* LIGAND DATABASE FILE (OPLS2005)
*
001      72    75    144    239     420
    1     0 S   NP   _N1_     1    28.93815    95.27664   -25.41457
    2     1 S   H    _HN1     2     1.02947    77.53968     6.23108
    3     1 S   H    _H1_     3     1.02827    29.62824  -169.52698
    4     1 S   H    _H2_     4     1.02796   120.52394   -97.92255
    5     1 S   CT   _CA1     5     1.50124   120.75247   112.75229
    6     5 S   HC   _HA1     6     1.09575   105.15537    90.36898
    7     5 S   CO3  _C1_     7     1.53761   112.48655   -29.83194
    8     7 S   O2Z  _O11     8     1.26376   115.00411   -42.28629
    9     7 S   O2Z  _O12     9     1.26237   114.93515   136.73044
   10     5 S   CT   _CB1    10     1.53058   107.40707  -151.66757
   11    10 S   HC   HB11    11     1.09843   109.30270   -49.41627
   12    10 S   HC   HB12    12     1.09811   110.48500    67.16689
   13    10 S   CT   _CG1    13     1.53032   112.65774  -170.35278
   14    13 S   HC   HG11    14     1.09567   110.75364   -67.95333
   15    13 S   HC   HG12    15     1.09670   109.67861    51.30161
   16    13 S   C    _CD1    16     1.51815   111.93065   171.78642
   17    16 S   O    _OE1    17     1.22761   123.15498    13.65683
   18    16 S   N    _N2_    18     1.38659   111.88212  -166.36314
   19    18 S   H    _HN2    19     1.01573   118.97198     0.98636
   20    18 S   CT1  _CA2    20     1.46201   123.30964   175.87650
   21    20 S   HC   _HA2    21     1.09740   109.29358     7.25050
   22    20 S   C    _C2_    22     1.53680   108.73849  -108.20244
   23    22 S   O    _O2_    23     1.23078   122.23947  -148.19299
   24    20 S   CT   _CB2    32     1.53321   111.78292   129.27053
   25    24 S   HC   HB21    33     1.09591   110.20067    56.56996
   26    24 S   HC   HB22    34     1.09416   109.89438   175.46663
   27    22 S   N    _N3_    24     1.38309   113.84270    39.25199
   28    27 S   H    _HN3    25     1.01545   119.62934    -3.05069
   29    24 S   S    _SG2    35     1.82711   111.62586   -64.12269
   30    27 S   CT   _CA3    26     1.45287   123.31238   177.27739
   31    30 S   HC   HA31    27     1.09546   107.49733   -65.27479
   32    30 S   HC   HA32    28     1.09554   108.02178    51.19785
   33    29 S   CT   _C10    36     1.85156    99.48611  -177.97880
   34    33 S   HC   _H3_    37     1.09771   106.86449   -34.61058
   35    30 S   CO3  _C3_    29     1.52986   114.01188   173.20540
   36    35 S   O2Z  _O31    30     1.26389   116.06651    -0.58950
   37    35 S   O2Z  _O32    31     1.26422   114.42440   179.47437
   38    33 S   CM   _C4_    38     1.52522   108.62682  -151.59330
   39    33 S   CT   _C11    60     1.53168   109.96737    82.41526
   40    39 S   HC   _H29    61     1.09951   108.79463   -47.09277
   41    38 S   C3T  _C14    39     1.49196   117.41410  -100.48922
   42    38 S   CMA  _C6_    70     1.36019   118.44419    80.01893
   43    42 S   OM   _O16    71     1.25982   133.09255  -179.32363
   44    42 S   HC   _H21    72     1.09253   112.66310    -0.00000
   45    41 S   C3T  _C9_    40     1.51489   116.14119    72.29219
   46    45 S   HC   _H26    41     1.08279   119.89937    -6.46648
   47    45 S   HC   _H27    42     1.08545   118.09996   137.04720
   48    41 S   C3T  _C15    43     1.50821   122.56643     2.29363
   49    48 S   CO4  _C5_    44     1.49210   105.92386  -147.72651
   50    49 S   O    _O17    45     1.22079   124.90262  -167.33469
   51    48 S   CT   _C12    51     1.52621   119.00567    -4.16720
   52    51 S   HC   _H30    52     1.09711   107.79107   103.62348
   53    49 S   OS   _O18    46     1.36404   109.89146     9.34342
   54    51 S   CT   _C8_    53     1.54206   115.71442  -134.68513
