   HC   _H71   102     1.09373   111.61184    65.68748
  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   9   5   4   3
  16   7   2   1   1  10   4  14   8   7   3   7   3   2   1   7
   4   7   4   3   6   3   9   3  10  13   5   4   2   1   1   9
   6  10   5   4   2   1   7   4   7   4   3   6   7   8   5   2
  10   3   1  12  12  10   5   7   2   5   4   3   6   2   1   1
  11   4   9   8   7   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    97    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    48    93    97    98    40    41    44    45    46    47    99  
   38    39    42    97    40    41    44  
   36    37  
   37  
    0  
   39    42    43    48    49    50    97    40    41    44  
   42    43    48    40  
   41    44    45    46    47    99   100   101   105    42    88    93    97    98  
   44    45    46    47    99    93    97    98  
   43    48    49    50    51    52    53  
   48    49    50  
   45    46    47    99    93    97    98  
   46    47    97  
   47    97  
   97  
   49    50    51    52    53    54    55  
   50    51    52    53  
   51    52    53    54    55    56    57  
   52    53    54    55  
   53    54    55  
   54    55    56    57    58    60  
   55    56    57  
   56    57    58    59    64    60    61    62    63  
   57    58    60  
   58    59    64    65    66    69    60    61    62    63  
   59    64    65    66    67    68    71    69    70    60    61    62    63  
   64    65    66    69    60  
   61    62    63    64  
   62    63  
   63  
    0  
   65    66    67    68    71    72    73    69    70  
   66    67    68    71    69    70  
   67    68    71    72    73    74    75    76    69    70  
   68    71    72    73    69  
   71    72    73    69  
   70    71  
    0  
   72    73    74    75    76    77    83  
   73    74    75    76  
   74    75    76    77    78    79    83  
   75    76    77    83  
   76    77    83  
   77    78    79    80    83    81  
   78    79    80    83    81    82    84  
   79    80    83    81    82    84    85    94  
   80    83    81    82    84  
   83    81  
   82    84    85    86    90    94    95    96    88    83  
   84    85    94  
    0  
   85    86    87    90    91    92    94    95    96    88    89    93  
   86    87    90    91    92    94    95    96    88    89    93    97  
   87    90    91    92    94    95    96    88    89    93  
   90    91    92    94    88  
   89    93    97    98    99    90    94  
   93    97  
   91    92    94    95    96  
   92    94    95    96  
   94    95    96  
   97    98    99   100   101   105  
   95    96  
   96  
    0  
   98    99   100   101   102   103   104   105   106   107   108  
   99   100   101   105  
  100   101   102   103   104   105   106   107   108  
  101   102   103   104   105   106   107   108  
  102   103   104   105   106   107   108  
  103   104   105  
  104   105  
  105  
  106   107   108  
  107   108  
  108  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.2500   0.1700  -1.111500   1.8650   1.6500   0.051222218  -2.220205820
   49   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660   0.115300   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   72   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   73   3.5000   0.0660  -0.005000   2.4950   1.7500   0.005000000  -0.741685710
   74   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   75   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   76   3.5500   0.0700   0.439000   2.5000   1.7750   0.001000000  -0.843144165
   77   3.2500   0.1700  -0.590000   1.8650   1.6500   0.001000000  -0.511443539
   78   3.5500   0.0700   0.145000   2.5000   1.7750   0.001000000  -0.843144165
   79   3.5500   0.0700  -0.148000   2.0020   1.7750   0.001000000  -0.843144165
   80   2.4200   0.0300   0.181000   1.3810   1.2100   0.030040813   0.268726247
   81   3.7500   0.1050   0.615000   1.9250   1.7000   0.001000000  -0.126889456
