* LIGAND DATABASE FILE (OPLS2005)
*
001      89    92    162    269     490
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02097    79.78552    55.41300
    3     1 S   H    _H1_     3     1.02126    36.27114  -161.79216
    4     1 S   H    _H2_     4     1.02084    98.78167   -52.18936
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08491   110.56590    58.77998
   26    24 S   HC   HB22    34     1.08612   109.94660   179.13182
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C22    36     1.84732    97.43169   161.86047
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C13    37     1.55317   107.96713  -160.00950
   38    33 S   CT   _C23    64     1.57560   112.24243    76.64956
   39    33 S   OH   _O33    88     1.43320   108.51002   -42.23442
   40    39 S   HO   _H54    89     0.96811   106.09115   -57.30426
   41    37 S   CMA  _C10    38     1.37113   124.16452    87.75265
   42    41 S   OM   _O25    39     1.26883   126.84578    -9.24042
   43    38 S   OH   _O34    65     1.43597   111.41567    34.65410
   44    43 S   HO   _H55    66     0.96717   105.95827   -62.09973
   45    41 S   CA   _C8_    40     1.52508   114.50488   168.38039
   46    45 S   CA   _C7_    41     1.40928   122.64615    18.37321
   47    46 S   CA   _C5_    42     1.40998   120.04919  -179.01127
   48    47 S   HA   _H35    43     1.08779   121.14236   178.12873
   49    46 S   CM   _C11    51     1.46942   118.84536    -0.77833
   50    47 S   CA   _C4_    44     1.39228   121.11424    -1.01240
   51    50 S   HA   _H34    45     1.08623   120.15372   179.95154
   52    37 S   CT   _C18    52     1.51937   111.46879   -95.55340
   53    52 S   HC   _H39    53     1.09922   106.82727    50.62007
   54    49 S   CM   _C16    85     1.34424   122.59874   149.05797
   55    54 S   HC   _H37    86     1.07843   120.25340   179.93744
   56    54 S   HC   _H38    87     1.07955   120.27966    -0.01978
   57    50 S   CA   _C6_    46     1.38515   119.62072     0.48739
   58    57 S   HA   _H36    47     1.08713   119.57675   179.34898
   59    52 S   CT   _C21    54     1.54560   109.75343   -66.96479
   60    59 S   HC   _H42    55     1.09433   109.44293   -84.05746
   61    45 S   CA   _C9_    48     1.41624   119.93323  -161.43627
   62    59 S   CT   _C20    56     1.56416   113.43521    41.44406
   63    62 S   HC   _H41    57     1.10288   107.32608   134.63233
   64    59 S   OH   _O30    83     1.43324   107.32465   160.60783
   65    64 S   HO   _H53    84     0.96789   106.08088   179.98022
   66    61 S   OH   _O28    49     1.36912   123.30470     1.83323
   67    66 S   HO   _H51    50     0.96736   109.80132    -1.99919
   68    62 S   CT   _C19    58     1.55072   112.52998  -107.90730
   69    68 S   HC   _H40    59     1.10537   108.87457    51.27199
   70    68 S   CM   _C14    60     1.51881   112.24370   171.27562
   71    68 S   NT   _N24    74     1.47170   107.67998   -64.90694
   72    70 S   CM   _C12    61     1.34517   124.33121   -14.79592
   73    70 S   OH   _O29    72     1.38806   115.34639   166.53175
   74    73 S   HO   _H52    73     0.95973   109.35375   178.77651
   75    71 S   CT   _C24    75     1.45792   109.95268   -83.92653
   76    75 S   HC   _H43    76     1.09249   110.09316   180.00000
   77    75 S   HC   _H44    77     1.09350   110.23032    59.97120
   78    75 S   HC   _H45    78     1.09423   110.21478   -59.97893
   79    71 S   CT   _C25    79     1.45777   109.96167   153.57924
   80    79 S   HC   _H46    80     1.09260   110.09611   179.98022
   81    79 S   HC   _H47    81     1.09426   110.20352    59.96640
   82    79 S   HC   _H48    82     1.09283   110.22817   -59.98359
   83    72 S   CO4  _C15    62     1.49496   120.05531    -3.91617
   84    83 S   O    _O26    63     1.23099   119.75221   172.80723
