* LIGAND DATABASE FILE (OPLS2005)
*
001      74    75    134    209     386
    1     0 S   NP   _N1_     1    28.64191    96.99642   -23.14223
    2     1 S   H    _HN1     2     1.02789   103.66109   -92.03244
    3     1 S   H    _H1_     3     1.02949    68.51196    12.61510
    4     1 S   H    _H2_     4     1.02828    42.52439   166.27012
    5     1 S   CT   _CA1     5     1.50112   141.72815   108.70070
    6     5 S   HC   _HA1     6     1.09572   105.18989    96.83425
    7     5 S   CO3  _C1_     7     1.53787   112.48818   -23.40554
    8     7 S   O2Z  _O11     8     1.26373   115.00794   -42.09085
    9     7 S   O2Z  _O12     9     1.26242   114.95030   137.05398
   10     5 S   CT   _CB1    10     1.53077   107.42005  -145.16847
   11    10 S   HC   HB11    11     1.09834   109.37513   -49.54930
   12    10 S   HC   HB12    12     1.09812   110.44652    67.06315
   13    10 S   CT   _CG1    13     1.52992   112.60717  -170.51370
   14    13 S   HC   HG11    14     1.09578   110.65266   -65.87021
   15    13 S   HC   HG12    15     1.09670   109.76539    53.36581
   16    13 S   C    _CD1    16     1.51797   112.19709   173.83627
   17    16 S   O    _OE1    17     1.22730   123.27377     7.90445
   18    16 S   N    _N2_    18     1.38662   111.69433  -172.16842
   19    18 S   H    _HN2    19     1.01573   118.90310     1.91826
   20    18 S   CT1  _CA2    20     1.46213   123.40014   177.34450
   21    20 S   HC   _HA2    21     1.09739   109.39059     4.66737
   22    20 S   C    _C2_    22     1.53600   108.51352  -110.82788
   23    22 S   O    _O2_    23     1.23063   122.28999  -146.70938
   24    20 S   CT   _CB2    32     1.53516   111.65569   126.73647
   25    24 S   HC   HB21    33     1.09501   109.54925    56.11357
   26    24 S   HC   HB22    34     1.09303   109.57280   174.97820
   27    22 S   N    _N3_    24     1.38327   113.72796    40.63392
   28    27 S   H    _HN3    25     1.01573   119.61972    -3.04292
   29    24 S   S    _SG2    35     1.82975   111.16763   -64.49488
   30    27 S   CT   _CA3    26     1.45291   123.23142   177.24835
   31    30 S   HC   HA31    27     1.09548   107.48800   -65.19061
   32    30 S   HC   HA32    28     1.09556   108.01515    51.25797
   33    29 S   CT   _C14    36     1.86217   102.58774  -173.44952
   34    30 S   CO3  _C3_    29     1.52968   114.06771   173.26885
   35    34 S   O2Z  _O31    30     1.26378   116.07157    -0.84395
   36    34 S   O2Z  _O32    31     1.26426   114.41642   179.22444
   37    33 S   C4T  _C12    37     1.54142   108.55560    72.37241
   38    37 S   HC   _H4_    38     1.09980   110.79162   -60.53987
   39    33 S   CT   _C15    66     1.53899   105.36965  -167.70668
   40    39 S   HC   _H13    67     1.09696   111.29517    62.34060
   41    39 S   HC   _H14    68     1.09636   112.26334   -58.53531
   42    39 S   HC   _H15    69     1.09460   112.09828  -178.30569
   43    33 S   CT   _C16    70     1.54152   110.40448   -48.08024
   44    43 S   HC   _H16    71     1.09591   111.05686   -48.62492
   45    43 S   HC   _H17    72     1.09490   111.69473    73.06514
   46    37 S   C4   _C13    39     1.55861   117.86856    67.83078
   47    46 S   O    _O35    40     1.21031   136.05420   -63.18887
   48    37 S   C4T  _C10    47     1.57308   120.09795   169.39423
   49    48 S   HC   _H3_    48     1.09615   115.58363    -9.95839
   50    43 S   OH   _O36    73     1.42486   111.01655  -167.52848
   51    50 S   HO   _H18    74     0.97268   107.10391   178.86979
   52    46 S   N4   _N5_    41     1.36129    91.15216   123.07360
   53    52 S   CM   _C9_    42     1.37042   125.60652   120.26999
   54    53 S   CM   _C8_    43     1.34060   110.62631  -112.62608
   55    53 S   CO3  _C17    63     1.53621   122.08351    64.37558
