* LIGAND DATABASE FILE (OPLS2005)
*
001      75    77    139    221     411
    1     0 S   NP   _N1_     1    29.09809    96.35759   -19.66405
    2     1 S   H    _HN1     2     1.02895    82.54527    21.85800
    3     1 S   H    _H1_     3     1.02902    46.78368   144.33094
    4     1 S   H    _H2_     4     1.02804    78.99911   -88.30148
    5     1 S   CT   _CA1     5     1.50224   157.14851   150.41390
    6     5 S   HC   _HA1     6     1.09693   104.89765    56.71883
    7     5 S   CO3  _C1_     7     1.54196   111.07936   -60.56742
    8     7 S   O2Z  _O11     8     1.26107   116.11240   -92.97471
    9     7 S   O2Z  _O12     9     1.26408   114.16216    85.51994
   10     5 S   CT   _CB1    10     1.53154   107.18817   172.72678
   11    10 S   HC   HB11    11     1.09821   109.57743   -50.52966
   12    10 S   HC   HB12    12     1.09780   110.61399    66.18375
   13    10 S   CT   _CG1    13     1.52868   111.99607  -171.30916
   14    13 S   HC   HG11    14     1.09486   110.26514   -61.18318
   15    13 S   HC   HG12    15     1.09639   110.00188    57.98141
   16    13 S   C    _CD1    16     1.51589   112.72107   178.50551
   17    16 S   O    _OE1    17     1.22696   123.36163    -5.74426
   18    16 S   N    _N2_    18     1.38666   111.40053   174.33614
   19    18 S   H    _HN2    19     1.01571   119.06825     2.15713
   20    18 S   CT1  _CA2    20     1.46180   123.39719  -178.40284
   21    20 S   HC   _HA2    21     1.09701   109.33728    -7.47795
   22    20 S   C    _C2_    22     1.53416   108.99708  -123.62870
   23    22 S   O    _O2_    23     1.23056   122.09092  -154.12706
   24    20 S   CT   _CB2    32     1.53491   111.20114   114.43534
   25    24 S   HC   HB21    33     1.09320   109.22298    61.72788
   26    24 S   HC   HB22    34     1.09512   110.42436   179.79633
   27    22 S   N    _N3_    24     1.38251   113.80397    32.79226
   28    27 S   H    _HN3    25     1.01635   119.40349    -2.52956
   29    24 S   S    _SG2    35     1.82928   111.31037   -60.55212
   30    27 S   CT   _CA3    26     1.45269   123.29472   177.96346
   31    30 S   HC   HA31    27     1.09536   107.41261   -69.16058
   32    30 S   HC   HA32    28     1.09560   108.14106    47.35667
   33    29 S   CT   _C19    36     1.86806   101.46876   150.99625
   34    30 S   CO3  _C3_    29     1.52949   114.01930   169.49502
   35    34 S   O2Z  _O31    30     1.26365   116.04642     2.31782
   36    34 S   O2Z  _O32    31     1.26419   114.41605  -177.60004
   37    33 S   C    _C13    37     1.51974   106.70062   -68.64106
   38    37 S   O    _O21    38     1.22264   124.26765    96.85869
   39    33 S   CT   _C17    73     1.52637   111.57669    62.53729
   40    39 S   HC   _H35    74     1.09574   111.95727   -55.66413
   41    39 S   HC   _H36    75     1.09843   109.50743  -172.00530
   42    37 S   N    _N19    39     1.40220   106.41385   -84.39704
   43    42 S   CA   _C8_    40     1.42701   123.88604   167.01180
   44    42 S   C    _C12    60     1.39895   111.20357   -12.62378
   45    44 S   O    _O20    61     1.21949   130.83478   165.43041
   46    43 S   CA   _C6_    41     1.40606   120.62046   -23.28810
   47    46 S   HA   _H27    42     1.08578   120.82108    -1.45333
   48    33 S   CT   _C18    62     1.53194   112.96153  -175.90399
   49    48 S   HC   _H37    63     1.10429   109.33876  -178.30939
   50    46 S   CA   _C9_    43     1.40305   121.22034   179.83449
   51    48 S   CT   _C16    64     1.51495   113.34537   -59.77308
   52    51 S   HC   _H33    65     1.09634   110.26055  -179.24983
   53    51 S   HC   _H34    66     1.09497   111.96591    62.98757
   54    50 S   CA   _C11    44     1.39376   120.17428    -1.61544
   55    54 S   Cl   CL25    45     1.72417   121.53485  -177.99474
   56    50 S   OS   _O22    50     1.37270   119.93732  -177.58111
   57    51 S   CT   _C14    67     1.53683   108.44530   -59.18958