   85    72 S   C    _C17    67     1.47149   119.30580   178.20572
   86    85 S   O    _O27    68     1.22574   121.44680   -60.01466
   87    85 S   N    _N23    69     1.37233   113.22683   119.97629
   88    87 S   H    _H49    70     1.01503   118.50979    -0.02798
   89    87 S   H    _H50    71     1.01544   122.86554  -179.94766
  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  10   5   4   3
  19   2   1   1  18  19   6   1  11   4   8   2  12  14   9   4
  11   5   3  11   5   3   1   1   4   2  10   5   2  13   6   2
   1   1   1  16   6  11  10   9   3   1   7   3   2   1   3   2
   1   1   4   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    52    62    83    38    43    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    45    49    52    53    59    62    63    68    72    83    84    38    43    44    39    40  
   35    36  
   36  
    0  
   41    42    45    46    61    49    52    53    59    60    62    83    38    43    64    54    39    40  
   43    44    85    71    64    39    40    41    52    59    60    62    63    68    69    70    72    83    84  
   40    41    43    52    62    83  
    0  
   42    45    46    47    57    61    66    49    52    53    59  
   45    46    61    52  
   44    59    62    63    68    72    83    84  
   62    83  
   46    47    48    50    57    58    61    66    67    49    52    54  
   47    48    50    51    57    61    66    49    52    53    59    54    55    56  
   48    50    51    57    58    61    49    52    54  
   50    51    57    49  
   52    53    59    60    62    64    54    55    56    50    61  
   51    57    58    61    66  
   57    58    61  
   53    59    60    62    63    68    64    65    54    55    56  
   59    60    62    64    54  
   55    56    59  
   56  
    0  
   58    61    66    67  
   61    66  
   60    62    63    68    69    70    83    71    64    65  
   62    63    68    64    65  
   66    67  
   63    68    69    70    72    83    84    73    71    75    79    64    65  
   68    69    70    83    71    64  
   65    68  
    0  
   67  
    0  
   69    70    72    83    85    73    74    71    75    76    77    78    79    80    81    82  
   70    72    73    71    75    79  
   72    83    84    85    86    87    73    74    71    75    79  
   75    76    77    78    79    80    81    82    72    73  
   83    84    85    86    87    88    89    73    74  
   74    83    85  
    0  
   76    77    78    79    80    81    82  
   77    78    79  
   78    79  
   79  
   80    81    82  
   81    82  
   82  
    0  
   84    85    86    87  
   85  
   86    87    88    89  
   87    88    89  
   88    89  
   89  
    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   0.432500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   40   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   41   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   67   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   68   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   71   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   72   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
   73   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   74   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   75   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   84   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   85   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   86   2.9600   0.2100  -0.500000   1.8100   1.6000   0.001000000  -1.480495490
   87   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
   88   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   89   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    38   268.000  1.529
   33    39   320.000  1.410