   55    54 S   HC   _H24    54     1.09912   107.43422  -150.94885
   56    54 S   HC   _H25    55     1.09076   114.62557   -34.57775
   57    41 S   CO   _C13    47     1.51219   119.01828  -132.17351
   58    57 S   HC   _H31    48     1.09558   112.28431    28.31746
   59    54 S   CT   _C16    56     1.55234   107.14007    91.63167
   60    57 S   OH   _O19    49     1.42244   110.63455   -93.64546
   61    60 S   HO   _H38    50     0.97574   106.21295    56.72951
   62    59 S   CT   _C7_    57     1.54227   104.79602     6.18409
   63    62 S   HC   _H22    58     1.09603   111.00027   -98.31771
   64    62 S   HC   _H23    59     1.09582   112.58169   141.82277
   65    59 S   CT   _C17    62     1.53247   112.12463  -114.25531
   66    65 S   HC   _H32    63     1.09563   111.06853   -60.51899
   67    65 S   HC   _H33    64     1.09587   110.96412   179.54200
   68    65 S   HC   _H34    65     1.09339   111.84052    59.77436
   69    59 S   CT   _C18    66     1.53853   110.03247   125.03026
   70    69 S   HC   _H35    67     1.09581   110.99686    61.51407
   71    69 S   HC   _H36    68     1.09565   111.53746   -58.62370
   72    69 S   HC   _H37    69     1.09584   111.10404  -178.54559
  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
  18   7   2   1   1  17  17   8  17   5   1   1  12   5   4  13
   8   3  12   5   4  14   5   4   3   2  11   1   1  10   3   2
   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    51    62    39    40    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    45    48    57    51    52    54    59    62    63    64    39    40    42    43    44  
   38    41    51    62    39    40    42  
   36    37  
   37  
    0  
   41    45    46    47    48    49    53    57    58    60    51    62    39    40    42    43    44  
   40    65    69    42    41    45    48    49    51    52    54    55    56    59    62    63    64  
   48    51    52    54    59    62    63    64  
   45    46    47    48    49    50    53    57    58    60    61    51    52    54    42    43    44  
   43    44    45    48    57  
   44  
    0  
   46    47    48    49    50    53    57    58    60    51    52    54  
   47    48    49    57    51  
   48    49    57    51  
   49    50    53    57    58    60    51    52    54    55    56    59    62  
   50    53    57    58    60    51    52    54  
   53    57    51  
   52    54    55    56    59    62    63    64    65    69    53    57  
   54    55    56    59    62  
   57    58    60    61  
   55    56    59    62    63    64    65    66    67    68    69    70    71    72  
   56    59    62    65    69  
   59    62    65    69  
   58    60    61  
   60    61  
   62    63    64    65    66    67    68    69    70    71    72  
   61  
    0  
   63    64    65    66    67    68    69    70    71    72  
   64    65    69  
   65    69  
   66    67    68    69    70    71    72  
   67    68    69  
   68    69  
   69  
   70    71    72  
   71    72  
   72  
    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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.5500   0.0760   0.437200   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   44   2.5000   0.0500  -0.062100   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   49   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.0000   0.1700  -0.251400   1.7660   1.5600   0.020110767  -0.896042159
   54   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660   0.236100   1.9750   1.7500   0.005000000  -0.741685710
   58   2.4200   0.0150   0.100000   1.3810   1.2100   0.008598240   0.268726247
   59   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   60   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   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    39   268.000  1.529