   58    57 S   HC   _H29    68     1.09777   108.47220   -71.61896
   59    57 S   HC   _H30    69     1.09593   109.64065   172.51607
   60    54 S   CA   _C7_    46     1.39102   119.55983     1.59692
   61    60 S   HA   _H28    47     1.08662   120.98152  -179.55677
   62    56 S   CT   _C21    51     1.43833   112.53677   -73.54499
   63    62 S   HC   _H41    52     1.09632   111.62373   -13.73274
   64    57 S   CT   _C15    70     1.53882   114.12956    49.09230
   65    64 S   HC   _H31    71     1.09642   108.77937    76.11607
   66    64 S   HC   _H32    72     1.09644   109.13806  -168.61398
   67    43 S   CA   _C10    48     1.40338   122.16633   155.65637
   68    67 S   F    _F23    49     1.34065   121.13692    -3.79736
   69    62 S   CZ   _C5_    53     1.47299   109.94740   108.50271
   70    62 S   CT   _C20    56     1.52587   107.42472  -131.75879
   71    70 S   HC   _H38    57     1.09639   111.21337   -57.66698
   72    70 S   HC   _H39    58     1.09514   111.46929  -178.66250
   73    70 S   HC   _H40    59     1.09506   110.50921    60.69697
   74    69 S   CZ   _C4_    54     1.20079   179.45824  -151.78319
   75    74 S   HC   _H26    55     1.06522   179.59170   -33.92727
  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  12   5   4   3
  18   2   1   1  14   5  13   6   5  12  12   9   3   9   4   8
   4  10   8   5   4   7   4   9   5   4   3   3   2   8   6   2
   1   1   1   1   6   4   2   1   1   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    48    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    44    48    49    51    64    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    44    45    48    49    51    52    53    57    64    65    66    39    40    41  
   35    36  
   36  
    0  
   38    42    43    46    67    44    45    48    49    51    64    39    40    41  
   42    43    44    48    39  
   40    41    42    44    48    49    51    57    58    59    64    65    66  
   41    48    57    64    65    66  
   48    57    64    65    66  
   43    46    47    50    60    67    68    44    45    48    49    51  
   46    47    50    54    60    61    67    68    56    44    45    48  
   45    48    49    51    52    53    57    46    67  
   48    49    51  
   47    50    54    55    60    67    68    56    62  
   50    54    67    56  
   49    51    52    53    57    58    59    64  
   51    52    53    57  
   54    55    60    61    67    56    62    63    69    70  
   52    53    57    58    59    64    65    66  
   53    57    58    59    64  
   57    58    59    64  
   55    60    61    67    68    56    62  
   60    61    67    56  
   62    63    69    74    70    71    72    73    60  
   58    59    64    65    66  
   59    64    65    66  
   64    65    66  
   61    67    68  
   67    68  
   63    69    74    75    70    71    72    73  
   69    74    70    71    72    73  
   65    66  
   66  
    0  
   68  
    0  
   74    75    70    71    72    73  
   71    72    73    74  
   72    73  
   73  
    0  
   75  
    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  -0.175000   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   0.007500   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   3.7500   0.1050   0.630500   1.9250   1.7000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   39   3.5000   0.0660  -0.120000   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   3.2500   0.1700  -0.206700   1.8100   1.6000   0.054801302  -1.445846770
   43   3.5500   0.0700  -0.038300   2.5000   1.7750   0.001000000  -0.843144165
   44   3.7500   0.1050   0.630500   1.9250   1.7000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   46   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   47   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   56   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0700   0.220000   2.5000   1.7750   0.001000000  -0.843144165