   56    55 S   O2Z  _O38    64     1.26369   115.60109  -125.39958
   57    55 S   O2Z  _O37    65     1.26463   114.75748    54.61597
   58    54 S   CT   _C11    44     1.50516   111.21299     2.83787
   59    58 S   HC   _H11    45     1.09448   111.32340   112.82565
   60    58 S   HC   _H12    46     1.09477   110.91613  -125.20346
   61    54 S   SZ   _S1_    49     1.76411   124.10489   179.48300
   62    61 S   OZ   _O34    50     1.50047   106.54581  -176.68814
   63    61 S   CM   _C7_    51     1.78910   100.09283    72.91250
   64    63 S   HC   _H10    52     1.08592   121.63737   -21.20555
   65    63 S   CM   _C6_    53     1.33916   118.33690   160.29534
   66    65 S   HC   _H9_    54     1.08587   122.03008    -0.75537
   67    65 S   N    _N4_    55     1.37292   122.01763   179.18291
   68    67 S   H    _H8_    56     1.01662   117.56566    -0.06256
   69    67 S   C    _C5_    57     1.38711   123.56404  -179.98022
   70    69 S   O    _O33    58     1.22819   126.11946    -0.13562
   71    69 S   CT   _C4_    59     1.50567   112.03684  -179.98022
   72    71 S   HC   _H5_    60     1.09362   109.76771    62.02173
   73    71 S   HC   _H6_    61     1.09368   109.89586   -58.49484
   74    71 S   HC   _H7_    62     1.09350   109.74807  -178.21831
  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  13   5   4   3
  17   2   1   1  19   8   9   3   2   1   6   3   2   8   3   9
   6   1   1   9  10  11   4   1   1   5   2   1   6   3   6   3
   6   3   7   3   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    43    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    46    48    39    40    41    42    43    44    45    50  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    46    47    52    58    48    49    39    40    41    42    43    44    45    50    51  
   35    36  
   36  
    0  
   38    46    47    52    53    54    58    59    60    48    49    39    40    41    42    43    44    45    50  
   46    47    52    58    48    49    39    43  
   40    41    42    43    44    45    50    46    48  
   41    42    43  
   42    43  
   43  
   44    45    50    51    46    48  
   45    50    51  
   50    51  
   47    52    53    54    58    48    49    55  
   52    53    48  
   49    61    55    52    53    54    58    59    60  
   52    53    54    58    59    60  
   51  
    0  
   53    54    58    59    60    61    55    56    57  
   54    58    59    60    61    62    63    55    56    57  
   58    59    60    61    62    63    64    65    55    56    57  
   56    57    58    61  
   57  
    0  
   59    60    61    62    63  
   60    61  
   61  
   62    63    64    65    66    67  
   63    64    65  
   64    65    66    67    68    69  
   65    66    67  
   66    67    68    69    70    71  
   67    68    69  
   68    69    70    71    72    73    74  
   69    70    71  
   70    71    72    73    74  
   71    72    73    74  
   72    73    74  
   73    74  
   74  
    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   0.226300   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   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   48   3.5000   0.0660   0.003700   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.2500   0.1700  -0.296300   1.8100   1.6000   0.054801302  -1.445846770
   53   3.5500   0.0760  -0.259000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5500   0.0760   0.007500   2.0020   1.7750   0.023028004  -0.852763146
   55   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   58   3.5000   0.0660  -0.061200   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5600   0.3950   0.445000   2.0080   1.7800   0.025682759  -1.666211680
   62   2.7000   0.2800  -0.460000   1.5350   1.3500   0.001000000  -0.126889456