   82   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   83   2.9000   0.1400  -0.257000   1.6450   1.4500   0.001000000  -0.126889456
   84   3.2500   0.1700   0.003200   1.8100   1.6000   0.054801302  -1.445846770
   85   3.5500   0.0760  -0.073200   2.0020   1.7750   0.023028004  -0.852763146
   86   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   87   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   88   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   89   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   90   3.5000   0.0660  -0.120000   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   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   94   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   99   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   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    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    40   268.000  1.529
   38    39   340.000  1.080
   38    42   465.000  1.376
   42    43   745.000  1.250
   42    48   415.000  1.382
   48    49   434.000  1.010
   48    50   382.000  1.448
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   317.000  1.510
   53    54   340.000  1.080
   53    55   549.000  1.340
   55    56   340.000  1.080
   55    57   380.000  1.444
   57    58   549.000  1.340
   57    60   317.000  1.510
   58    59   340.000  1.080
   58    64   317.000  1.510
   64    65   340.000  1.090
   64    66   268.000  1.529
   64    69   320.000  1.410
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    71   317.000  1.522
   71    72   570.000  1.229
   71    73   317.000  1.522
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   295.000  1.488
   76    77   488.000  1.335
   76    83   462.000  1.357
   77    78   410.000  1.394
   78    79   520.000  1.370
   78    81   310.000  1.477
   79    80   367.000  1.080
   79    83   340.000  1.360
   81    82   570.000  1.229
   81    84   490.000  1.335
   84    85   400.000  1.384
   84    94   337.000  1.449
   85    86   549.000  1.340
   85    88   320.000  1.462
   86    87   340.000  1.080
   86    90   317.000  1.510
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    94   268.000  1.529
   94    95   340.000  1.090
   94    96   340.000  1.090
   88    89   570.000  1.229
   88    93   214.000  1.327
   93    97   320.000  1.410
   97    98   340.000  1.090
   97    40   268.000  1.529
   97    99   268.000  1.529
   40    41   340.000  1.090
   40    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   99   100   340.000  1.090
   99   101   268.000  1.529
   99   105   268.000  1.529
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   340.000  1.090
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   340.000  1.090
   69    70   553.000  0.945
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    42    70.00000  124.00000
   33    40    97    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    44    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    42    43    65.00000  137.10300
   38    42    48    75.00000  114.40000
   42    38    39    40.00000  120.50800
   42    48    49    50.00000  121.48000
   42    48    50    50.00000  121.00000
   48    42    43   105.00000  113.92000
   48    50    51    35.00000  109.50000
   48    50    52    35.00000  109.50000
   48    50    53    80.00000  112.42400
   50    48    49    35.00000  112.50000
   50    53    54    35.00000  117.00000
   50    53    55    70.00000  124.00000
   52    50    51    33.00000  107.80000
   53    50    51    35.00000  109.50000
   53    50    52    35.00000  109.50000
   53    55    56    35.00000  120.00000
   53    55    57    70.00000  123.01800
   55    53    54    35.00000  120.00000
   55    57    58    70.00000  123.01800
   55    57    60    70.00000  124.00000
   57    55    56    35.00000  120.00000
   57    58    59    35.00000  120.00000
   57    58    64    70.00000  124.00000