   68   2.8500   0.0610  -0.220000   2.4980   2.2250   0.001000000   0.985400000
   69   3.6500   0.1500   0.010000   2.0580   1.8250   0.025318638  -1.264311570
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.6500   0.1500  -0.210000   2.0580   1.8250   0.025318638  -1.264311570
   75   2.4200   0.0300   0.200000   1.3810   1.2100   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   317.000  1.522
   33    48   268.000  1.529
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    42   490.000  1.335
   42    43   360.000  1.404
   42    44   490.000  1.335
   43    46   469.000  1.400
   43    67   469.000  1.400
   46    47   367.000  1.080
   46    50   469.000  1.400
   50    54   469.000  1.400
   50    56   450.000  1.364
   54    55   300.000  1.725
   54    60   469.000  1.400
   60    61   367.000  1.080
   60    67   469.000  1.400
   67    68   420.000  1.354
   56    62   320.000  1.410
   62    63   340.000  1.090
   62    69   390.000  1.470
   62    70   268.000  1.529
   69    74   985.000  1.221
   74    75   410.000  1.067
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   44    45   570.000  1.229
   44    48   317.000  1.522
   48    49   340.000  1.090
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    39   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    70.00000  112.33000
   29    33    48    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    42    70.00000  116.60000
   33    48    44    63.00000  111.10000
   33    48    49    37.50000  110.70000
   33    48    51    58.35000  112.70000
   33    39    64    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   37    42    43    65.00000  121.96500
   37    42    44    70.00000  121.37400
   42    37    38    80.00000  122.90000
   42    43    46    70.00000  119.01900
   42    43    67    70.00000  119.01900
   42    44    45    80.00000  122.90000
   42    44    48    70.00000  116.60000
   43    46    47    35.00000  120.00000
   43    46    50    63.00000  120.00000
   43    67    60    63.00000  120.00000
   43    67    68    80.00000  120.00000
   46    50    54    63.00000  120.00000
   46    50    56    70.00000  120.00000
   50    46    47    35.00000  120.00000
   50    54    55    75.00000  120.00000
   50    54    60    63.00000  120.00000
   50    56    62    75.00000  111.00000
   54    60    61    35.00000  120.00000
   54    60    67    63.00000  120.00000
   60    54    55    75.00000  120.00000
   60    67    68    80.00000  120.00000
   67    43    46    63.00000  120.00000
   67    60    61    35.00000  120.00000
   56    50    54    70.00000  120.00000
   56    62    63    35.00000  109.50000
   56    62    69    90.00000  109.17800
   56    62    70    50.00000  109.50000
   62    69    74    30.00000  179.48800
   62    70    71    37.50000  110.70000
   62    70    72    37.50000  110.70000
   62    70    73    37.50000  110.70000
   69    62    63    35.00000  108.50000
   69    74    75    20.00000  179.85100
   70    62    63    37.50000  110.70000
   70    62    69    58.35000  112.70000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   44    42    43    65.00000  121.96500
   44    48    49    35.00000  109.50000
   44    48    51    63.00000  111.10000
   48    33    37    63.00000  111.10000
   48    44    45    80.00000  120.40000
   48    51    52    37.50000  110.70000
   48    51    53    37.50000  110.70000
   48    51    57    58.35000  112.70000
   51    48    49    37.50000  110.70000
   51    57    58    37.50000  110.70000
   51    57    59    37.50000  110.70000
   51    57    64    58.35000  112.70000
   53    51    52    33.00000  107.80000
   57    51    52    37.50000  110.70000
   57    51    53    37.50000  110.70000
   57    64    65    37.50000  110.70000
   57    64    66    37.50000  110.70000
   57    64    39    58.35000  112.70000
   59    57    58    33.00000  107.80000
   64    57    58    37.50000  110.70000