   63   3.5500   0.0760  -0.107500   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760  -0.063700   2.0020   1.7750   0.023028004  -0.852763146
   66   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   67   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   68   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   69   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   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    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   260.000  1.519
   33    39   268.000  1.529
   33    43   268.000  1.529
   37    38   340.000  1.090
   37    46   250.000  1.540
   37    48   268.000  1.529
   46    47   930.000  1.212
   46    52   440.000  1.369
   52    53   400.000  1.384
   52    48   305.000  1.456
   53    54   549.000  1.340
   53    55   230.000  1.545
   54    58   317.000  1.510
   54    61   205.000  1.810
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    48   260.000  1.519
   48    49   340.000  1.090
   61    62   700.000  1.530
   61    63   205.000  1.810
   63    64   340.000  1.080
   63    65   549.000  1.340
   65    66   340.000  1.080
   65    67   400.000  1.384
   67    68   434.000  1.010
   67    69   490.000  1.335
   69    70   570.000  1.229
   69    71   317.000  1.522
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   55    56   656.000  1.250
   55    57   656.000  1.250
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   340.000  1.090
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    50   320.000  1.410
   50    51   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  111.63000
   29    33    39    75.00000  111.63000
   29    33    43    75.00000  111.63000
   33    37    38    45.00000  112.72800
   33    37    46    63.00000  111.10000
   33    37    48    65.00000  119.52000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   33    43    44    37.50000  110.70000
   33    43    45    37.50000  110.70000
   33    43    50    50.00000  109.50000
   37    46    47    60.00000  136.58000
   37    46    52    95.00000   92.72400
   37    48    52   105.00000   87.49700
   37    48    58    65.00000  119.52000
   37    48    49    37.50000  110.70000
   46    37    38    40.00000  113.37500
   46    52    53    50.00000  132.10000
   46    52    48   100.00000   93.00000
   52    46    47    75.00000  131.60000
   52    53    54    75.00000  120.83300
   52    53    55    80.00000  114.48000
   52    48    58    80.00000  110.05700
   52    48    49    50.00000  112.01000
   53    54    58    70.00000  124.00000
   53    54    61    65.00000  118.19300
   53    55    56    85.00000  113.83300
   53    55    57    85.00000  113.83300
   54    58    59    35.00000  109.50000
   54    58    60    35.00000  109.50000
   54    58    48    70.00000  112.02700
   54    61    62   100.00000  107.42000
   54    61    63    80.00000   95.00000
   58    48    49    45.00000  112.72800
   60    58    59    33.00000  107.80000
   48    37    38    37.50000  110.70000
   48    37    46   100.00000   86.36000
   48    52    53    50.00000  132.70000
   48    58    59    45.00000  111.22300
   48    58    60    45.00000  111.22300
   61    54    58    70.00000  116.66000
   61    63    64    40.00000  114.00000
   61    63    65    65.00000  118.19300
   63    61    62   100.00000  107.42000
   63    65    66    35.00000  120.00000
   63    65    67    75.00000  120.83300
   65    63    64    35.00000  120.00000
   65    67    68    45.00000  117.55000
   65    67    69    70.00000  120.89900
   67    65    66    45.00000  111.09300
   67    69    70    80.00000  122.90000
   67    69    71    70.00000  116.60000
   69    67    68    35.00000  119.80000
   69    71    72    35.00000  109.50000
   69    71    73    35.00000  109.50000
