* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    140    226     420
    1     0 S   NP   _N1_     1    28.83499    95.39752   -25.15664
    2     1 S   H    _HN1     2     1.02949    75.39422    15.89846
    3     1 S   H    _H1_     3     1.02828    31.92789  -171.33265
    4     1 S   H    _H2_     4     1.02785   115.19310   -87.82321
    5     1 S   CT   _CA1     5     1.50113   127.09878   120.64869
    6     5 S   HC   _HA1     6     1.09573   105.19574    90.86597
    7     5 S   CO3  _C1_     7     1.53784   112.45832   -29.37403
    8     7 S   O2Z  _O11     8     1.26372   115.00389   -42.59534
    9     7 S   O2Z  _O12     9     1.26238   114.94300   136.52821
   10     5 S   CT   _CB1    10     1.53076   107.42126  -151.14803
   11    10 S   HC   HB11    11     1.09833   109.36990   -49.69199
   12    10 S   HC   HB12    12     1.09813   110.44782    66.91316
   13    10 S   CT   _CG1    13     1.52993   112.61238  -170.66784
   14    13 S   HC   HG11    14     1.09581   110.63733   -65.71095
   15    13 S   HC   HG12    15     1.09670   109.78620    53.52826
   16    13 S   C    _CD1    16     1.51799   112.20351   173.98402
   17    16 S   O    _OE1    17     1.22733   123.27774     7.22884
   18    16 S   N    _N2_    18     1.38655   111.68778  -172.90256
   19    18 S   H    _HN2    19     1.01582   118.94356     1.67211
   20    18 S   CT1  _CA2    20     1.46191   123.36024   177.45424
   21    20 S   HC   _HA2    21     1.09737   109.36134     2.26762
   22    20 S   C    _C2_    22     1.53540   108.63261  -113.21753
   23    22 S   O    _O2_    23     1.23059   122.26726  -148.05660
   24    20 S   CT   _CB2    32     1.53315   111.59825   124.27354
   25    24 S   HC   HB21    33     1.09506   110.05042    56.76280
   26    24 S   HC   HB22    34     1.09523   110.12309   175.73281
   27    22 S   N    _N3_    24     1.38324   113.70516    39.38804
   28    27 S   H    _HN3    25     1.01586   119.58404    -3.33284
   29    24 S   S    _SG2    35     1.82765   111.48542   -64.65410
   30    27 S   CT   _CA3    26     1.45287   123.21895   177.12274
   31    30 S   HC   HA31    27     1.09549   107.51128   -64.55521
   32    30 S   HC   HA32    28     1.09556   107.98457    51.88388
   33    29 S   CT   _C15    36     1.83816    99.52206  -179.38356
   34    33 S   HC   _H3_    37     1.09570   106.98324    42.29614
   35    30 S   CO3  _C3_    29     1.52961   114.07632   173.88044
   36    35 S   O2Z  _O31    30     1.26376   116.06745    -0.66881
   37    35 S   O2Z  _O32    31     1.26428   114.41265   179.39059
   38    33 S   CT   _C8_    38     1.52851   110.91070   -77.63482
   39    38 S   HC   _H22    39     1.09528   110.59588   153.50422
   40    38 S   HC   _H23    40     1.09218   114.78286    28.93902
   41    38 S   CO4  _C6_    41     1.50575   102.89058   -91.71542
   42    41 S   O    _O17    42     1.22641   122.84658   164.55513
   43    41 S   CT   _C16    43     1.53058   112.98067   -16.79709
   44    43 S   CT   _C9_    44     1.54760   108.34271  -126.45111
   45    44 S   HC   _H24    45     1.09988   109.43767    23.74898
   46    44 S   HC   _H25    46     1.09895   109.00685   -89.77715
   47    33 S   CT   _C12    60     1.55751   116.07197   164.77584
   48    47 S   HC   _H29    61     1.10206   103.91358  -164.96960
   49    43 S   CT   _C18    69     1.53925   106.52333   114.66025
   50    49 S   HC   _H36    70     1.09114   112.92080  -171.21343
   51    49 S   HC   _H37    71     1.09721   110.70500    68.75060
   52    49 S   HC   _H38    72     1.09209   112.79930   -48.94369
   53    44 S   CT   _C11    47     1.53015   116.73477   145.27550
   54    53 S   HC   _H28    48     1.09888   108.95510   -79.96474
   55    53 S   CM   _C4_    49     1.49335   115.62001   160.19499
   56    55 S   CO4  _C5_    50     1.47656   108.42194  -147.28718
   57    56 S   O    _O16    51     1.21728   127.16734  -169.64769
   58    55 S   CM   _C7_    66     1.33605   130.03964    31.67522