   38    41   305.000  1.480
   38    42   465.000  1.376
   41    45   260.000  1.509
   41    48   260.000  1.509
   41    57   275.000  1.510
   45    46   340.000  1.088
   45    47   340.000  1.088
   45    48   260.000  1.509
   48    49   290.000  1.496
   48    51   275.000  1.510
   49    50   570.000  1.229
   49    53   214.000  1.327
   53    57   320.000  1.380
   57    58   340.000  1.090
   57    60   380.000  1.407
   60    61   553.000  0.945
   51    52   340.000  1.090
   51    54   268.000  1.529
   51    39   268.000  1.529
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    59   268.000  1.529
   59    62   268.000  1.529
   59    65   268.000  1.529
   59    69   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    39   268.000  1.529
   39    40   340.000  1.090
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   42    43   745.000  1.250
   42    44   335.000  1.111
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    38    41    65.00000  117.92700
   33    38    42    70.00000  124.00000
   33    39    51    58.35000  112.70000
   33    39    62    58.35000  112.70000
   33    39    40    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    41    45    60.00000  120.58800
   38    41    48    60.00000  120.58800
   38    41    57    65.00000  117.55000
   38    42    43    65.00000  137.10300
   38    42    44    45.00000  105.30000
   41    45    46    37.50000  117.20000
   41    45    47    37.50000  117.20000
   41    45    48    10.00000   60.00500
   41    48    45    10.00000   60.00500
   41    48    49    65.00000  117.18000
   41    48    51    60.00000  120.94000
   41    57    53    90.00000  108.56700
   41    57    58    45.00000  112.01100
   41    57    60    90.00000  110.19100
   45    48    49    65.00000  117.18000
   45    48    51    60.00000  120.94000
   47    45    46    35.00000  114.30000
   48    41    45    10.00000   60.00500
   48    45    46    37.50000  117.20000
   48    45    47    37.50000  117.20000
   48    49    50    75.00000  121.36600
   48    49    53    81.00000  111.40000
   48    51    52    45.00000  109.38400
   48    51    54    70.00000  112.37300
   48    51    39    70.00000  112.37300
   49    53    57    95.00000  111.08000
   53    49    50    83.00000  123.40000
   53    57    58    35.00000  109.50000
   53    57    60   110.00000  112.08000
   57    41    45    60.00000  120.94000
   57    41    48    60.00000  120.94000
   57    60    61    70.00000  107.92000
   60    57    58    60.00000  108.02500
   51    48    49    63.00000  111.10000
   51    54    55    37.50000  110.70000
   51    54    56    37.50000  110.70000
   51    54    59    58.35000  112.70000
   51    39    62    58.35000  112.70000
   51    39    40    37.50000  110.70000
   54    51    52    37.50000  110.70000
   54    59    62    58.35000  112.70000
   54    59    65    58.35000  112.70000
   54    59    69    58.35000  112.70000
   56    54    55    33.00000  107.80000
   59    54    55    37.50000  110.70000
   59    54    56    37.50000  110.70000
   59    62    63    37.50000  110.70000
   59    62    64    37.50000  110.70000
   59    62    39    58.35000  112.70000
   59    65    66    37.50000  110.70000
   59    65    67    37.50000  110.70000
   59    65    68    37.50000  110.70000
   59    69    70    37.50000  110.70000
   59    69    71    37.50000  110.70000
   59    69    72    37.50000  110.70000
   62    39    40    37.50000  110.70000
   64    62    63    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.02700
   39    51    52    37.50000  110.70000
   39    51    54    58.35000  112.70000
   39    62    63    37.50000  110.70000
   39    62    64    37.50000  110.70000