   37    41   465.000  1.376
   37    52   317.000  1.510
   41    42   745.000  1.250
   41    45   320.000  1.460
   45    46   469.000  1.400
   45    61   469.000  1.400
   46    47   469.000  1.400
   46    49   320.000  1.460
   47    48   367.000  1.080
   47    50   469.000  1.400
   50    51   367.000  1.080
   50    57   469.000  1.400
   57    58   367.000  1.080
   57    61   469.000  1.400
   61    66   450.000  1.364
   66    67   553.000  0.945
   49    52   317.000  1.510
   49    54   549.000  1.340
   52    53   340.000  1.090
   52    59   268.000  1.529
   59    60   340.000  1.090
   59    62   268.000  1.529
   59    64   320.000  1.410
   62    63   340.000  1.090
   62    68   268.000  1.529
   62    38   268.000  1.529
   68    69   340.000  1.090
   68    70   317.000  1.510
   68    71   382.000  1.448
   70    72   549.000  1.340
   70    73   510.000  1.338
   72    83   320.000  1.462
   72    85   410.000  1.444
   83    84   570.000  1.229
   83    38   317.000  1.522
   38    43   320.000  1.410
   43    44   553.000  0.945
   85    86   570.000  1.229
   85    87   490.000  1.335
   87    88   434.000  1.010
   87    89   434.000  1.010
   73    74   553.000  0.945
   71    75   382.000  1.448
   71    79   382.000  1.448
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   340.000  1.090
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    82   340.000  1.090
   64    65   553.000  0.945
   54    55   340.000  1.080
   54    56   340.000  1.080
   39    40   553.000  0.945
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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  112.20000
   29    33    38    75.00000  111.63000
   29    33    39    85.00000  114.68000
   33    37    41    70.00000  124.00000
   33    37    52    65.00000  117.92700
   33    38    62    58.35000  112.70000
   33    38    83    63.00000  111.10000
   33    38    43    50.00000  109.50000
   33    39    40    55.00000  108.50000
   37    41    42    65.00000  137.10300
   37    41    45    60.00000  123.20500
   37    52    49    70.00000  110.12100
   37    52    53    35.00000  109.50000
   37    52    59    70.00000  112.02700
   41    45    46    60.00000  120.93500
   41    45    61    60.00000  120.93500
   45    41    42    85.00000  114.86500
   45    46    47    63.00000  120.00000
   45    46    49    60.00000  120.93500
   45    61    57    63.00000  120.00000
   45    61    66    70.00000  120.00000
   46    47    48    35.00000  120.00000
   46    47    50    63.00000  120.00000
   46    49    52    65.00000  118.87000
   46    49    54    60.00000  123.20500
   47    50    51    35.00000  120.00000
   47    50    57    63.00000  120.00000
   50    47    48    35.00000  120.00000
   50    57    58    35.00000  120.00000
   50    57    61    63.00000  120.00000
   57    50    51    35.00000  120.00000
   57    61    66    70.00000  120.00000
   61    45    46    63.00000  120.00000
   61    57    58    35.00000  120.00000
   61    66    67    35.00000  113.00000
   49    46    47    60.00000  120.93500
   49    52    53    35.00000  109.50000
   49    52    59    70.00000  112.02700
   49    54    55    35.00000  120.00000
   49    54    56    35.00000  120.00000
   52    37    41    70.00000  124.00000
   52    59    60    37.50000  110.70000
   52    59    62    58.35000  112.70000
   52    59    64    50.00000  109.50000
   59    52    53    37.50000  110.70000
   59    62    63    37.50000  110.70000
   59    62    68    58.35000  112.70000
   59    62    38    58.35000  112.70000
   59    64    65    55.00000  108.50000
   62    59    60    37.50000  110.70000
   62    68    69    37.50000  110.70000
   62    68    70    70.00000  112.02700
   62    68    71    56.20000  109.47000
   62    38    83    63.00000  111.10000