   57    60    61    35.00000  109.50000
   57    60    62    35.00000  109.50000
   57    60    63    35.00000  109.50000
   58    64    65    35.00000  109.50000
   58    64    66    70.00000  112.02700
   58    64    69    90.00000  110.39200
   64    58    59    35.00000  117.00000
   64    66    67    37.50000  110.70000
   64    66    68    37.50000  110.70000
   64    66    71    63.00000  111.10000
   64    69    70    55.00000  108.50000
   66    64    65    37.50000  110.70000
   66    71    72    80.00000  120.40000
   66    71    73    70.00000  116.00000
   68    66    67    33.00000  107.80000
   71    66    67    35.00000  109.50000
   71    66    68    35.00000  109.50000
   71    73    74    35.00000  109.50000
   71    73    75    35.00000  109.50000
   71    73    76    75.00000  105.85400
   73    71    72    80.00000  120.40000
   73    76    77    65.00000  125.57700
   73    76    83    80.00000  117.62500
   75    73    74    33.00000  107.80000
   76    73    74    45.00000  109.19200
   76    73    75    45.00000  109.19200
   76    77    78    70.00000  110.00000
   76    83    79    70.00000  104.00000
   77    78    79    70.00000  111.00000
   77    78    81    65.00000  122.69000
   78    79    80    35.00000  130.70000
   78    79    83    70.00000  108.00000
   78    81    82    80.00000  122.33200
   78    81    84    75.00000  113.48100
   83    76    77    70.00000  115.00000
   83    79    80    35.00000  113.40000
   81    78    79    60.00000  124.35000
   81    84    85    70.00000  120.89900
   81    84    94    50.00000  121.90000
   84    81    82    80.00000  122.90000
   84    85    86    75.00000  120.83300
   84    85    88    70.00000  117.92000
   84    94    90    70.00000  110.72300
   84    94    95    35.00000  109.50000
   84    94    96    35.00000  109.50000
   85    86    87    35.00000  120.00000
   85    86    90    70.00000  124.00000
   85    88    89    80.00000  123.72100
   85    88    93    90.00000  111.29400
   86    90    91    35.00000  109.50000
   86    90    92    35.00000  109.50000
   86    90    94    70.00000  112.02700
   90    86    87    35.00000  117.00000
   90    94    95    37.50000  110.70000
   90    94    96    37.50000  110.70000
   92    90    91    33.00000  107.80000
   94    84    85    70.00000  119.94800
   94    90    91    37.50000  110.70000
   94    90    92    37.50000  110.70000
   96    94    95    33.00000  107.80000
   88    85    86    65.00000  118.96000
   88    93    97    83.00000  116.90000
   93    88    89    83.00000  123.40000
   93    97    98    35.00000  109.50000
   93    97    40    50.00000  109.50000
   93    97    99    50.00000  109.50000
   97    40    41    37.50000  110.70000
   97    40    44    58.35000  112.70000
   97    99   100    37.50000  110.70000
   97    99   101    58.35000  112.70000
   97    99   105    58.35000  112.70000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    97    98    37.50000  110.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    47    37.50000  110.70000
   44    40    41    37.50000  110.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   99    97    98    37.50000  110.70000
   99    97    40    58.35000  112.70000
   99   101   102    37.50000  110.70000
   99   101   103    37.50000  110.70000
   99   101   104    37.50000  110.70000
   99   105   106    37.50000  110.70000
   99   105   107    37.50000  110.70000
   99   105   108    37.50000  110.70000
  101    99   100    37.50000  110.70000
  103   101   102    33.00000  107.80000
  104   101   102    33.00000  107.80000
  104   101   103    33.00000  107.80000
  105    99   100    37.50000  110.70000
  105    99   101    58.35000  112.70000
  107   105   106    33.00000  107.80000
  108   105   106    33.00000  107.80000
  108   105   107    33.00000  107.80000
   69    64    65    35.00000  109.50000
   69    64    66    50.00000  109.50000