   59    58 S   HC   _H20    67     1.08467   121.17573     0.91792
   60    58 S   HC   _H21    68     1.08535   121.65683  -179.37442
   61    56 S   OS   _O18    52     1.36229   106.88822     9.09416
   62    53 S   CT   _C14    53     1.51893   114.96677    43.74910
   63    62 S   HC   _H31    54     1.09414   113.28500    37.46340
   64    62 S   CT   _C10    55     1.52617   113.15415   -89.92074
   65    64 S   HC   _H26    56     1.09986   108.16995   -55.79181
   66    64 S   HC   _H27    57     1.09945   107.93749  -167.91788
   67    64 S   CT   _C13    58     1.54631   118.03291    68.94777
   68    67 S   HC   _H30    59     1.09590   107.73105    73.70745
   69    67 S   CT   _C17    62     1.54148   106.25118  -171.80617
   70    69 S   HC   _H33    63     1.09562   111.03191    69.13621
   71    69 S   HC   _H34    64     1.09596   110.74202   -50.65047
   72    69 S   HC   _H35    65     1.09182   112.51366  -169.76999
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  15   8   2   1   1  10   5   4  13   4  17  18   7   6  16   5
   5   2   1   1  14   7   9   8   3   4   1   1   6   7   4   8
   4   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    43    67    47    48  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    64    67    68    47    48    69    49  
   38    39    40    41    43    67    47    48  
   36    37  
   37  
    0  
   39    40    41    42    43    44    67    47    48    49  
   40    41    42    43    47  
   41    42    43    47  
   42    43    44    45    46    53    67    47    48    49    50    51    52  
   43    44    47    49  
   44    45    46    53    54    55    62    64    67    68    47    48    69    49    50    51    52  
   45    46    53    54    55    56    61    62    63    64    67    47    48    58    49    50    51    52  
   46    53    54    55    62    47    49  
   53    54    55    62    47    49  
   48    69    70    71    72    49    50    51    52    53    62    64    65    66    67    68  
   69    49    64    67    68  
   50    51    52    53    67  
   51    52  
   52  
    0  
   54    55    56    57    61    62    63    64    65    66    67    58    59    60  
   55    56    61    62    63    64    58  
   56    57    61    62    63    64    58    59    60  
   57    61    62    63    64    58    59    60  
   61    62    58  
   59    60    61    62  
   60  
    0  
   62    63    64    65    66    67  
   63    64    65    66    67    68    69  
   64    65    66    67  
   65    66    67    68    69    70    71    72  
   66    67    68    69  
   67    68    69  
   68    69    70    71    72  
   69    70    71    72  
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   56   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   58   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   62   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.4200   0.0150   0.030000   1.3810   1.2100   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   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   268.000  1.529
   33    47   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   317.000  1.522
   41    42   570.000  1.229
   41    43   317.000  1.522
   43    44   268.000  1.529
   43    47   268.000  1.529
   43    49   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    53   268.000  1.529
   53    54   340.000  1.090
   53    55   317.000  1.510
   53    62   268.000  1.529
   55    56   320.000  1.462
   55    58   549.000  1.340
   56    57   570.000  1.229
   56    61   214.000  1.327
   61    62   320.000  1.410
   62    63   340.000  1.090
   62    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   268.000  1.529
   67    68   340.000  1.090
   67    47   268.000  1.529
   67    69   268.000  1.529
   47    48   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   58    59   340.000  1.080
   58    60   340.000  1.080
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    47    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    63.00000  111.10000