   62    38    43    50.00000  109.50000
   68    62    63    37.50000  110.70000
   68    70    72    70.00000  124.00000
   68    70    73    90.00000  109.34000
   68    71    75    51.80000  107.20000
   68    71    79    51.80000  107.20000
   70    68    69    35.00000  109.50000
   70    72    83    65.00000  118.96000
   70    72    85    70.00000  118.70000
   70    73    74    70.00000  107.45700
   72    83    84    80.00000  123.72100
   72    83    38    65.00000  118.62400
   72    85    86    80.00000  125.30000
   72    85    87    80.00000  111.56200
   83    38    43    90.00000  109.61100
   38    33    37    70.00000  112.02700
   38    62    63    37.50000  110.70000
   38    62    68    58.35000  112.70000
   38    83    84    80.00000  120.40000
   38    43    44    55.00000  108.50000
   85    72    83    55.00000  123.68000
   85    87    88    35.00000  119.80000
   85    87    89    35.00000  119.80000
   87    85    86    80.00000  122.90000
   89    87    88    35.00000  120.00000
   73    70    72    80.00000  121.38400
   71    68    69    35.00000  109.50000
   71    68    70    75.00000  110.70900
   71    75    76    35.00000  109.50000
   71    75    77    35.00000  109.50000
   71    75    78    35.00000  109.50000
   71    79    80    35.00000  109.50000
   71    79    81    35.00000  109.50000
   71    79    82    35.00000  109.50000
   77    75    76    33.00000  107.80000
   78    75    76    33.00000  107.80000
   78    75    77    33.00000  107.80000
   79    71    75    51.80000  107.20000
   81    79    80    33.00000  107.80000
   82    79    80    33.00000  107.80000
   82    79    81    33.00000  107.80000
   64    59    60    35.00000  109.50000
   64    59    62    50.00000  109.50000
   54    49    52    70.00000  124.00000
   56    54    55    35.00000  117.00000
   39    33    37    90.00000  110.39200
   39    33    38    50.00000  109.50000
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    37    52   0.30250  1.0 1.0
   29    33    37    52  -0.14950 -1.0 2.0
   29    33    37    52   0.36900  1.0 3.0
   29    33    38    62   0.44750  1.0 1.0
   29    33    38    62  -0.17800 -1.0 2.0
   29    33    38    62   0.20200  1.0 3.0
   29    33    38    83   0.56750  1.0 1.0
   29    33    38    83  -0.07550 -1.0 2.0
   29    33    38    83   0.20000  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    39    40   0.35600  1.0 1.0
   29    33    39    40  -0.10750 -1.0 2.0
   29    33    39    40  -0.54400  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    45   7.00000 -1.0 2.0
   33    37    52    49   0.09700  1.0 1.0
   33    37    52    49   0.15600 -1.0 2.0
   33    37    52    49  -0.50800  1.0 3.0
   33    37    52    53   0.34800  1.0 3.0
   33    37    52    59   0.46850  1.0 1.0
   33    37    52    59   0.08550 -1.0 2.0
   33    37    52    59   0.09800  1.0 3.0
   33    38    43    44  -0.11600  1.0 1.0
   33    38    43    44  -0.09450 -1.0 2.0
   33    38    43    44   0.21250  1.0 3.0
   37    33    38    62   0.34400  1.0 1.0
   37    33    38    62   0.09450 -1.0 2.0
   37    33    38    62   0.11100  1.0 3.0
   37    33    38    83  -0.98800  1.0 1.0
   37    33    38    83   0.48800 -1.0 2.0
   37    33    38    83   0.76800  1.0 3.0
   37    33    38    43   1.05650  1.0 1.0
   37    33    38    43   0.15600 -1.0 2.0
   37    33    38    43   0.53150  1.0 3.0
   37    33    39    40  -0.07800  1.0 1.0
   37    33    39    40  -0.21500 -1.0 2.0
   37    33    39    40  -0.03150  1.0 3.0
   37    41    45    46   0.15800  1.0 1.0
   37    41    45    46   1.85350 -1.0 2.0
   37    41    45    46  -0.48700  1.0 3.0
   37    41    45    61   0.15800  1.0 1.0
   37    41    45    61   1.85350 -1.0 2.0
   37    41    45    61  -0.48700  1.0 3.0
   37    52    59    60   0.15000  1.0 3.0