   64    57    59    37.50000  110.70000
   64    39    40    37.50000  110.70000
   64    39    41    37.50000  110.70000
   66    64    65    33.00000  107.80000
   39    33    37    63.00000  111.10000
   39    33    48    58.35000  112.70000
   39    64    65    37.50000  110.70000
   39    64    66    37.50000  110.70000
   41    39    40    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.30150 -1.0 2.0
   29    33    37    42   0.00000  1.0 1.0
   29    33    48    44   0.56750  1.0 1.0
   29    33    48    44  -0.07550 -1.0 2.0
   29    33    48    44   0.20000  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    51   0.44750  1.0 1.0
   29    33    48    51  -0.17800 -1.0 2.0
   29    33    48    51   0.20200  1.0 3.0
   29    33    39    64   0.44750  1.0 1.0
   29    33    39    64  -0.17800 -1.0 2.0
   29    33    39    64   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
   33    37    42    43   0.76000  1.0 1.0
   33    37    42    43   4.11600 -1.0 2.0
   33    37   -42    44   2.45000 -1.0 2.0
   33    48    51    52   0.15000  1.0 3.0
   33    48    51    53   0.15000  1.0 3.0
   33    48    51    57   0.56750  1.0 1.0
   33    48    51    57  -0.07550 -1.0 2.0
   33    48    51    57   0.20000  1.0 3.0
   37    33   -48    44   0.11950  1.0 1.0
   37    33   -48    44   0.20300 -1.0 2.0
   37    33   -48    44  -0.70800  1.0 3.0
   37    33    48    49  -0.11250  1.0 3.0
   37    33    48    51  -0.95700  1.0 1.0
   37    33    48    51  -0.18200 -1.0 2.0
   37    33    48    51   0.29450  1.0 3.0
   37    33    39    64  -0.95700  1.0 1.0
   37    33    39    64  -0.18200 -1.0 2.0
   37    33    39    64   0.29450  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    41  -0.11250  1.0 3.0
   37    42    43    46   1.00100  1.0 1.0
   37    42    43    46   0.85050 -1.0 2.0
   37    42    43    67   1.00100  1.0 1.0
   37    42    43    67   0.85050 -1.0 2.0
   37    42    44    45   2.22250 -1.0 2.0
   37    42   -44    48   2.45000 -1.0 2.0
   38    37    42    43   0.04000 -1.0 2.0
   38    37    42    44   2.22250 -1.0 2.0
   42    43    46    47   3.62500 -1.0 2.0
   42    43    46    50   3.62500 -1.0 2.0
   42    43    67    60   3.62500 -1.0 2.0
   42    43    67    68   3.62500 -1.0 2.0
   42    44   -48    33   1.39750  1.0 1.0
   42    44   -48    33  -0.07950 -1.0 2.0
   42    44   -48    33  -0.18750  1.0 3.0
   42    44    48    49   0.00000  1.0 1.0
   42    44    48    51   1.39750  1.0 1.0
   42    44    48    51  -0.07950 -1.0 2.0
   42    44    48    51  -0.18750  1.0 3.0
   43    42    44    45   0.04000 -1.0 2.0
   43    42    44    48   0.76000  1.0 1.0
   43    42    44    48   4.11600 -1.0 2.0
   43    46    50    54   3.62500 -1.0 2.0
   43    46    50    56   3.62500 -1.0 2.0
   46    43    67    60   3.62500 -1.0 2.0
   46    43    67    68   3.62500 -1.0 2.0
   46    50    54    55   3.62500 -1.0 2.0
   46    50   -54    60   3.62500 -1.0 2.0
   46    50    56    62   1.63200 -1.0 2.0
   47    46    50    54   3.62500 -1.0 2.0
   47    46    50    56   3.62500 -1.0 2.0
   50    54    60    61   3.62500 -1.0 2.0
   50    54    60    67   3.62500 -1.0 2.0
   50    56    62    63   0.08050  1.0 3.0
   50    56    62    69  -0.25600  1.0 1.0
   50    56    62    69  -0.40050 -1.0 2.0
   50    56    62    69   0.34700  1.0 3.0
   50    56    62    70  -0.32850  1.0 1.0
   50    56    62    70  -0.35800 -1.0 2.0
   50    56    62    70   0.33950  1.0 3.0
   54    50    56    62   1.63200 -1.0 2.0
   54    60   -67    43   3.62500 -1.0 2.0
   54    60    67    68   3.62500 -1.0 2.0
   55    54    60    61   3.62500 -1.0 2.0
   55    54    60    67   3.62500 -1.0 2.0
   61    60    67    43   3.62500 -1.0 2.0
   61    60    67    68   3.62500 -1.0 2.0
   67    43    46    47   3.62500 -1.0 2.0
   67    43   -46    50   3.62500 -1.0 2.0
   56    50    54    55   3.62500 -1.0 2.0
   56    50    54    60   3.62500 -1.0 2.0
