* LIGAND DATABASE FILE (OPLS2005)
*
001      61    61    107    163     315
    1     0 S   NP   _N1_     1    28.94405    94.67922   -20.64575
    2     1 S   H    _HN1     2     1.02936    95.84580    27.01501
    3     1 S   H    _H1_     3     1.02870    36.37355   138.33203
    4     1 S   H    _H2_     4     1.02819    79.13411   -80.36231
    5     1 S   CT   _CA1     5     1.50019   144.64150   166.74422
    6     5 S   HC   _HA1     6     1.09581   105.35389    42.43757
    7     5 S   CO3  _C1_     7     1.53972   111.95967   -77.80983
    8     7 S   O2Z  _O11     8     1.26433   115.40351   -60.72179
    9     7 S   O2Z  _O12     9     1.26179   114.89341   119.03748
   10     5 S   CT   _CB1    10     1.53148   107.49593   160.15171
   11    10 S   HC   HB11    11     1.09820   109.84894   -49.90705
   12    10 S   HC   HB12    12     1.09825   110.19587    66.58894
   13    10 S   CT   _CG1    13     1.53125   112.49052  -170.89977
   14    13 S   HC   HG11    14     1.09525   110.51959   -49.76364
   15    13 S   HC   HG12    15     1.09595   110.23988    69.25358
   16    13 S   C    _CD1    16     1.51764   111.65526  -170.43902
   17    16 S   O    _OE1    17     1.22752   122.93014   -18.97733
   18    16 S   N    _N2_    18     1.38554   111.96075   161.16303
   19    18 S   H    _HN2    19     1.01600   119.29221     4.20687
   20    18 S   CT1  _CA2    20     1.46335   123.28114  -175.88544
   21    20 S   HC   _HA2    21     1.09729   109.34834   -10.87475
   22    20 S   C    _C2_    22     1.53331   108.63395  -126.62341
   23    22 S   O    _O2_    23     1.23018   122.42449  -148.51923
   24    20 S   CT   _CB2    32     1.53454   111.08987   110.91735
   25    24 S   HC   HB21    33     1.09485   109.63726    57.10039
   26    24 S   HC   HB22    34     1.09509   110.70781   175.62055
   27    22 S   N    _N3_    24     1.38386   113.44330    39.10878
   28    27 S   H    _HN3    25     1.01643   119.49885    -3.73450
   29    24 S   S    _SG2    35     1.82938   111.34386   -64.92755
   30    27 S   CT   _CA3    26     1.45297   123.07555   176.90168
   31    30 S   HC   HA31    27     1.09556   107.55681   -62.85122
   32    30 S   HC   HA32    28     1.09561   107.90360    53.54075
   33    29 S   CT   _C13    36     1.84228    99.78058   156.86765
   34    33 S   HC   _H5_    37     1.09608   107.42809    40.84060
   35    30 S   CO3  _C3_    29     1.52924   114.15907   175.49380
   36    35 S   O2Z  _O31    30     1.26363   116.04610    -0.96103
   37    35 S   O2Z  _O32    31     1.26428   114.42078   179.08293
   38    33 S   CM   _C11    38     1.50534   107.93856   157.86257
   39    38 S   CM   _C10    39     1.44067   120.65646    94.51852
   40    39 S   HC   _H9_    40     1.08579   118.16793  -174.43947
   41    38 S   CMA  _C12    59     1.51175   121.50344   -89.15254
   42    41 S   OM   _O36    60     1.26328   120.83606   111.49513
   43    41 S   OM   _O37    61     1.26299   120.42638   -68.15168
   44    39 S   CM   _C9_    41     1.33856   121.98224     5.38227
   45    44 S   HC   _H8_    42     1.08653   118.93153  -179.31016
   46    44 S   CT   _C8_    43     1.50092   123.42421     2.42995
   47    46 S   HC   _H4_    44     1.09626   107.93630   135.72924
   48    33 S   CT   _C7_    45     1.54879   111.28423   -79.03367
   49    48 S   HC   _H3_    46     1.09766   109.55322    44.28999
   50    46 S   NP   _N4_    55     1.49143   111.25019  -109.29385
   51    50 S   H    _H10    56     1.02915   111.30273    65.51240
   52    50 S   H    _H11    57     1.03188   112.52006   -54.96901
   53    50 S   H    _H12    58     1.02822   111.06866  -174.14522
   54    48 S   OS   _O35    47     1.44696   108.29111   163.36801
   55    54 S   CM   _C5_    48     1.38381   113.28222  -103.26719
   56    55 S   CM   _C4_    49     1.33716   120.11981   120.67981
   57    56 S   HC   _H6_    50     1.08547   120.45070    -2.52360
   58    56 S   HC   _H7_    51     1.08435   122.11229   177.52662
   59    55 S   CO3  _C6_    52     1.54926   118.64694   -63.88698
   60    59 S   O2Z  _O34    53     1.26447   116.01670   159.51560
   61    59 S   O2Z  _O33    54     1.26619   115.08298   -19.63501
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  15   7   2   1   1  11  10   4   4   1   1  10   4   9   7   9
   3   4   2   1   1   7   6   5   2   1   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    48    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    46    48    49    54    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    44    46    47    48    49    54    55    50    41    42    43  
   38    39    46    48    49    54    41  
   36    37  
   37  
    0  
   39    40    44    45    46    48    49    54    41    42    43  
   40    44    45    46    47    48    50    41    42    43  
   44    45    46    41  
   42    43    44    48  
   43  
    0  
   45    46    47    48    49    54    50    51    52    53  