   65    59    62    58.35000  112.70000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   69    59    62    58.35000  112.70000
   69    59    65    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   42    38    41    55.00000  125.06700
   44    42    43    50.00000  124.16400
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    41   0.30250  1.0 1.0
   29    33    38    41  -0.14950 -1.0 2.0
   29    33    38    41   0.36900  1.0 3.0
   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    39    51   0.44750  1.0 1.0
   29    33    39    51  -0.17800 -1.0 2.0
   29    33    39    51   0.20200  1.0 3.0
   29    33    39    62   0.44750  1.0 1.0
   29    33    39    62  -0.17800 -1.0 2.0
   29    33    39    62   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   33    38    41    45   0.46850  1.0 1.0
   33    38    41    45   0.08550 -1.0 2.0
   33    38    41    45   0.09800  1.0 3.0
   33    38    41    48   0.46850  1.0 1.0
   33    38    41    48   0.08550 -1.0 2.0
   33    38    41    48   0.09800  1.0 3.0
   33    38    41    57   0.46850  1.0 1.0
   33    38    41    57   0.08550 -1.0 2.0
   33    38    41    57   0.09800  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    44   7.00000 -1.0 2.0
   34    33    38    41   0.34800  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    39    51   0.15000  1.0 3.0
   34    33    39    62   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   38    33    39    51   0.34400  1.0 1.0
   38    33    39    51   0.09450 -1.0 2.0
   38    33    39    51   0.11100  1.0 3.0
   38    33    39    62   0.34400  1.0 1.0
   38    33    39    62   0.09450 -1.0 2.0
   38    33    39    62   0.11100  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    41    45    46   0.15000  1.0 3.0
   38    41    45    47   0.15000  1.0 3.0
   38    41   -45    48   0.34400  1.0 1.0
   38    41   -45    48   0.09450 -1.0 2.0
   38    41   -45    48   0.11100  1.0 3.0
   38    41   -48    45   0.34400  1.0 1.0
   38    41   -48    45   0.09450 -1.0 2.0
   38    41   -48    45   0.11100  1.0 3.0
   38    41    48    49  -0.98800  1.0 1.0
   38    41    48    49   0.48800 -1.0 2.0
   38    41    48    49   0.76800  1.0 3.0
   38    41   -48    51   0.34400  1.0 1.0
   38    41   -48    51   0.09450 -1.0 2.0
   38    41   -48    51   0.11100  1.0 3.0
   38    41    57    53   0.61850  1.0 1.0
   38    41    57    53  -0.22750 -1.0 2.0
   38    41    57    53   0.15300  1.0 3.0
   38    41    57    58   0.15000  1.0 3.0
   38    41    57    60   1.05650  1.0 1.0
   38    41    57    60   0.15600 -1.0 2.0
   38    41    57    60   0.53150  1.0 3.0
   41    38    42    43   7.00000 -1.0 2.0
   41    38    42    44   7.00000 -1.0 2.0
   41    45   -48    49  -0.95700  1.0 1.0
   41    45   -48    49  -0.18200 -1.0 2.0
   41    45   -48    49   0.29450  1.0 3.0
   41    45   -48    51   0.07850  1.0 1.0
   41    45   -48    51  -0.03950 -1.0 2.0
   41    45   -48    51   0.67350  1.0 3.0
   41    48    49    50   0.30150 -1.0 2.0
   41    48   -49    53   0.36750  1.0 3.0
   41    48    51    52   0.15000  1.0 3.0
   41    48    51    54   0.07850  1.0 1.0
   41    48    51    54  -0.03950 -1.0 2.0
   41    48    51    54   0.67350  1.0 3.0
   41    48    51    39   0.07850  1.0 1.0
   41    48    51    39  -0.03950 -1.0 2.0
   41    48    51    39   0.67350  1.0 3.0
   41    57    60    61  -0.11600  1.0 1.0
   41    57    60    61  -0.09450 -1.0 2.0
   41    57    60    61   0.21250  1.0 3.0
   45    41   -48    49  -0.95700  1.0 1.0
   45    41   -48    49  -0.18200 -1.0 2.0
   45    41   -48    49   0.29450  1.0 3.0
   45    41   -48    51   0.07850  1.0 1.0
   45    41   -48    51  -0.03950 -1.0 2.0
   45    41   -48    51   0.67350  1.0 3.0