   60    57    58    70.00000  124.00000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    40    97   0.44750  1.0 1.0
   29    33    40    97  -0.17800 -1.0 2.0
   29    33    40    97   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    44   0.44750  1.0 1.0
   29    33    40    44  -0.17800 -1.0 2.0
   29    33    40    44   0.20200  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    48   7.00000 -1.0 2.0
   33    40    44    45   0.15000  1.0 3.0
   33    40    44    46   0.15000  1.0 3.0
   33    40    44    47   0.15000  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    40    97   0.15000  1.0 3.0
   34    33    40    41   0.15000  1.0 3.0
   34    33    40    44   0.15000  1.0 3.0
   38    33    40    97   0.34400  1.0 1.0
   38    33    40    97   0.09450 -1.0 2.0
   38    33    40    97   0.11100  1.0 3.0
   38    33    40    41   0.15000  1.0 3.0
   38    33    40    44   0.34400  1.0 1.0
   38    33    40    44   0.09450 -1.0 2.0
   38    33    40    44   0.11100  1.0 3.0
   38    42    48    49   1.00000 -1.0 2.0
   38    42    48    50  -0.54700  1.0 1.0
   38    42    48    50   1.23000 -1.0 2.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    48   7.00000 -1.0 2.0
   42    48    50    51   0.00000  1.0 1.0
   42    48    50    52   0.00000  1.0 1.0
   42    48    50    53  -0.12500  1.0 1.0
   42    48    50    53  -0.12500 -1.0 2.0
   42    48    50    53   0.25000  1.0 3.0
   43    42    48    49   1.00000 -1.0 2.0
   43    42    48    50   1.00000 -1.0 2.0
   48    50    53    54   0.00000  1.0 1.0
   48    50    53    55   0.62150  1.0 1.0
   48    50    53    55   0.42850 -1.0 2.0
   48    50    53    55  -0.68200  1.0 3.0
   49    48    50    51   0.00000  1.0 1.0
   49    48    50    52   0.00000  1.0 1.0
   49    48    50    53  -0.12500  1.0 1.0
   49    48    50    53  -0.12500 -1.0 2.0
   49    48    50    53   0.25000  1.0 3.0
   50    53    55    56   7.00000 -1.0 2.0
   50    53    55    57   7.00000 -1.0 2.0
   51    50    53    54   0.33100  1.0 3.0
   51    50    53    55   0.00000  1.0 1.0
   52    50    53    54   0.33100  1.0 3.0
   52    50    53    55   0.00000  1.0 1.0
   53    55    57    58   0.28850  1.0 1.0
   53    55    57    58   2.61350 -1.0 2.0
   53    55    57    58   0.78400  1.0 3.0
   53    55    57    60  -0.18600  1.0 3.0
   54    53    55    56   7.00000 -1.0 2.0
   54    53    55    57   7.00000 -1.0 2.0
   55    57    58    59   7.00000 -1.0 2.0
   55    57    58    64   7.00000 -1.0 2.0
   55    57    60    61   0.00000  1.0 1.0
   55    57    60    62   0.00000  1.0 1.0
   55    57    60    63   0.00000  1.0 1.0
   56    55    57    58  -0.18600  1.0 3.0
   56    55    57    60   0.00000  1.0 1.0
   57    58    64    65   0.00000  1.0 1.0
   57    58    64    66   0.09850  1.0 1.0
   57    58    64    66   0.15250 -1.0 2.0
   57    58    64    66  -0.50650  1.0 3.0
   57    58    64    69   0.67800  1.0 1.0
   57    58    64    69   0.47050 -1.0 2.0
   57    58    64    69  -0.62500  1.0 3.0
   58    57    60    61   0.00000  1.0 1.0
   58    57    60    62   0.00000  1.0 1.0
   58    57    60    63   0.00000  1.0 1.0
   58    64    66    67   0.15000  1.0 3.0
   58    64    66    68   0.15000  1.0 3.0
   58    64    66    71  -0.98800  1.0 1.0
   58    64    66    71   0.48800 -1.0 2.0
   58    64    66    71   0.76800  1.0 3.0
   58    64    69    70  -0.07800  1.0 1.0
   58    64    69    70  -0.21500 -1.0 2.0
   58    64    69    70  -0.03150  1.0 3.0
   59    58    64    65   0.33100  1.0 3.0
   59    58    64    66   0.00000  1.0 1.0
   59    58    64    69   0.00000  1.0 1.0
   64    66    71    72   0.30150 -1.0 2.0
   64    66    71    73   0.60050  1.0 1.0
   64    66    71    73   0.05600 -1.0 2.0
   64    66    71    73   0.26150  1.0 3.0
   65    64    66    67   0.15000  1.0 3.0
   65    64    66    68   0.15000  1.0 3.0
   65    64    66    71  -0.11250  1.0 3.0
   65    64    69    70   0.19450  1.0 3.0
   66    64    69    70  -0.11600  1.0 1.0