   37    52   -59    62   0.34400  1.0 1.0
   37    52   -59    62   0.09450 -1.0 2.0
   37    52   -59    62   0.11100  1.0 3.0
   37    52    59    64   1.05650  1.0 1.0
   37    52    59    64   0.15600 -1.0 2.0
   37    52    59    64   0.53150  1.0 3.0
   41    37    52    49  -0.28300  1.0 1.0
   41    37    52    49   0.26700 -1.0 2.0
   41    37    52    49  -0.63300  1.0 3.0
   41    37    52    53   0.00000  1.0 1.0
   41    37    52    59   0.09850  1.0 1.0
   41    37    52    59   0.15250 -1.0 2.0
   41    37    52    59  -0.50650  1.0 3.0
   41    45    46    47   3.62500 -1.0 2.0
   41    45   -46    49   3.62500 -1.0 2.0
   41    45    61    57   3.62500 -1.0 2.0
   41    45    61    66   3.62500 -1.0 2.0
   42    41    45    46  -0.01750  1.0 1.0
   42    41    45    46  -0.32000 -1.0 2.0
   42    41    45    46   0.00600  1.0 3.0
   42    41    45    61  -0.01750  1.0 1.0
   42    41    45    61  -0.32000 -1.0 2.0
   42    41    45    61   0.00600  1.0 3.0
   45    46    47    48   3.62500 -1.0 2.0
   45    46    47    50   3.62500 -1.0 2.0
   45    46    49    52  -0.02500  1.0 1.0
   45    46    49    52  -0.32150 -1.0 2.0
   45    46    49    52  -0.01500  1.0 3.0
   45    46    49    54   0.15800  1.0 1.0
   45    46    49    54   1.85350 -1.0 2.0
   45    46    49    54  -0.48700  1.0 3.0
   45    61    66    67   0.84100 -1.0 2.0
   46    45    61    57   3.62500 -1.0 2.0
   46    45    61    66   3.62500 -1.0 2.0
   46    47    50    51   3.62500 -1.0 2.0
   46    47   -50    57   3.62500 -1.0 2.0
   46    49   -52    37   0.09700  1.0 1.0
   46    49   -52    37   0.15600 -1.0 2.0
   46    49   -52    37  -0.50800  1.0 3.0
   46    49    52    53   0.77000  1.0 3.0
   46    49    52    59  -0.01700  1.0 1.0
   46    49    52    59   0.06550 -1.0 2.0
   46    49    52    59  -0.91500  1.0 3.0
   46    49    54    55   7.00000 -1.0 2.0
   46    49    54    56   7.00000 -1.0 2.0
   47    46    49    52  -0.02500  1.0 1.0
   47    46    49    52  -0.32150 -1.0 2.0
   47    46    49    52  -0.01500  1.0 3.0
   47    46    49    54   0.15800  1.0 1.0
   47    46    49    54   1.85350 -1.0 2.0
   47    46    49    54  -0.48700  1.0 3.0
   47    50    57    58   3.62500 -1.0 2.0
   47    50    57    61   3.62500 -1.0 2.0
   48    47    50    51   3.62500 -1.0 2.0
   48    47    50    57   3.62500 -1.0 2.0
   50    57   -61    45   3.62500 -1.0 2.0
   50    57    61    66   3.62500 -1.0 2.0
   51    50    57    58   3.62500 -1.0 2.0
   51    50    57    61   3.62500 -1.0 2.0
   57    61    66    67   0.84100 -1.0 2.0
   58    57    61    45   3.62500 -1.0 2.0
   58    57    61    66   3.62500 -1.0 2.0
   61    45   -46    47   3.62500 -1.0 2.0
   61    45    46    49   3.62500 -1.0 2.0
   49    46    47    48   3.62500 -1.0 2.0
   49    46    47    50   3.62500 -1.0 2.0
   49    52    59    60   0.15000  1.0 3.0
   49    52    59    62   0.34400  1.0 1.0
   49    52    59    62   0.09450 -1.0 2.0
   49    52    59    62   0.11100  1.0 3.0
   49    52    59    64   1.05650  1.0 1.0
   49    52    59    64   0.15600 -1.0 2.0
   49    52    59    64   0.53150  1.0 3.0
   52    37    41    42   7.00000 -1.0 2.0
   52    37   -41    45   7.00000 -1.0 2.0
   52    49    54    55   7.00000 -1.0 2.0
   52    49    54    56   7.00000 -1.0 2.0
   52    59    62    63   0.15000  1.0 3.0
   52    59    62    68   0.56750  1.0 1.0
   52    59    62    68  -0.07550 -1.0 2.0
   52    59    62    68   0.20000  1.0 3.0
   52    59    62    38   0.56750  1.0 1.0
   52    59    62    38  -0.07550 -1.0 2.0
   52    59    62    38   0.20000  1.0 3.0
   52    59    64    65  -0.11600  1.0 1.0
   52    59    64    65  -0.09450 -1.0 2.0
   52    59    64    65   0.21250  1.0 3.0
   53    52    59    60   0.15000  1.0 3.0
   53    52    59    62   0.15000  1.0 3.0
