* LIGAND DATABASE FILE (OPLS2005)
*
001      74    76    146    232     435
    1     0 S   NP   _N1_     1    28.74879    95.33696   -23.09945
    2     1 S   H    _HN1     2     1.02830    32.22273   162.40366
    3     1 S   H    _H1_     3     1.02785   101.78564   -92.68977
    4     1 S   H    _H2_     4     1.02951    79.62078    14.09397
    5     1 S   CT   _CA1     5     1.50109   138.11750   123.17171
    6     5 S   HC   _HA1     6     1.09574   105.20894    80.39144
    7     5 S   CO3  _C1_     7     1.53799   112.40945   -39.85541
    8     7 S   O2Z  _O11     8     1.26372   115.01276   -43.74729
    9     7 S   O2Z  _O12     9     1.26239   114.94176   135.36935
   10     5 S   CT   _CB1    10     1.53080   107.41779  -161.64426
   11    10 S   HC   HB11    11     1.09831   109.39711   -49.84219
   12    10 S   HC   HB12    12     1.09814   110.44265    66.76994
   13    10 S   CT   _CG1    13     1.52981   112.58789  -170.82819
   14    13 S   HC   HG11    14     1.09591   110.58764   -64.73494
   15    13 S   HC   HG12    15     1.09668   109.83636    54.49237
   16    13 S   C    _CD1    16     1.51799   112.26094   174.94216
   17    16 S   O    _OE1    17     1.22731   123.29781     4.68977
   18    16 S   N    _N2_    18     1.38617   111.61058  -175.39410
   19    18 S   H    _HN2    19     1.01590   119.02161     1.76025
   20    18 S   CT1  _CA2    20     1.46267   123.49677   178.67869
   21    20 S   HC   _HA2    21     1.09740   109.31189     2.26443
   22    20 S   C    _C2_    22     1.53577   109.01552  -113.24560
   23    22 S   O    _O2_    23     1.23064   122.24321  -151.61496
   24    20 S   CT   _CB2    32     1.53532   111.26177   124.15421
   25    24 S   HC   HB21    33     1.09400   109.00973    55.55177
   26    24 S   HC   HB22    34     1.09365   109.93878   174.55105
   27    22 S   N    _N3_    24     1.38326   113.81781    36.03216
   28    27 S   H    _HN3    25     1.01577   119.53481    -3.65811
   29    24 S   S    _SG2    35     1.83301   110.63197   -65.38337
   30    27 S   CT   _CA3    26     1.45271   123.19746   177.04143
   31    30 S   HC   HA31    27     1.09550   107.54243   -63.96020
   32    30 S   HC   HA32    28     1.09558   107.94967    52.46957
   33    29 S   CT   _C16    36     1.88826   103.04367   176.05018
   34    30 S   CO3  _C3_    29     1.52946   114.09509   174.46565
   35    34 S   O2Z  _O31    30     1.26374   116.08029     0.15702
   36    34 S   O2Z  _O32    31     1.26430   114.40824  -179.80021
   37    33 S   CM   _C13    37     1.49724   108.70004   -54.44654
   38    37 S   CMA  _C14    38     1.34823   112.31232   109.47497
   39    38 S   OM   _O34    39     1.26258   127.83358   179.35472
   40    37 S   CT   _C12    44     1.50098   118.78985   -71.09772
   41    40 S   HC   _H15    45     1.09701   108.76187    74.02823
   42    40 S   HC   _H16    46     1.09587   111.64872  -169.20705
   43    38 S   OS   _O33    40     1.42027   109.79680    -2.93145
   44    40 S   CT   _C11    47     1.53147   112.49087   -46.61687
   45    44 S   HC   _H13    48     1.09644   107.96435   167.84085
   46    44 S   HC   _H14    49     1.09586   108.65448   -77.41484
   47    33 S   CT   _C15    41     1.52909   109.77734    54.62101
   48    47 S   HC   _H17    42     1.09568   113.84802    18.14633
   49    47 S   HC   _H18    43     1.09097   114.46660   139.33714
   50    44 S   CT   _C10    50     1.55102   113.31176    45.84231
   51    50 S   HC   _H3_    51     1.09850   104.90015    59.66476