   66    64    69    70  -0.09450 -1.0 2.0
   66    64    69    70   0.21250  1.0 3.0
   66    71    73    74   0.00000  1.0 1.0
   66    71    73    75   0.00000  1.0 1.0
   66    71    73    76   0.65300  1.0 1.0
   66    71    73    76  -0.03850 -1.0 2.0
   66    71    73    76   0.33900  1.0 3.0
   67    66    71    72   0.00000  1.0 1.0
   67    66    71    73   0.00000  1.0 1.0
   68    66    71    72   0.00000  1.0 1.0
   68    66    71    73   0.00000  1.0 1.0
   71    73    76    77   0.04300 -1.0 2.0
   71    73    76    83   0.04300 -1.0 2.0
   72    71    73    74   0.00000  1.0 1.0
   72    71    73    75   0.00000  1.0 1.0
   72    71    73    76   0.30150 -1.0 2.0
   73    76    77    78   3.62500 -1.0 2.0
   73    76    83    79   3.62500 -1.0 2.0
   74    73    76    77   0.00000  1.0 1.0
   74    73    76    83   0.00000  1.0 1.0
   75    73    76    77   0.00000  1.0 1.0
   75    73    76    83   0.00000  1.0 1.0
   76    77   -78    79   2.40000 -1.0 2.0
   76    77    78    81   3.62500 -1.0 2.0
   77    76   -83    79   3.62500 -1.0 2.0
   77    78    79    80   3.62500 -1.0 2.0
   77    78   -79    83   3.62500 -1.0 2.0
   77    78    81    82   1.05000 -1.0 2.0
   77    78    81    84   1.61600  1.0 1.0
   77    78    81    84  -0.04750 -1.0 2.0
   77    78    81    84   0.11700  1.0 3.0
   78    79   -83    76   3.62500 -1.0 2.0
   78    81    84    85   2.45000 -1.0 2.0
   78    81    84    94   1.49850  1.0 1.0
   78    81    84    94   1.53950 -1.0 2.0
   79    78    81    82   1.05000 -1.0 2.0
   79    78    81    84   0.75700  1.0 1.0
   79    78    81    84   0.34650 -1.0 2.0
   79    78    81    84   0.33000  1.0 3.0
   79    78    81    84  -0.28100 -1.0 4.0
   80    79    83    76   3.62500 -1.0 2.0
   83    76   -77    78   3.62500 -1.0 2.0
   81    78    79    80   3.62500 -1.0 2.0
   81    78    79    83   3.62500 -1.0 2.0
   81    84    85    86  -0.18900  1.0 1.0
   81    84    85    86   1.70900 -1.0 2.0
   81    84    85    88  -0.56400  1.0 1.0
   81    84    85    88   0.77500 -1.0 2.0
   81    84    85    88   0.18700  1.0 3.0
   81    84    94    90  -0.43950  1.0 1.0
   81    84    94    90  -0.08100 -1.0 2.0
   81    84    94    90   0.03350  1.0 3.0
   81    84    94    95   0.00000  1.0 1.0
   81    84    94    96   0.00000  1.0 1.0
   82    81    84    85   2.67200 -1.0 2.0
   82    81    84    94   3.04450 -1.0 2.0
   84    85    86    87   7.00000 -1.0 2.0
   84    85   -86    90   7.00000 -1.0 2.0
   84    85    88    89  -0.52200  1.0 1.0
   84    85    88    89   0.82950 -1.0 2.0
   84    85    88    93   1.50000 -1.0 2.0
   85    84   -94    90  -0.05900 -1.0 2.0
   85    84    94    95   0.00000  1.0 1.0
   85    84    94    96   0.00000  1.0 1.0
   85    86    90    91   0.00000  1.0 1.0
   85    86    90    92   0.00000  1.0 1.0
   85    86   -90    94   0.09850  1.0 1.0
   85    86   -90    94   0.15250 -1.0 2.0
   85    86   -90    94  -0.50650  1.0 3.0
   85    88    93    97   2.00000 -1.0 2.0
   86    85    88    89   1.00000 -1.0 2.0
   86    85    88    93  -0.56150  1.0 1.0
   86    85    88    93   2.19150 -1.0 2.0
   86    90   -94    84   0.21700  1.0 1.0
   86    90   -94    84   0.68550 -1.0 2.0
   86    90   -94    84  -0.27950  1.0 3.0
   86    90    94    95   0.15000  1.0 3.0
   86    90    94    96   0.15000  1.0 3.0
   87    86    90    91   0.33100  1.0 3.0
   87    86    90    92   0.33100  1.0 3.0
   87    86    90    94   0.00000  1.0 1.0
   91    90    94    84   0.15000  1.0 3.0
   91    90    94    95   0.15000  1.0 3.0
   91    90    94    96   0.15000  1.0 3.0
   92    90    94    84   0.15000  1.0 3.0
   92    90    94    95   0.15000  1.0 3.0
   92    90    94    96   0.15000  1.0 3.0
   94    84   -85    86  -0.88150  1.0 1.0
   94    84   -85    86   2.95600 -1.0 2.0
   94    84    85    88   1.00000 -1.0 2.0
   88    85    86    87   7.00000 -1.0 2.0
   88    85    86    90   7.00000 -1.0 2.0
   88    93    97    98   0.08050  1.0 3.0