   45    41    57    53  -0.26800  1.0 1.0
   45    41    57    53   0.69150 -1.0 2.0
   45    41    57    53  -0.48750  1.0 3.0
   45    41    57    58   0.15000  1.0 3.0
   45    41    57    60   0.86500  1.0 1.0
   45    41    57    60  -0.17500 -1.0 2.0
   45    41    57    60   0.20800  1.0 3.0
   45    48    49    50   0.30150 -1.0 2.0
   45    48   -49    53   0.36750  1.0 3.0
   45    48    51    52   0.15000  1.0 3.0
   45    48    51    54   0.07850  1.0 1.0
   45    48    51    54  -0.03950 -1.0 2.0
   45    48    51    54   0.67350  1.0 3.0
   45    48    51    39   0.07850  1.0 1.0
   45    48    51    39  -0.03950 -1.0 2.0
   45    48    51    39   0.67350  1.0 3.0
   46    45   -48    41   0.15000  1.0 3.0
   46    45    48    49   0.15000  1.0 3.0
   46    45    48    51   0.15000  1.0 3.0
   47    45   -48    41   0.15000  1.0 3.0
   47    45    48    49   0.15000  1.0 3.0
   47    45    48    51   0.15000  1.0 3.0
   48    41   -45    46   0.15000  1.0 3.0
   48    41   -45    47   0.15000  1.0 3.0
   48    41   -57    53  -0.26800  1.0 1.0
   48    41   -57    53   0.69150 -1.0 2.0
   48    41   -57    53  -0.48750  1.0 3.0
   48    41    57    58   0.15000  1.0 3.0
   48    41    57    60   0.86500  1.0 1.0
   48    41    57    60  -0.17500 -1.0 2.0
   48    41    57    60   0.20800  1.0 3.0
   48    49   -53    57   1.63150  1.0 1.0
   48    49   -53    57   2.92000 -1.0 2.0
   48    51    54    55   0.15000  1.0 3.0
   48    51    54    56   0.15000  1.0 3.0
   48    51    54    59   0.47050  1.0 1.0
   48    51    54    59   0.03900 -1.0 2.0
   48    51    54    59   0.20100  1.0 3.0
   48    51   -39    33   0.47050  1.0 1.0
   48    51   -39    33   0.03900 -1.0 2.0
   48    51   -39    33   0.20100  1.0 3.0
   48    51    39    62   0.47050  1.0 1.0
   48    51    39    62   0.03900 -1.0 2.0
   48    51    39    62   0.20100  1.0 3.0
   48    51    39    40   0.15000  1.0 3.0
   49    48    51    52  -0.11250  1.0 3.0
   49    48    51    54  -0.95700  1.0 1.0
   49    48    51    54  -0.18200 -1.0 2.0
   49    48    51    54   0.29450  1.0 3.0
   49    48    51    39  -0.95700  1.0 1.0
   49    48    51    39  -0.18200 -1.0 2.0
   49    48    51    39   0.29450  1.0 3.0
   49    53   -57    41  -2.60950  1.0 1.0
   49    53   -57    41   1.40200 -1.0 2.0
   49    53   -57    41   0.21950  1.0 3.0
   49    53    57    58   0.08050  1.0 3.0
   49    53    57    60  -3.31650  1.0 1.0
   49    53    57    60   0.10350 -1.0 2.0
   49    53    57    60  -0.05050  1.0 3.0
   50    49    53    57   3.00000 -1.0 2.0
   53    57    60    61  -0.50000  1.0 1.0
   53    57    60    61  -0.73950 -1.0 2.0
   53    57    60    61   0.17150  1.0 3.0
   57    41    45    46   0.15000  1.0 3.0
   57    41    45    47   0.15000  1.0 3.0
   57    41   -45    48   0.07850  1.0 1.0
   57    41   -45    48  -0.03950 -1.0 2.0
   57    41   -45    48   0.67350  1.0 3.0
   57    41   -48    45   0.07850  1.0 1.0
   57    41   -48    45  -0.03950 -1.0 2.0
   57    41   -48    45   0.67350  1.0 3.0
   57    41   -48    49  -0.95700  1.0 1.0
   57    41   -48    49  -0.18200 -1.0 2.0
   57    41   -48    49   0.29450  1.0 3.0
   57    41    48    51   3.97050  1.0 1.0
   58    57    60    61   0.19450  1.0 3.0
   51    48    49    50   0.30150 -1.0 2.0
   51    48    49    53   0.36750  1.0 3.0
   51    54   -59    62   0.56750  1.0 1.0
   51    54   -59    62  -0.07550 -1.0 2.0
   51    54   -59    62   0.20000  1.0 3.0
   51    54    59    65   0.56750  1.0 1.0
   51    54    59    65  -0.07550 -1.0 2.0
   51    54    59    65   0.20000  1.0 3.0
   51    54    59    69   0.56750  1.0 1.0
   51    54    59    69  -0.07550 -1.0 2.0
   51    54    59    69   0.20000  1.0 3.0
   52    51    54    55   0.15000  1.0 3.0