   52    33 S   CT   _C5_    52     1.59839   111.90191  -176.14583
   53    52 S   CT   _C6_    53     1.56332   110.92914   -56.46135
   54    53 S   HC   _H7_    54     1.09450   112.33408     8.84451
   55    53 S   HC   _H8_    55     1.09856   109.70764  -106.03569
   56    52 S   CT   _C4_    71     1.56305   110.74040  -174.45398
   57    56 S   HC   _H4_    72     1.09317   112.94762   -55.02757
   58    56 S   HC   _H5_    73     1.09123   111.76334  -176.50027
   59    56 S   HC   _H6_    74     1.09378   112.38533    66.12198
   60    53 S   CT   _C7_    56     1.52645   114.56143   132.59089
   61    60 S   HC   _H9_    57     1.09639   109.00619   164.15896
   62    60 S   HC   _H10    58     1.09616   110.01510   -79.50608
   63    60 S   CT   _C8_    59     1.52092   111.21402    43.16237
   64    63 S   HC   _H11    60     1.09718   108.60339    55.99589
   65    63 S   HC   _H12    61     1.09741   109.22972   170.53220
   66    50 S   CT   _C9_    62     1.57797   113.42139   172.93892
   67    66 S   CT   _C17    63     1.55368   107.98781   -83.72621
   68    67 S   HC   _H19    64     1.09529   111.45558    59.41691
   69    67 S   HC   _H20    65     1.09558   111.55578   -60.99219
   70    67 S   HC   _H21    66     1.09634   111.23407   179.18651
   71    66 S   CT   _C18    67     1.54370   114.48498    34.05537
   72    71 S   HC   _H22    68     1.09540   111.81724   -64.63712
   73    71 S   HC   _H23    69     1.09680   110.70687   176.44978
   74    71 S   HC   _H24    70     1.09194   112.53381    56.65208
  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
  23   2   1   1  16  10   3  11   5   4   4  11   5   4   6   2
   1  22   7  14  13   6   5   5   2   1   1   8   5   4  11   4
   3   8   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    47    52    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    47    48    49    40    50    52    53    56  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    47    48    49    40    41    42    44    50    51    52    53    54    55    60    66    56    57    58    59  
   35    36  
   36  
    0  
   38    39    43    47    48    49    40    41    42    44    45    46    50    52    53    56  
   39    43    47    48    49    40    41    42    44    52  
   43    47    40  
   41    42    44    45    46    50    51    52    66    43    47  
   42    44    45    46    50  
   44    45    46    50  
   47    48    49    52  
   45    46    50    51    52    53    63    66    67    71    56  
   46    50    51    52    66  
   50    51    52    66  
   48    49    50    52    53    56  
   49    52  
   52  
   51    52    53    54    55    60    63    64    65    66    67    68    69    70    71    72    73    74    56    57    58    59  
   52    53    63    66    67    71    56  
   53    54    55    60    61    62    63    66    67    71    56    57    58    59  
   54    55    60    61    62    63    64    65    66    56    57    58    59  
   55    60    61    62    63    56  
   60    61    62    63    56  
   57    58    59    60    66  
   58    59  
   59  
    0  
   61    62    63    64    65    66    67    71  
   62    63    64    65    66  
   63    64    65    66  
   64    65    66    67    68    69    70    71    72    73    74  
   65    66    67    71  
   66    67    71  
   67    68    69    70    71    72    73    74  
   68    69    70    71    72    73    74  
   69    70    71  
   70    71  
   71  
   72    73    74  
   73    74  