   69    71    74    35.00000  109.50000
   71    69    70    80.00000  120.40000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   55    53    54    55.00000  124.75400
   57    55    56    80.00000  126.00000
   39    33    37    70.00000  112.98000
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    33.00000  107.80000
   43    33    37    70.00000  112.98000
   43    33    39    58.35000  112.70000
   43    50    51    55.00000  108.50000
   45    43    44    33.00000  107.80000
   50    43    44    35.00000  109.50000
   50    43    45    35.00000  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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   24    29    33    43   0.01700  1.0 1.0
   24    29    33    43  -0.23550 -1.0 2.0
   24    29    33    43   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    37    38   0.15000  1.0 3.0
   29    33    37    46   0.56750  1.0 1.0
   29    33    37    46  -0.07550 -1.0 2.0
   29    33    37    46   0.20000  1.0 3.0
   29    33    37    48   0.44750  1.0 1.0
   29    33    37    48  -0.17800 -1.0 2.0
   29    33    37    48   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.15000  1.0 3.0
   29    33    43    44   0.15000  1.0 3.0
   29    33    43    45   0.15000  1.0 3.0
   29    33    43    50   0.56750  1.0 1.0
   29    33    43    50  -0.07550 -1.0 2.0
   29    33    43    50   0.20000  1.0 3.0
   33    37    46    47   0.30150 -1.0 2.0
   33    37    46    52   1.39750  1.0 1.0
   33    37    46    52  -0.07950 -1.0 2.0
   33    37    46    52  -0.18750  1.0 3.0
   33    37   -48    52   0.43900  1.0 1.0
   33    37   -48    52   0.49100 -1.0 2.0
   33    37   -48    52   0.28400  1.0 3.0
   33    37    48    58   0.56750  1.0 1.0
   33    37    48    58  -0.07550 -1.0 2.0
   33    37    48    58   0.20000  1.0 3.0
   33    37    48    49   0.15000  1.0 3.0
   33    43    50    51  -0.11600  1.0 1.0
   33    43    50    51  -0.09450 -1.0 2.0
   33    43    50    51   0.21250  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    42   0.15000  1.0 3.0
   37    33    43    44   0.15000  1.0 3.0
   37    33    43    45   0.15000  1.0 3.0
   37    33    43    50   0.86500  1.0 1.0
   37    33    43    50  -0.17500 -1.0 2.0
   37    33    43    50   0.20800  1.0 3.0
   37    46    52    53   3.00000 -1.0 2.0
   37    46   -52    48   3.00000 -1.0 2.0
   38    37    46    47   0.00000  1.0 1.0
   38    37    46    52   0.00000  1.0 1.0
   38    37   -48    52   0.15000  1.0 3.0
   38    37    48    58   0.15000  1.0 3.0
   38    37    48    49   0.15000  1.0 3.0
   46    37   -48    52   3.00000 -1.0 2.0
   46    37    48    58  -0.95700  1.0 1.0
   46    37    48    58  -0.18200 -1.0 2.0
   46    37    48    58   0.29450  1.0 3.0
   46    37    48    49   0.15000  1.0 3.0
   46    52    53    54   0.00000  1.0 1.0
   46    52    53    55   0.00000  1.0 1.0
   46    52   -48    37   0.00000  1.0 1.0
   46    52   -48    58   0.00000  1.0 1.0
   46    52   -48    49   0.00000  1.0 1.0
   47    46    52    53   3.00000 -1.0 2.0
   47    46    52    48   3.00000 -1.0 2.0
   52    53   -54    58   7.00000 -1.0 2.0
   52    53    54    61   7.00000 -1.0 2.0
   52    53    55    56   1.91650 -1.0 2.0
   52    53    55    57   1.91650 -1.0 2.0
   53    52   -48    37   0.00000  1.0 1.0
   53    52   -48    58   0.00000  1.0 1.0
   53    52    48    49   0.00000  1.0 1.0
   53    54    58    59   0.00000  1.0 1.0
   53    54    58    60   0.00000  1.0 1.0
   53    54   -58    48   0.09850  1.0 1.0
   53    54   -58    48   0.15250 -1.0 2.0
   53    54   -58    48  -0.50650  1.0 3.0
   53    54    61    62   1.00000 -1.0 2.0
   53    54    61    63   1.00000 -1.0 2.0
   54    53    55    56  -0.04000 -1.0 2.0
   54    53    55    56  -0.29050  1.0 3.0