   56    62    69    74   0.00000  1.0 1.0
   56    62    70    71   0.23400  1.0 3.0
   56    62    70    72   0.23400  1.0 3.0
   56    62    70    73   0.23400  1.0 3.0
   62    69    74    75   0.00000  1.0 1.0
   63    62    69    74   0.00000  1.0 1.0
   63    62    70    71   0.15000  1.0 3.0
   63    62    70    72   0.15000  1.0 3.0
   63    62    70    73   0.15000  1.0 3.0
   69    62    70    71   0.15000  1.0 3.0
   69    62    70    72   0.15000  1.0 3.0
   69    62    70    73   0.15000  1.0 3.0
   70    62    69    74   0.00000  1.0 1.0
   44    42    43    46   1.00100  1.0 1.0
   44    42    43    46   0.85050 -1.0 2.0
   44    42    43    67   1.00100  1.0 1.0
   44    42    43    67   0.85050 -1.0 2.0
   44    48    51    52  -0.11250  1.0 3.0
   44    48    51    53  -0.11250  1.0 3.0
   44    48    51    57  -0.95700  1.0 1.0
   44    48    51    57  -0.18200 -1.0 2.0
   44    48    51    57   0.29450  1.0 3.0
   45    44    48    33   0.30150 -1.0 2.0
   45    44    48    49   0.00000  1.0 1.0
   45    44    48    51   0.30150 -1.0 2.0
   48    33    37    38   0.30150 -1.0 2.0
   48    33   -37    42   1.39750  1.0 1.0
   48    33   -37    42  -0.07950 -1.0 2.0
   48    33   -37    42  -0.18750  1.0 3.0
   48    33    39    64   0.56750  1.0 1.0
   48    33    39    64  -0.07550 -1.0 2.0
   48    33    39    64   0.20000  1.0 3.0
   48    33    39    40   0.15000  1.0 3.0
   48    33    39    41   0.15000  1.0 3.0
   48    51    57    58   0.15000  1.0 3.0
   48    51    57    59   0.15000  1.0 3.0
   48    51   -57    64   0.56750  1.0 1.0
   48    51   -57    64  -0.07550 -1.0 2.0
   48    51   -57    64   0.20000  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    53   0.15000  1.0 3.0
   49    48    51    57   0.15000  1.0 3.0
   51    57    64    65   0.15000  1.0 3.0
   51    57    64    66   0.15000  1.0 3.0
   51    57    64    39   0.56750  1.0 1.0
   51    57    64    39  -0.07550 -1.0 2.0
   51    57    64    39   0.20000  1.0 3.0
   52    51    57    58   0.15000  1.0 3.0
   52    51    57    59   0.15000  1.0 3.0
   52    51    57    64   0.15000  1.0 3.0
   53    51    57    58   0.15000  1.0 3.0
   53    51    57    59   0.15000  1.0 3.0
   53    51    57    64   0.15000  1.0 3.0
   57    64   -39    33   0.56750  1.0 1.0
   57    64   -39    33  -0.07550 -1.0 2.0
   57    64   -39    33   0.20000  1.0 3.0
   57    64    39    40   0.15000  1.0 3.0
   57    64    39    41   0.15000  1.0 3.0
   58    57    64    65   0.15000  1.0 3.0
   58    57    64    66   0.15000  1.0 3.0
   58    57    64    39   0.15000  1.0 3.0
   59    57    64    65   0.15000  1.0 3.0
   59    57    64    66   0.15000  1.0 3.0
   59    57    64    39   0.15000  1.0 3.0
   65    64    39    33   0.15000  1.0 3.0
   65    64    39    40   0.15000  1.0 3.0
   65    64    39    41   0.15000  1.0 3.0
   66    64    39    33   0.15000  1.0 3.0
   66    64    39    40   0.15000  1.0 3.0
   66    64    39    41   0.15000  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    42   1.39750  1.0 1.0
   39    33    37    42  -0.07950 -1.0 2.0
   39    33    37    42  -0.18750  1.0 3.0
   39    33    48    44  -0.95700  1.0 1.0
   39    33    48    44  -0.18200 -1.0 2.0
   39    33    48    44   0.29450  1.0 3.0
   39    33    48    49   0.15000  1.0 3.0
   39    33   -48    51   0.56750  1.0 1.0
   39    33   -48    51  -0.07550 -1.0 2.0
   39    33   -48    51   0.20000  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
   36    30    34    35  10.50000 -1.0 2.0
   33    42    37    38  10.50000 -1.0 2.0
   44    37    42    43   1.00000 -1.0 2.0
   46    67    43    42   4.00000 -1.0 2.0
   50    47    46    43   1.10000 -1.0 2.0
   54    56    50    46   4.00000 -1.0 2.0
   60    55    54    50   4.00000 -1.0 2.0
   67    61    60    54   1.10000 -1.0 2.0
   60    68    67    43   4.00000 -1.0 2.0
   42    48    44    45  10.50000 -1.0 2.0
END