   74  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   39   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   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   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    47   268.000  1.529
   33    52   268.000  1.529
   37    38   465.000  1.376
   37    40   317.000  1.510
   38    39   745.000  1.250
   38    43   440.000  1.360
   43    47   320.000  1.410
   47    48   340.000  1.090
   47    49   340.000  1.090
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    50   268.000  1.529
   50    51   340.000  1.090
   50    52   268.000  1.529
   50    66   268.000  1.529
   52    53   268.000  1.529
   52    56   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   268.000  1.529
   66    67   268.000  1.529
   66    71   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   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    75.00000  112.20000
   29    33    47    75.00000  111.63000
   29    33    52    75.00000  111.63000
   33    37    38    70.00000  124.00000
   33    37    40    65.00000  117.92700
   33    47    43    50.00000  109.50000
   33    47    48    37.50000  110.70000
   33    47    49    37.50000  110.70000
   33    52    50    58.35000  112.70000
   33    52    53    58.35000  112.70000
   33    52    56    58.35000  112.70000
   37    38    39    65.00000  137.10300
   37    38    43    80.00000  120.01400
   37    40    41    35.00000  109.50000
   37    40    42    35.00000  109.50000
   37    40    44    70.00000  112.02700
   38    43    47    90.00000  111.18400
   43    38    39    65.00000  121.00000
   43    47    48    35.00000  109.50000
   43    47    49    35.00000  109.50000
   47    33    37    70.00000  112.02700
   49    47    48    33.00000  107.80000
   40    37    38    70.00000  124.00000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    50    58.35000  112.70000
   42    40    41    33.00000  107.80000
   44    40    41    37.50000  110.70000
   44    40    42    37.50000  110.70000
   44    50    51    37.50000  110.70000
   44    50    52    58.35000  112.70000
   44    50    66    58.35000  112.70000
   46    44    45    33.00000  107.80000
   50    44    45    37.50000  110.70000
   50    44    46    37.50000  110.70000
   50    52    53    58.35000  112.70000
   50    52    56    58.35000  112.70000
   50    66    63    58.35000  112.70000
   50    66    67    58.35000  112.70000
   50    66    71    58.35000  112.70000
   52    33    37    70.00000  112.02700
   52    33    47    58.35000  112.70000
   52    50    51    37.50000  110.70000
   52    53    54    37.50000  110.70000
   52    53    55    37.50000  110.70000
   52    53    60    58.35000  112.70000
   52    56    57    37.50000  110.70000
   52    56    58    37.50000  110.70000
   52    56    59    37.50000  110.70000
   53    60    61    37.50000  110.70000
   53    60    62    37.50000  110.70000
   53    60    63    58.35000  112.70000
   55    53    54    33.00000  107.80000
   60    53    54    37.50000  110.70000
   60    53    55    37.50000  110.70000
   60    63    64    37.50000  110.70000
   60    63    65    37.50000  110.70000
   60    63    66    58.35000  112.70000
   62    60    61    33.00000  107.80000
   63    60    61    37.50000  110.70000
   63    60    62    37.50000  110.70000
   63    66    67    58.35000  112.70000
   63    66    71    58.35000  112.70000
   65    63    64    33.00000  107.80000
   66    50    51    37.50000  110.70000