   53    52    59    64   0.23400  1.0 3.0
   59    62    68    69   0.15000  1.0 3.0
   59    62    68    70   0.34400  1.0 1.0
   59    62    68    70   0.09450 -1.0 2.0
   59    62    68    70   0.11100  1.0 3.0
   59    62    68    71   1.85550  1.0 1.0
   59    62    68    71  -0.84100 -1.0 2.0
   59    62   -38    33   0.56750  1.0 1.0
   59    62   -38    33  -0.07550 -1.0 2.0
   59    62   -38    33   0.20000  1.0 3.0
   59    62    38    83  -0.95700  1.0 1.0
   59    62    38    83  -0.18200 -1.0 2.0
   59    62    38    83   0.29450  1.0 3.0
   59    62    38    43   0.86500  1.0 1.0
   59    62    38    43  -0.17500 -1.0 2.0
   59    62    38    43   0.20800  1.0 3.0
   60    59    62    63   0.15000  1.0 3.0
   60    59    62    68   0.15000  1.0 3.0
   60    59    62    38   0.15000  1.0 3.0
   60    59    64    65   0.19450  1.0 3.0
   62    59    64    65  -0.11600  1.0 1.0
   62    59    64    65  -0.09450 -1.0 2.0
   62    59    64    65   0.21250  1.0 3.0
   62    68    70    72   0.09850  1.0 1.0
   62    68    70    72   0.15250 -1.0 2.0
   62    68    70    72  -0.50650  1.0 3.0
   62    68    70    73   0.09700  1.0 1.0
   62    68    70    73   0.15600 -1.0 2.0
   62    68    70    73  -0.50800  1.0 3.0
   62    68    71    75   0.23450  1.0 1.0
   62    68    71    75   0.02050 -1.0 2.0
   62    68    71    75   0.25250  1.0 3.0
   62    68    71    79   0.23450  1.0 1.0
   62    68    71    79   0.02050 -1.0 2.0
   62    68    71    79   0.25250  1.0 3.0
   62    38    43    44  -0.11600  1.0 1.0
   62    38    43    44  -0.09450 -1.0 2.0
   62    38    43    44   0.21250  1.0 3.0
   63    62    68    69   0.15000  1.0 3.0
   63    62    68    70   0.15000  1.0 3.0
   63    62    68    71   0.15000  1.0 3.0
   63    62    38    33   0.15000  1.0 3.0
   63    62    38    83  -0.11250  1.0 3.0
   63    62    38    43   0.23400  1.0 3.0
   68    62    38    33   0.56750  1.0 1.0
   68    62    38    33  -0.07550 -1.0 2.0
   68    62    38    33   0.20000  1.0 3.0
   68    62    38    83  -0.95700  1.0 1.0
   68    62    38    83  -0.18200 -1.0 2.0
   68    62    38    83   0.29450  1.0 3.0
   68    62    38    43   0.86500  1.0 1.0
   68    62    38    43  -0.17500 -1.0 2.0
   68    62    38    43   0.20800  1.0 3.0
   68    70   -72    83   7.00000 -1.0 2.0
   68    70    72    85   7.00000 -1.0 2.0
   68    70    73    74   2.00000 -1.0 2.0
   68    71    75    76   0.28000  1.0 3.0
   68    71    75    77   0.28000  1.0 3.0
   68    71    75    78   0.28000  1.0 3.0
   68    71    79    80   0.28000  1.0 3.0
   68    71    79    81   0.28000  1.0 3.0
   68    71    79    82   0.28000  1.0 3.0
   69    68    70    72   0.00000  1.0 1.0
   69    68    70    73   0.00000  1.0 1.0
   69    68    71    75   0.28000  1.0 3.0
   69    68    71    79   0.28000  1.0 3.0
   70    68    71    75  -0.60800  1.0 1.0
   70    68    71    75   1.10050 -1.0 2.0
   70    68    71    75   0.47000  1.0 3.0
   70    68    71    79  -0.60800  1.0 1.0
   70    68    71    79   1.10050 -1.0 2.0
   70    68    71    79   0.47000  1.0 3.0
   70    72    83    84   1.00000 -1.0 2.0
   70    72    83    38  -0.33500  1.0 1.0
   70    72    83    38   1.06600 -1.0 2.0
   70    72    83    38  -0.14000  1.0 3.0
   70    72    85    86   1.00000 -1.0 2.0
   70    72    85    87   0.49500  1.0 1.0
   70    72    85    87   1.31600 -1.0 2.0
   70    72    85    87  -0.02300  1.0 3.0
   72    70    73    74  -0.66100  1.0 1.0
   72    70    73    74   1.20850 -1.0 2.0
   72    70    73    74  -0.36000  1.0 3.0
   72    83    38    33   0.65300  1.0 1.0
   72    83    38    33  -0.03850 -1.0 2.0
   72    83    38    33   0.33900  1.0 3.0
   72    83   -38    62   0.65300  1.0 1.0
   72    83   -38    62  -0.03850 -1.0 2.0
   72    83   -38    62   0.33900  1.0 3.0