   33    47    43    58.35000  112.70000
   33    47    67    58.35000  112.70000
   33    47    48    37.50000  110.70000
   38    33    34    37.50000  110.70000
   38    41    42    80.00000  120.40000
   38    41    43    70.00000  116.00000
   40    38    39    33.00000  107.80000
   41    38    39    35.00000  109.50000
   41    38    40    35.00000  109.50000
   41    43    44    63.00000  111.10000
   41    43    47    63.00000  111.10000
   41    43    49    63.00000  111.10000
   43    41    42    80.00000  120.40000
   43    44    45    37.50000  110.70000
   43    44    46    37.50000  110.70000
   43    44    53    58.35000  112.70000
   43    47    67    58.35000  112.70000
   43    47    48    37.50000  110.70000
   43    49    50    37.50000  110.70000
   43    49    51    37.50000  110.70000
   43    49    52    37.50000  110.70000
   44    53    54    37.50000  110.70000
   44    53    55    70.00000  112.02700
   44    53    62    58.35000  112.70000
   46    44    45    33.00000  107.80000
   53    44    45    37.50000  110.70000
   53    44    46    37.50000  110.70000
   53    55    56    65.00000  116.34900
   53    55    58    70.00000  124.00000
   53    62    61    50.00000  109.50000
   53    62    63    37.50000  110.70000
   53    62    64    58.35000  112.70000
   55    53    54    35.00000  109.50000
   55    56    57    80.00000  123.72100
   55    56    61    90.00000  111.29400
   55    58    59    35.00000  120.00000
   55    58    60    35.00000  120.00000
   56    61    62    83.00000  116.90000
   61    56    57    83.00000  123.40000
   61    62    63    35.00000  109.50000
   61    62    64    50.00000  109.50000
   62    53    54    37.50000  110.70000
   62    53    55    70.00000  112.02700
   62    64    65    37.50000  110.70000
   62    64    66    37.50000  110.70000
   62    64    67    58.35000  112.70000
   64    62    63    37.50000  110.70000
   64    67    68    37.50000  110.70000
   64    67    47    58.35000  112.70000
   64    67    69    58.35000  112.70000
   66    64    65    33.00000  107.80000
   67    64    65    37.50000  110.70000
   67    64    66    37.50000  110.70000
   67    47    48    37.50000  110.70000
   67    69    70    37.50000  110.70000
   67    69    71    37.50000  110.70000
   67    69    72    37.50000  110.70000
   47    33    34    37.50000  110.70000
   47    33    38    58.35000  112.70000
   47    43    44    58.35000  112.70000
   47    67    68    37.50000  110.70000
   69    67    68    37.50000  110.70000
   69    67    47    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
   58    55    56    65.00000  118.96000
   60    58    59    35.00000  117.00000
   49    43    44    58.35000  112.70000
   49    43    47    58.35000  112.70000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.56750  1.0 1.0
   29    33    38    41  -0.07550 -1.0 2.0
   29    33    38    41   0.20000  1.0 3.0
   29    33    47    43   0.44750  1.0 1.0
   29    33    47    43  -0.17800 -1.0 2.0
   29    33    47    43   0.20200  1.0 3.0
   29    33    47    67   0.44750  1.0 1.0
   29    33    47    67  -0.17800 -1.0 2.0
   29    33    47    67   0.20200  1.0 3.0
   29    33    47    48   0.15000  1.0 3.0
   33    38    41    42   0.30150 -1.0 2.0
   33    38   -41    43   0.60050  1.0 1.0
   33    38   -41    43   0.05600 -1.0 2.0
   33    38   -41    43   0.26150  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41  -0.11250  1.0 3.0
   34    33    47    43   0.15000  1.0 3.0
   34    33    47    67   0.15000  1.0 3.0
   34    33    47    48   0.15000  1.0 3.0
   38    33   -47    43   0.56750  1.0 1.0
   38    33   -47    43  -0.07550 -1.0 2.0
   38    33   -47    43   0.20000  1.0 3.0
   38    33    47    67   0.56750  1.0 1.0
   38    33    47    67  -0.07550 -1.0 2.0
   38    33    47    67   0.20000  1.0 3.0
   38    33    47    48   0.15000  1.0 3.0
   38    41    43    44   0.60050  1.0 1.0