   66    50    52    58.35000  112.70000
   66    63    64    37.50000  110.70000
   66    63    65    37.50000  110.70000
   66    67    68    37.50000  110.70000
   66    67    69    37.50000  110.70000
   66    67    70    37.50000  110.70000
   66    71    72    37.50000  110.70000
   66    71    73    37.50000  110.70000
   66    71    74    37.50000  110.70000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   71    66    67    58.35000  112.70000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   56    52    53    58.35000  112.70000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    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
   24    29    33    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   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   0.42700  1.0 1.0
   29    33    37    38  -0.70350 -1.0 2.0
   29    33    37    38  -0.43150  1.0 3.0
   29    33    37    40   0.30250  1.0 1.0
   29    33    37    40  -0.14950 -1.0 2.0
   29    33    37    40   0.36900  1.0 3.0
   29    33    47    43   0.56750  1.0 1.0
   29    33    47    43  -0.07550 -1.0 2.0
   29    33    47    43   0.20000  1.0 3.0
   29    33    47    48   0.15000  1.0 3.0
   29    33    47    49   0.15000  1.0 3.0
   29    33    52    50   0.44750  1.0 1.0
   29    33    52    50  -0.17800 -1.0 2.0
   29    33    52    50   0.20200  1.0 3.0
   29    33    52    53   0.44750  1.0 1.0
   29    33    52    53  -0.17800 -1.0 2.0
   29    33    52    53   0.20200  1.0 3.0
   29    33    52    56   0.44750  1.0 1.0
   29    33    52    56  -0.17800 -1.0 2.0
   29    33    52    56   0.20200  1.0 3.0
   33    37    38    39   7.00000 -1.0 2.0
   33    37   -38    43   7.00000 -1.0 2.0
   33    37    40    41   0.34800  1.0 3.0
   33    37    40    42   0.34800  1.0 3.0
   33    37    40    44   0.46850  1.0 1.0
   33    37    40    44   0.08550 -1.0 2.0
   33    37    40    44   0.09800  1.0 3.0
   33    52    53    54   0.15000  1.0 3.0
   33    52    53    55   0.15000  1.0 3.0
   33    52    53    60   0.56750  1.0 1.0
   33    52    53    60  -0.07550 -1.0 2.0
   33    52    53    60   0.20000  1.0 3.0
   33    52    56    57   0.15000  1.0 3.0
   33    52    56    58   0.15000  1.0 3.0
   33    52    56    59   0.15000  1.0 3.0
   37    33   -47    43   0.61850  1.0 1.0
   37    33   -47    43  -0.22750 -1.0 2.0
   37    33   -47    43   0.15300  1.0 3.0
   37    33    47    48   0.15000  1.0 3.0
   37    33    47    49   0.15000  1.0 3.0
   37    33    52    50   0.34400  1.0 1.0
   37    33    52    50   0.09450 -1.0 2.0
   37    33    52    50   0.11100  1.0 3.0
   37    33    52    53   0.34400  1.0 1.0
   37    33    52    53   0.09450 -1.0 2.0
   37    33    52    53   0.11100  1.0 3.0
   37    33    52    56   0.34400  1.0 1.0
   37    33    52    56   0.09450 -1.0 2.0
   37    33    52    56   0.11100  1.0 3.0
   37    38   -43    47  -2.26850  1.0 1.0
   37    38   -43    47   3.39050 -1.0 2.0
   37    40    44    45   0.15000  1.0 3.0
   37    40    44    46   0.15000  1.0 3.0
   37    40   -44    50   0.34400  1.0 1.0
   37    40   -44    50   0.09450 -1.0 2.0
   37    40   -44    50   0.11100  1.0 3.0
   38    37    40    41   0.00000  1.0 1.0
   38    37    40    42   0.00000  1.0 1.0
   38    37    40    44   0.09850  1.0 1.0
   38    37    40    44   0.15250 -1.0 2.0
   38    37    40    44  -0.50650  1.0 3.0
   38    43   -47    33  -0.46850  1.0 1.0
   38    43   -47    33   0.09300 -1.0 2.0
   38    43   -47    33  -0.12850  1.0 3.0