   52    51    54    56   0.15000  1.0 3.0
   52    51    54    59   0.15000  1.0 3.0
   52    51    39    33   0.15000  1.0 3.0
   52    51    39    62   0.15000  1.0 3.0
   52    51    39    40   0.15000  1.0 3.0
   54    51    39    33   0.56750  1.0 1.0
   54    51    39    33  -0.07550 -1.0 2.0
   54    51    39    33   0.20000  1.0 3.0
   54    51   -39    62   0.56750  1.0 1.0
   54    51   -39    62  -0.07550 -1.0 2.0
   54    51   -39    62   0.20000  1.0 3.0
   54    51    39    40   0.15000  1.0 3.0
   54    59    62    63   0.15000  1.0 3.0
   54    59    62    64   0.15000  1.0 3.0
   54    59   -62    39   0.56750  1.0 1.0
   54    59   -62    39  -0.07550 -1.0 2.0
   54    59   -62    39   0.20000  1.0 3.0
   54    59    65    66   0.15000  1.0 3.0
   54    59    65    67   0.15000  1.0 3.0
   54    59    65    68   0.15000  1.0 3.0
   54    59    69    70   0.15000  1.0 3.0
   54    59    69    71   0.15000  1.0 3.0
   54    59    69    72   0.15000  1.0 3.0
   55    54    59    62   0.15000  1.0 3.0
   55    54    59    65   0.15000  1.0 3.0
   55    54    59    69   0.15000  1.0 3.0
   56    54    59    62   0.15000  1.0 3.0
   56    54    59    65   0.15000  1.0 3.0
   56    54    59    69   0.15000  1.0 3.0
   59    62    39    33   0.56750  1.0 1.0
   59    62    39    33  -0.07550 -1.0 2.0
   59    62    39    33   0.20000  1.0 3.0
   59    62   -39    51   0.56750  1.0 1.0
   59    62   -39    51  -0.07550 -1.0 2.0
   59    62   -39    51   0.20000  1.0 3.0
   59    62    39    40   0.15000  1.0 3.0
   62    59    65    66   0.15000  1.0 3.0
   62    59    65    67   0.15000  1.0 3.0
   62    59    65    68   0.15000  1.0 3.0
   62    59    69    70   0.15000  1.0 3.0
   62    59    69    71   0.15000  1.0 3.0
   62    59    69    72   0.15000  1.0 3.0
   63    62    39    33   0.15000  1.0 3.0
   63    62    39    51   0.15000  1.0 3.0
   63    62    39    40   0.15000  1.0 3.0
   64    62    39    33   0.15000  1.0 3.0
   64    62    39    51   0.15000  1.0 3.0
   64    62    39    40   0.15000  1.0 3.0
   39    33   -38    41   0.46850  1.0 1.0
   39    33   -38    41   0.08550 -1.0 2.0
   39    33   -38    41   0.09800  1.0 3.0
   39    33    38    42   0.09850  1.0 1.0
   39    33    38    42   0.15250 -1.0 2.0
   39    33    38    42  -0.50650  1.0 3.0
   39    51    54    55   0.15000  1.0 3.0
   39    51    54    56   0.15000  1.0 3.0
   39    51   -54    59   0.56750  1.0 1.0
   39    51   -54    59  -0.07550 -1.0 2.0
   39    51   -54    59   0.20000  1.0 3.0
   65    59    62    63   0.15000  1.0 3.0
   65    59    62    64   0.15000  1.0 3.0
   65    59    62    39   0.56750  1.0 1.0
   65    59    62    39  -0.07550 -1.0 2.0
   65    59    62    39   0.20000  1.0 3.0
   65    59    69    70   0.15000  1.0 3.0
   65    59    69    71   0.15000  1.0 3.0
   65    59    69    72   0.15000  1.0 3.0
   69    59    62    63   0.15000  1.0 3.0
   69    59    62    64   0.15000  1.0 3.0
   69    59    62    39   0.56750  1.0 1.0
   69    59    62    39  -0.07550 -1.0 2.0
   69    59    62    39   0.20000  1.0 3.0
   69    59    65    66   0.15000  1.0 3.0
   69    59    65    67   0.15000  1.0 3.0
   69    59    65    68   0.15000  1.0 3.0
   42    38    41    45   0.09850  1.0 1.0
   42    38    41    45   0.15250 -1.0 2.0
   42    38    41    45  -0.50650  1.0 3.0
   42    38    41    48   0.09850  1.0 1.0
   42    38    41    48   0.15250 -1.0 2.0
   42    38    41    48  -0.50650  1.0 3.0
   42    38    41    57   0.09850  1.0 1.0
   42    38    41    57   0.15250 -1.0 2.0
   42    38    41    57  -0.50650  1.0 3.0
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    41    38    42   1.10000 -1.0 2.0
   48    53    49    50  10.50000 -1.0 2.0
   43    44    42    38   1.10000 -1.0 2.0
END