   88    93    97    40  -0.25900  1.0 1.0
   88    93    97    40  -0.47000 -1.0 2.0
   88    93    97    40   0.11750  1.0 3.0
   88    93    97    99  -0.25900  1.0 1.0
   88    93    97    99  -0.47000 -1.0 2.0
   88    93    97    99   0.11750  1.0 3.0
   89    88    93    97   3.00000 -1.0 2.0
   93    97    40    33   0.62750  1.0 1.0
   93    97    40    33  -0.30950 -1.0 2.0
   93    97    40    33   0.27300  1.0 3.0
   93    97    40    41   0.23400  1.0 3.0
   93    97    40    44   0.62750  1.0 1.0
   93    97    40    44  -0.30950 -1.0 2.0
   93    97    40    44   0.27300  1.0 3.0
   93    97    99   100   0.23400  1.0 3.0
   93    97    99   101   0.62750  1.0 1.0
   93    97    99   101  -0.30950 -1.0 2.0
   93    97    99   101   0.27300  1.0 3.0
   93    97    99   105   0.62750  1.0 1.0
   93    97    99   105  -0.30950 -1.0 2.0
   93    97    99   105   0.27300  1.0 3.0
   97    40    44    45   0.15000  1.0 3.0
   97    40    44    46   0.15000  1.0 3.0
   97    40    44    47   0.15000  1.0 3.0
   97    99   101   102   0.15000  1.0 3.0
   97    99   101   103   0.15000  1.0 3.0
   97    99   101   104   0.15000  1.0 3.0
   97    99   105   106   0.15000  1.0 3.0
   97    99   105   107   0.15000  1.0 3.0
   97    99   105   108   0.15000  1.0 3.0
   98    97    40    33   0.15000  1.0 3.0
   98    97    40    41   0.15000  1.0 3.0
   98    97    40    44   0.15000  1.0 3.0
   98    97    99   100   0.15000  1.0 3.0
   98    97    99   101   0.15000  1.0 3.0
   98    97    99   105   0.15000  1.0 3.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    42   0.09850  1.0 1.0
   40    33    38    42   0.15250 -1.0 2.0
   40    33    38    42  -0.50650  1.0 3.0
   40    97    99   100   0.15000  1.0 3.0
   40    97    99   101   0.56750  1.0 1.0
   40    97    99   101  -0.07550 -1.0 2.0
   40    97    99   101   0.20000  1.0 3.0
   40    97    99   105   0.56750  1.0 1.0
   40    97    99   105  -0.07550 -1.0 2.0
   40    97    99   105   0.20000  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    47   0.15000  1.0 3.0
   99    97    40    33   0.56750  1.0 1.0
   99    97    40    33  -0.07550 -1.0 2.0
   99    97    40    33   0.20000  1.0 3.0
   99    97    40    41   0.15000  1.0 3.0
   99    97    40    44   0.56750  1.0 1.0
   99    97    40    44  -0.07550 -1.0 2.0
   99    97    40    44   0.20000  1.0 3.0
  100    99   101   102   0.15000  1.0 3.0
  100    99   101   103   0.15000  1.0 3.0
  100    99   101   104   0.15000  1.0 3.0
  100    99   105   106   0.15000  1.0 3.0
  100    99   105   107   0.15000  1.0 3.0
  100    99   105   108   0.15000  1.0 3.0
  101    99   105   106   0.15000  1.0 3.0
  101    99   105   107   0.15000  1.0 3.0
  101    99   105   108   0.15000  1.0 3.0
  105    99   101   102   0.15000  1.0 3.0
  105    99   101   103   0.15000  1.0 3.0
  105    99   101   104   0.15000  1.0 3.0
   69    64    66    67   0.23400  1.0 3.0
   69    64    66    68   0.23400  1.0 3.0
   69    64    66    71  -0.09450  1.0 1.0
   69    64    66    71  -1.12950 -1.0 2.0
   69    64    66    71   0.54000  1.0 3.0
   60    57    58    59   7.00000 -1.0 2.0
   60    57    58    64   7.00000 -1.0 2.0
IPHI
    9     5     7     8  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    35    36  10.50000 -1.0 2.0
   33    39    38    42   1.10000 -1.0 2.0
   48    43    42    38   1.10000 -1.0 2.0
   49    42    48    50   1.00000 -1.0 2.0
   50    54    53    55   1.10000 -1.0 2.0
   57    56    55    53   1.10000 -1.0 2.0
   55    60    57    58   1.10000 -1.0 2.0
   64    59    58    57   1.10000 -1.0 2.0
   66    73    71    72  10.50000 -1.0 2.0
   77    83    76    73   4.00000 -1.0 2.0
   79    81    78    77   4.00000 -1.0 2.0
   83    80    79    78   1.10000 -1.0 2.0
   78    84    81    82  10.50000 -1.0 2.0
   94    81    84    85   1.00000 -1.0 2.0
   84    88    85    86   1.10000 -1.0 2.0
   90    87    86    85   1.10000 -1.0 2.0
   85    93    88    89  10.50000 -1.0 2.0
END