   38    43    47    48   0.08050  1.0 3.0
   38    43    47    49   0.08050  1.0 3.0
   39    38    43    47   2.00000 -1.0 2.0
   47    33   -37    38   0.09850  1.0 1.0
   47    33   -37    38   0.15250 -1.0 2.0
   47    33   -37    38  -0.50650  1.0 3.0
   47    33    37    40   0.46850  1.0 1.0
   47    33    37    40   0.08550 -1.0 2.0
   47    33    37    40   0.09800  1.0 3.0
   47    33    52    50   0.56750  1.0 1.0
   47    33    52    50  -0.07550 -1.0 2.0
   47    33    52    50   0.20000  1.0 3.0
   47    33    52    53   0.56750  1.0 1.0
   47    33    52    53  -0.07550 -1.0 2.0
   47    33    52    53   0.20000  1.0 3.0
   47    33    52    56   0.56750  1.0 1.0
   47    33    52    56  -0.07550 -1.0 2.0
   47    33    52    56   0.20000  1.0 3.0
   40    37    38    39   7.00000 -1.0 2.0
   40    37    38    43   7.00000 -1.0 2.0
   40    44    50    51   0.15000  1.0 3.0
   40    44    50    52   0.56750  1.0 1.0
   40    44    50    52  -0.07550 -1.0 2.0
   40    44    50    52   0.20000  1.0 3.0
   40    44    50    66   0.56750  1.0 1.0
   40    44    50    66  -0.07550 -1.0 2.0
   40    44    50    66   0.20000  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    50   0.15000  1.0 3.0
   42    40    44    45   0.15000  1.0 3.0
   42    40    44    46   0.15000  1.0 3.0
   42    40    44    50   0.15000  1.0 3.0
   44    50   -52    33   0.56750  1.0 1.0
   44    50   -52    33  -0.07550 -1.0 2.0
   44    50   -52    33   0.20000  1.0 3.0
   44    50    52    53   0.56750  1.0 1.0
   44    50    52    53  -0.07550 -1.0 2.0
   44    50    52    53   0.20000  1.0 3.0
   44    50    52    56   0.56750  1.0 1.0
   44    50    52    56  -0.07550 -1.0 2.0
   44    50    52    56   0.20000  1.0 3.0
   44    50    66    63   0.56750  1.0 1.0
   44    50    66    63  -0.07550 -1.0 2.0
   44    50    66    63   0.20000  1.0 3.0
   44    50    66    67   0.56750  1.0 1.0
   44    50    66    67  -0.07550 -1.0 2.0
   44    50    66    67   0.20000  1.0 3.0
   44    50    66    71   0.56750  1.0 1.0
   44    50    66    71  -0.07550 -1.0 2.0
   44    50    66    71   0.20000  1.0 3.0
   45    44    50    51   0.15000  1.0 3.0
   45    44    50    52   0.15000  1.0 3.0
   45    44    50    66   0.15000  1.0 3.0
   46    44    50    51   0.15000  1.0 3.0
   46    44    50    52   0.15000  1.0 3.0
   46    44    50    66   0.15000  1.0 3.0
   50    52    53    54   0.15000  1.0 3.0
   50    52    53    55   0.15000  1.0 3.0
   50    52    53    60   0.56750  1.0 1.0
   50    52    53    60  -0.07550 -1.0 2.0
   50    52    53    60   0.20000  1.0 3.0
   50    52    56    57   0.15000  1.0 3.0
   50    52    56    58   0.15000  1.0 3.0
   50    52    56    59   0.15000  1.0 3.0
   50    66    67    68   0.15000  1.0 3.0
   50    66    67    69   0.15000  1.0 3.0
   50    66    67    70   0.15000  1.0 3.0
   50    66    71    72   0.15000  1.0 3.0
   50    66    71    73   0.15000  1.0 3.0
   50    66    71    74   0.15000  1.0 3.0
   51    50    52    33   0.15000  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    56   0.15000  1.0 3.0
   51    50    66    63   0.15000  1.0 3.0
   51    50    66    67   0.15000  1.0 3.0
   51    50    66    71   0.15000  1.0 3.0
   52    33    37    38   0.09850  1.0 1.0
   52    33    37    38   0.15250 -1.0 2.0
   52    33    37    38  -0.50650  1.0 3.0
   52    33   -37    40   0.46850  1.0 1.0
   52    33   -37    40   0.08550 -1.0 2.0
   52    33   -37    40   0.09800  1.0 3.0
   52    33    47    43   0.62750  1.0 1.0