   38    41    43    44   0.05600 -1.0 2.0
   38    41    43    44   0.26150  1.0 3.0
   38    41   -43    47   0.60050  1.0 1.0
   38    41   -43    47   0.05600 -1.0 2.0
   38    41   -43    47   0.26150  1.0 3.0
   38    41    43    49   0.60050  1.0 1.0
   38    41    43    49   0.05600 -1.0 2.0
   38    41    43    49   0.26150  1.0 3.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    43   0.00000  1.0 1.0
   40    38    41    42   0.00000  1.0 1.0
   40    38    41    43   0.00000  1.0 1.0
   41    43    44    45  -0.11250  1.0 3.0
   41    43    44    46  -0.11250  1.0 3.0
   41    43    44    53  -0.95700  1.0 1.0
   41    43    44    53  -0.18200 -1.0 2.0
   41    43    44    53   0.29450  1.0 3.0
   41    43   -47    33  -0.95700  1.0 1.0
   41    43   -47    33  -0.18200 -1.0 2.0
   41    43   -47    33   0.29450  1.0 3.0
   41    43    47    67  -0.95700  1.0 1.0
   41    43    47    67  -0.18200 -1.0 2.0
   41    43    47    67   0.29450  1.0 3.0
   41    43    47    48  -0.11250  1.0 3.0
   41    43    49    50  -0.11250  1.0 3.0
   41    43    49    51  -0.11250  1.0 3.0
   41    43    49    52  -0.11250  1.0 3.0
   42    41    43    44   0.30150 -1.0 2.0
   42    41    43    47   0.30150 -1.0 2.0
   42    41    43    49   0.30150 -1.0 2.0
   43    44    53    54   0.15000  1.0 3.0
   43    44    53    55   0.34400  1.0 1.0
   43    44    53    55   0.09450 -1.0 2.0
   43    44    53    55   0.11100  1.0 3.0
   43    44    53    62   0.56750  1.0 1.0
   43    44    53    62  -0.07550 -1.0 2.0
   43    44    53    62   0.20000  1.0 3.0
   44    43    47    33   0.56750  1.0 1.0
   44    43    47    33  -0.07550 -1.0 2.0
   44    43    47    33   0.20000  1.0 3.0
   44    43    47    67   0.56750  1.0 1.0
   44    43    47    67  -0.07550 -1.0 2.0
   44    43    47    67   0.20000  1.0 3.0
   44    43    47    48   0.15000  1.0 3.0
   44    43    49    50   0.15000  1.0 3.0
   44    43    49    51   0.15000  1.0 3.0
   44    43    49    52   0.15000  1.0 3.0
   44    53    55    56   0.09700  1.0 1.0
   44    53    55    56   0.15600 -1.0 2.0
   44    53    55    56  -0.50800  1.0 3.0
   44    53    55    58   0.09850  1.0 1.0
   44    53    55    58   0.15250 -1.0 2.0
   44    53    55    58  -0.50650  1.0 3.0
   44    53    62    61   0.62750  1.0 1.0
   44    53    62    61  -0.30950 -1.0 2.0
   44    53    62    61   0.27300  1.0 3.0
   44    53    62    63   0.15000  1.0 3.0
   44    53    62    64   0.56750  1.0 1.0
   44    53    62    64  -0.07550 -1.0 2.0
   44    53    62    64   0.20000  1.0 3.0
   45    44    53    54   0.15000  1.0 3.0
   45    44    53    55   0.15000  1.0 3.0
   45    44    53    62   0.15000  1.0 3.0
   46    44    53    54   0.15000  1.0 3.0
   46    44    53    55   0.15000  1.0 3.0
   46    44    53    62   0.15000  1.0 3.0
   53    55    56    57  -0.64400  1.0 1.0
   53    55    56    57   0.26850 -1.0 2.0
   53    55   -56    61  -0.15000  1.0 1.0
   53    55   -56    61   0.89550 -1.0 2.0
   53    55   -56    61  -0.06900  1.0 3.0
   53    55    58    59   7.00000 -1.0 2.0
   53    55    58    60   7.00000 -1.0 2.0
   53    62    64    65   0.15000  1.0 3.0
   53    62    64    66   0.15000  1.0 3.0
   53    62    64    67   0.56750  1.0 1.0
   53    62    64    67  -0.07550 -1.0 2.0
   53    62    64    67   0.20000  1.0 3.0
   54    53    55    56   0.15000  1.0 3.0
   54    53    55    58   0.00000  1.0 1.0
   54    53    62    61   0.23400  1.0 3.0
   54    53    62    63   0.15000  1.0 3.0
   54    53    62    64   0.15000  1.0 3.0
   55    53   -62    61   0.61850  1.0 1.0
   55    53   -62    61  -0.22750 -1.0 2.0
   55    53   -62    61   0.15300  1.0 3.0
   55    53    62    63   0.15000  1.0 3.0
   55    53    62    64   0.34400  1.0 1.0
   55    53    62    64   0.09450 -1.0 2.0
   55    53    62    64   0.11100  1.0 3.0
   55    56   -61    62   2.00000 -1.0 2.0
   56    55    58    59   7.00000 -1.0 2.0
   56    55    58    60   7.00000 -1.0 2.0
   56    61   -62    53  -0.25900  1.0 1.0