   54    53    55    57  -0.04000 -1.0 2.0
   54    53    55    57  -0.29050  1.0 3.0
   54    58    48    37   0.34400  1.0 1.0
   54    58    48    37   0.09450 -1.0 2.0
   54    58    48    37   0.11100  1.0 3.0
   54    58   -48    52   0.21700  1.0 1.0
   54    58   -48    52   0.68550 -1.0 2.0
   54    58   -48    52  -0.27950  1.0 3.0
   54    58    48    49   0.15000  1.0 3.0
   54    61    63    64   1.00000 -1.0 2.0
   54    61    63    65   1.00000 -1.0 2.0
   58    54    61    62   1.00000 -1.0 2.0
   58    54    61    63   1.00000 -1.0 2.0
   59    58    48    37   0.00000  1.0 1.0
   59    58    48    52   0.15000  1.0 3.0
   59    58    48    49   0.15000  1.0 3.0
   60    58    48    37   0.00000  1.0 1.0
   60    58    48    52   0.15000  1.0 3.0
   60    58    48    49   0.15000  1.0 3.0
   48    37   -46    47  -0.11250  1.0 1.0
   48    37   -46    47   0.11400 -1.0 2.0
   48    37   -46    47  -0.28950  1.0 3.0
   48    37   -46    52   3.00000 -1.0 2.0
   48    52   -53    54   0.00000  1.0 1.0
   48    52    53    55   0.00000  1.0 1.0
   61    54    58    59   0.00000  1.0 1.0
   61    54    58    60   0.00000  1.0 1.0
   61    54    58    48   0.09700  1.0 1.0
   61    54    58    48   0.15600 -1.0 2.0
   61    54    58    48  -0.50800  1.0 3.0
   61    63    65    66   7.00000 -1.0 2.0
   61    63    65    67   7.00000 -1.0 2.0
   62    61    63    64   1.00000 -1.0 2.0
   62    61    63    65   1.00000 -1.0 2.0
   63    65    67    68   0.78350 -1.0 2.0
   63    65    67    69  -0.18900  1.0 1.0
   63    65    67    69   1.70900 -1.0 2.0
   64    63    65    66   7.00000 -1.0 2.0
   64    63    65    67   7.00000 -1.0 2.0
   65    67    69    70   2.67200 -1.0 2.0
   65    67    69    71   0.67100  1.0 1.0
   65    67    69    71   1.42150 -1.0 2.0
   65    67    69    71   0.18700  1.0 3.0
   66    65    67    68   0.00000  1.0 1.0
   66    65    67    69   1.44600  1.0 1.0
   67    69    71    72   0.00000  1.0 1.0
   67    69    71    73   0.00000  1.0 1.0
   67    69    71    74   0.00000  1.0 1.0
   68    67    69    70   2.45000 -1.0 2.0
   68    67    69    71   2.45000 -1.0 2.0
   70    69    71    72   0.00000  1.0 1.0
   70    69    71    73   0.00000  1.0 1.0
   70    69    71    74   0.00000  1.0 1.0
   55    53    54    58   7.00000 -1.0 2.0
   55    53    54    61   7.00000 -1.0 2.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    46  -0.95700  1.0 1.0
   39    33    37    46  -0.18200 -1.0 2.0
   39    33    37    46   0.29450  1.0 3.0
   39    33    37    48   0.04050  1.0 1.0
   39    33    37    48   0.63700 -1.0 2.0
   39    33    37    48   0.17650  1.0 3.0
   39    33    43    44   0.15000  1.0 3.0
   39    33    43    45   0.15000  1.0 3.0
   39    33    43    50   0.86500  1.0 1.0
   39    33    43    50  -0.17500 -1.0 2.0
   39    33    43    50   0.20800  1.0 3.0
   43    33    37    38   0.15000  1.0 3.0
   43    33    37    46  -0.95700  1.0 1.0
   43    33    37    46  -0.18200 -1.0 2.0
   43    33    37    46   0.29450  1.0 3.0
   43    33    37    48   0.04050  1.0 1.0
   43    33    37    48   0.63700 -1.0 2.0
   43    33    37    48   0.17650  1.0 3.0
   43    33    39    40   0.15000  1.0 3.0
   43    33    39    41   0.15000  1.0 3.0
   43    33    39    42   0.15000  1.0 3.0
   44    43    50    51   0.19450  1.0 3.0
   45    43    50    51   0.19450  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   37    52    46    47  10.50000 -1.0 2.0
   48    46    52    53   1.00000 -1.0 2.0
   52    55    53    54   1.10000 -1.0 2.0
   58    61    54    53   1.10000 -1.0 2.0
   61    64    63    65  15.00000 -1.0 2.0
   67    66    65    63  15.00000 -1.0 2.0
   68    69    67    65   1.00000 -1.0 2.0
   67    71    69    70  10.50000 -1.0 2.0
   56    53    55    57  10.50000 -1.0 2.0
END