   52    33    47    43  -0.30950 -1.0 2.0
   52    33    47    43   0.27300  1.0 3.0
   52    33    47    48   0.15000  1.0 3.0
   52    33    47    49   0.15000  1.0 3.0
   52    50    66    63   0.56750  1.0 1.0
   52    50    66    63  -0.07550 -1.0 2.0
   52    50    66    63   0.20000  1.0 3.0
   52    50    66    67   0.56750  1.0 1.0
   52    50    66    67  -0.07550 -1.0 2.0
   52    50    66    67   0.20000  1.0 3.0
   52    50    66    71   0.56750  1.0 1.0
   52    50    66    71  -0.07550 -1.0 2.0
   52    50    66    71   0.20000  1.0 3.0
   52    53    60    61   0.15000  1.0 3.0
   52    53    60    62   0.15000  1.0 3.0
   52    53   -60    63   0.56750  1.0 1.0
   52    53   -60    63  -0.07550 -1.0 2.0
   52    53   -60    63   0.20000  1.0 3.0
   53    52    56    57   0.15000  1.0 3.0
   53    52    56    58   0.15000  1.0 3.0
   53    52    56    59   0.15000  1.0 3.0
   53    60    63    64   0.15000  1.0 3.0
   53    60    63    65   0.15000  1.0 3.0
   53    60    63    66   0.56750  1.0 1.0
   53    60    63    66  -0.07550 -1.0 2.0
   53    60    63    66   0.20000  1.0 3.0
   54    53    60    61   0.15000  1.0 3.0
   54    53    60    62   0.15000  1.0 3.0
   54    53    60    63   0.15000  1.0 3.0
   55    53    60    61   0.15000  1.0 3.0
   55    53    60    62   0.15000  1.0 3.0
   55    53    60    63   0.15000  1.0 3.0
   60    63   -66    50   0.56750  1.0 1.0
   60    63   -66    50  -0.07550 -1.0 2.0
   60    63   -66    50   0.20000  1.0 3.0
   60    63    66    67   0.56750  1.0 1.0
   60    63    66    67  -0.07550 -1.0 2.0
   60    63    66    67   0.20000  1.0 3.0
   60    63    66    71   0.56750  1.0 1.0
   60    63    66    71  -0.07550 -1.0 2.0
   60    63    66    71   0.20000  1.0 3.0
   61    60    63    64   0.15000  1.0 3.0
   61    60    63    65   0.15000  1.0 3.0
   61    60    63    66   0.15000  1.0 3.0
   62    60    63    64   0.15000  1.0 3.0
   62    60    63    65   0.15000  1.0 3.0
   62    60    63    66   0.15000  1.0 3.0
   63    66    67    68   0.15000  1.0 3.0
   63    66    67    69   0.15000  1.0 3.0
   63    66    67    70   0.15000  1.0 3.0
   63    66    71    72   0.15000  1.0 3.0
   63    66    71    73   0.15000  1.0 3.0
   63    66    71    74   0.15000  1.0 3.0
   64    63    66    50   0.15000  1.0 3.0
   64    63    66    67   0.15000  1.0 3.0
   64    63    66    71   0.15000  1.0 3.0
   65    63    66    50   0.15000  1.0 3.0
   65    63    66    67   0.15000  1.0 3.0
   65    63    66    71   0.15000  1.0 3.0
   66    50    52    33   0.56750  1.0 1.0
   66    50    52    33  -0.07550 -1.0 2.0
   66    50    52    33   0.20000  1.0 3.0
   66    50   -52    53   0.56750  1.0 1.0
   66    50   -52    53  -0.07550 -1.0 2.0
   66    50   -52    53   0.20000  1.0 3.0
   66    50    52    56   0.56750  1.0 1.0
   66    50    52    56  -0.07550 -1.0 2.0
   66    50    52    56   0.20000  1.0 3.0
   67    66    71    72   0.15000  1.0 3.0
   67    66    71    73   0.15000  1.0 3.0
   67    66    71    74   0.15000  1.0 3.0
   71    66    67    68   0.15000  1.0 3.0
   71    66    67    69   0.15000  1.0 3.0
   71    66    67    70   0.15000  1.0 3.0
   56    52    53    54   0.15000  1.0 3.0
   56    52    53    55   0.15000  1.0 3.0
   56    52    53    60   0.56750  1.0 1.0
   56    52    53    60  -0.07550 -1.0 2.0
   56    52    53    60   0.20000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    40    37    38   1.10000 -1.0 2.0
   39    43    38    37   1.10000 -1.0 2.0
END