   72    83    38    43   0.65300  1.0 1.0
   72    83    38    43  -0.03850 -1.0 2.0
   72    83    38    43   0.33900  1.0 3.0
   72    85    87    88   2.56700 -1.0 2.0
   72    85    87    89   2.56700 -1.0 2.0
   83    72    85    86   2.50000 -1.0 2.0
   83    72    85    87   1.50000 -1.0 2.0
   83    38    43    44   0.91850  1.0 1.0
   83    38    43    44   0.57950  1.0 3.0
   84    83    38    33   0.30150 -1.0 2.0
   84    83    38    62   0.30150 -1.0 2.0
   84    83    38    43   0.30150 -1.0 2.0
   38    33    37    41   0.09850  1.0 1.0
   38    33    37    41   0.15250 -1.0 2.0
   38    33    37    41  -0.50650  1.0 3.0
   38    33   -37    52   0.46850  1.0 1.0
   38    33   -37    52   0.08550 -1.0 2.0
   38    33   -37    52   0.09800  1.0 3.0
   38    33    39    40  -0.11600  1.0 1.0
   38    33    39    40  -0.09450 -1.0 2.0
   38    33    39    40   0.21250  1.0 3.0
   38    62    68    69   0.15000  1.0 3.0
   38    62   -68    70   0.34400  1.0 1.0
   38    62   -68    70   0.09450 -1.0 2.0
   38    62   -68    70   0.11100  1.0 3.0
   38    62    68    71   1.85550  1.0 1.0
   38    62    68    71  -0.84100 -1.0 2.0
   85    72    83    84   2.50000 -1.0 2.0
   85    72    83    38   1.50000 -1.0 2.0
   86    85    87    88   2.45000 -1.0 2.0
   86    85    87    89   2.45000 -1.0 2.0
   73    70    72    83   7.00000 -1.0 2.0
   73    70    72    85   7.00000 -1.0 2.0
   71    68    70    72   0.90200  1.0 1.0
   71    68    70    72   0.57900 -1.0 2.0
   71    68    70    72  -0.62100  1.0 3.0
   71    68    70    73   0.09700  1.0 1.0
   71    68    70    73   0.15600 -1.0 2.0
   71    68    70    73  -0.50800  1.0 3.0
   75    71    79    80   0.28000  1.0 3.0
   75    71    79    81   0.28000  1.0 3.0
   75    71    79    82   0.28000  1.0 3.0
   79    71    75    76   0.28000  1.0 3.0
   79    71    75    77   0.28000  1.0 3.0
   79    71    75    78   0.28000  1.0 3.0
   64    59    62    63   0.23400  1.0 3.0
   64    59    62    68   0.86500  1.0 1.0
   64    59    62    68  -0.17500 -1.0 2.0
   64    59    62    68   0.20800  1.0 3.0
   64    59    62    38   0.86500  1.0 1.0
   64    59    62    38  -0.17500 -1.0 2.0
   64    59    62    38   0.20800  1.0 3.0
   54    49    52    37  -0.28300  1.0 1.0
   54    49    52    37   0.26700 -1.0 2.0
   54    49    52    37  -0.63300  1.0 3.0
   54    49    52    53   0.00000  1.0 1.0
   54    49    52    59   0.09850  1.0 1.0
   54    49    52    59   0.15250 -1.0 2.0
   54    49    52    59  -0.50650  1.0 3.0
   39    33    37    41   0.67800  1.0 1.0
   39    33    37    41   0.47050 -1.0 2.0
   39    33    37    41  -0.62500  1.0 3.0
   39    33    37    52   0.18000  1.0 1.0
   39    33    37    52   0.16450 -1.0 2.0
   39    33    37    52   0.04450  1.0 3.0
   39    33    38    62   0.86500  1.0 1.0
   39    33    38    62  -0.17500 -1.0 2.0
   39    33    38    62   0.20800  1.0 3.0
   39    33    38    83  -0.09450  1.0 1.0
   39    33    38    83  -1.12950 -1.0 2.0
   39    33    38    83   0.54000  1.0 3.0
   39    33    38    43   3.75450  1.0 1.0
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
   36    30    34    35  10.50000 -1.0 2.0
   33    52    37    41   1.10000 -1.0 2.0
   45    42    41    37   1.10000 -1.0 2.0
   46    61    45    41   4.00000 -1.0 2.0
   47    49    46    45   4.00000 -1.0 2.0
   50    48    47    46   1.10000 -1.0 2.0
   57    51    50    47   1.10000 -1.0 2.0
   61    58    57    50   1.10000 -1.0 2.0
   57    66    61    45   4.00000 -1.0 2.0
   46    52    49    54   1.10000 -1.0 2.0
   68    73    70    72   1.10000 -1.0 2.0
   83    85    72    70   1.10000 -1.0 2.0
   72    38    83    84  10.50000 -1.0 2.0
   72    87    85    86  10.50000 -1.0 2.0
   89    85    87    88   1.00000 -1.0 2.0
   55    56    54    49   1.10000 -1.0 2.0
END