   56    61   -62    53  -0.47000 -1.0 2.0
   56    61   -62    53   0.11750  1.0 3.0
   56    61    62    63   0.08050  1.0 3.0
   56    61    62    64  -0.25900  1.0 1.0
   56    61    62    64  -0.47000 -1.0 2.0
   56    61    62    64   0.11750  1.0 3.0
   57    56    61    62   3.00000 -1.0 2.0
   61    62    64    65   0.23400  1.0 3.0
   61    62    64    66   0.23400  1.0 3.0
   61    62    64    67   0.62750  1.0 1.0
   61    62    64    67  -0.30950 -1.0 2.0
   61    62    64    67   0.27300  1.0 3.0
   62    53   -55    56   0.09700  1.0 1.0
   62    53   -55    56   0.15600 -1.0 2.0
   62    53   -55    56  -0.50800  1.0 3.0
   62    53    55    58   0.09850  1.0 1.0
   62    53    55    58   0.15250 -1.0 2.0
   62    53    55    58  -0.50650  1.0 3.0
   62    64    67    68   0.15000  1.0 3.0
   62    64    67    47   0.56750  1.0 1.0
   62    64    67    47  -0.07550 -1.0 2.0
   62    64    67    47   0.20000  1.0 3.0
   62    64    67    69   0.56750  1.0 1.0
   62    64    67    69  -0.07550 -1.0 2.0
   62    64    67    69   0.20000  1.0 3.0
   63    62    64    65   0.15000  1.0 3.0
   63    62    64    66   0.15000  1.0 3.0
   63    62    64    67   0.15000  1.0 3.0
   64    67    47    33   0.56750  1.0 1.0
   64    67    47    33  -0.07550 -1.0 2.0
   64    67    47    33   0.20000  1.0 3.0
   64    67    47    43   0.56750  1.0 1.0
   64    67    47    43  -0.07550 -1.0 2.0
   64    67    47    43   0.20000  1.0 3.0
   64    67    47    48   0.15000  1.0 3.0
   64    67    69    70   0.15000  1.0 3.0
   64    67    69    71   0.15000  1.0 3.0
   64    67    69    72   0.15000  1.0 3.0
   65    64    67    68   0.15000  1.0 3.0
   65    64    67    47   0.15000  1.0 3.0
   65    64    67    69   0.15000  1.0 3.0
   66    64    67    68   0.15000  1.0 3.0
   66    64    67    47   0.15000  1.0 3.0
   66    64    67    69   0.15000  1.0 3.0
   68    67    47    33   0.15000  1.0 3.0
   68    67    47    43   0.15000  1.0 3.0
   68    67    47    48   0.15000  1.0 3.0
   68    67    69    70   0.15000  1.0 3.0
   68    67    69    71   0.15000  1.0 3.0
   68    67    69    72   0.15000  1.0 3.0
   47    33    38    39   0.15000  1.0 3.0
   47    33    38    40   0.15000  1.0 3.0
   47    33   -38    41  -0.95700  1.0 1.0
   47    33   -38    41  -0.18200 -1.0 2.0
   47    33   -38    41   0.29450  1.0 3.0
   47    43    44    45   0.15000  1.0 3.0
   47    43    44    46   0.15000  1.0 3.0
   47    43    44    53   0.56750  1.0 1.0
   47    43    44    53  -0.07550 -1.0 2.0
   47    43    44    53   0.20000  1.0 3.0
   47    43    49    50   0.15000  1.0 3.0
   47    43    49    51   0.15000  1.0 3.0
   47    43    49    52   0.15000  1.0 3.0
   47    67    69    70   0.15000  1.0 3.0
   47    67    69    71   0.15000  1.0 3.0
   47    67    69    72   0.15000  1.0 3.0
   69    67    47    33   0.56750  1.0 1.0
   69    67    47    33  -0.07550 -1.0 2.0
   69    67    47    33   0.20000  1.0 3.0
   69    67    47    43   0.56750  1.0 1.0
   69    67    47    43  -0.07550 -1.0 2.0
   69    67    47    43   0.20000  1.0 3.0
   69    67    47    48   0.15000  1.0 3.0
   58    55    56    57   1.00000 -1.0 2.0
   58    55    56    61  -0.56150  1.0 1.0
   58    55    56    61   2.19150 -1.0 2.0
   49    43    44    45   0.15000  1.0 3.0
   49    43    44    46   0.15000  1.0 3.0
   49    43    44    53   0.56750  1.0 1.0
   49    43    44    53  -0.07550 -1.0 2.0
   49    43    44    53   0.20000  1.0 3.0
   49    43    47    33   0.56750  1.0 1.0
   49    43    47    33  -0.07550 -1.0 2.0
   49    43    47    33   0.20000  1.0 3.0
   49    43    47    67   0.56750  1.0 1.0
   49    43    47    67  -0.07550 -1.0 2.0
   49    43    47    67   0.20000  1.0 3.0
   49    43    47    48   0.15000  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
   38    43    41    42  10.50000 -1.0 2.0
   53    56    55    58   1.10000 -1.0 2.0
   55    61    56    57  10.50000 -1.0 2.0
   59    60    58    55   1.10000 -1.0 2.0
END