   46    47    48    50  
   47    48    49    54    55    50    51    52    53  
   48    49    54    50    51    52    53  
   49    54    55    56    59    50    51    52    53  
   54    55    50  
   51    52    53    54  
   52    53  
   53  
    0  
   55    56    57    58    59    60    61  
   56    57    58    59    60    61  
   57    58    59    60    61  
   58    59  
   59  
   60    61  
   61  
    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   1.6450   1.4500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   43   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.025600   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   48   3.5000   0.0660   0.394400   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.030000   1.6450   1.4500   0.008598240   0.268726247
   50   3.2500   0.1700  -0.300000   2.2900   2.0360   0.003973653   1.685851020
   51   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   52   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   53   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   54   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   55   3.5500   0.0760  -0.225300   2.0020   1.7750   0.023028004  -0.852763146
   56   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    48   268.000  1.529
   38    39   380.000  1.444
   38    41   465.000  1.376
   39    40   340.000  1.080
   39    44   549.000  1.340
   44    45   340.000  1.080
   44    46   317.000  1.510
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    50   367.000  1.471
   48    49   340.000  1.090
   48    54   320.000  1.410
   54    55   440.000  1.360
   55    56   549.000  1.340
   55    59   230.000  1.545
   56    57   340.000  1.080
   56    58   340.000  1.080
   59    60   656.000  1.250
   59    61   656.000  1.250
   50    51   434.000  1.010
   50    52   434.000  1.010
   50    53   434.000  1.010
   41    42   745.000  1.250
   41    43   745.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    48    75.00000  111.63000
   33    38    39    70.00000  124.00000
   33    38    41    70.00000  124.00000
   33    48    46    58.35000  112.70000
   33    48    49    37.50000  110.70000
   33    48    54    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  120.00000
   38    39    44    70.00000  123.01800
   38    41    42    65.00000  137.10300
   38    41    43    65.00000  137.10300
   39    44    45    35.00000  120.00000
   39    44    46    70.00000  124.00000
   44    39    40    35.00000  120.00000
   44    46    47    35.00000  109.50000
   44    46    48    70.00000  112.02700
   44    46    50    75.00000  110.06800
   46    44    45    35.00000  117.00000
   46    48    49    37.50000  110.70000
   46    48    54    50.00000  109.50000
   46    50    51    35.00000  109.50000
   46    50    52    35.00000  109.50000
   46    50    53    35.00000  109.50000
   48    33    34    37.50000  110.70000
   48    33    38    70.00000  112.02700
   48    46    47    37.50000  110.70000
   48    54    55    90.00000  111.18400
   54    48    49    35.00000  109.50000
   54    55    56    80.00000  120.01400
   54    55    59    80.00000  119.00000
   55    56    57    35.00000  120.00000
   55    56    58    35.00000  120.00000
   55    59    60    85.00000  113.83300
   55    59    61    85.00000  113.83300
   58    56    57    35.00000  117.00000
   59    55    56    55.00000  124.75400
   61    59    60    80.00000  126.00000
   50    46    47    35.00000  109.50000
   50    46    48    80.00000  111.20000
   52    50    51    35.00000  109.50000
   53    50    51    35.00000  109.50000
   53    50    52    35.00000  109.50000
   41    38    39    70.00000  117.34000
   43    41    42    65.00000  121.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    41   0.42700  1.0 1.0
   29    33    38    41  -0.70350 -1.0 2.0
   29    33    38    41  -0.43150  1.0 3.0
   29    33    48    46   0.44750  1.0 1.0
   29    33    48    46  -0.17800 -1.0 2.0
   29    33    48    46   0.20200  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    54   0.56750  1.0 1.0
   29    33    48    54  -0.07550 -1.0 2.0
   29    33    48    54   0.20000  1.0 3.0
   33    38    39    40   0.00000  1.0 1.0
   33    38    39    44  -0.18600  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    43   7.00000 -1.0 2.0
   33    48    54    55  -0.46850  1.0 1.0
   33    48    54    55   0.09300 -1.0 2.0
   33    48    54    55  -0.12850  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    48    46   0.15000  1.0 3.0
   34    33    48    49   0.15000  1.0 3.0
   34    33    48    54   0.23400  1.0 3.0
   38    33    48    46   0.34400  1.0 1.0
   38    33    48    46   0.09450 -1.0 2.0
   38    33    48    46   0.11100  1.0 3.0
   38    33    48    49   0.15000  1.0 3.0
   38    33    48    54   0.61850  1.0 1.0
   38    33    48    54  -0.22750 -1.0 2.0
   38    33    48    54   0.15300  1.0 3.0
   38    39    44    45   7.00000 -1.0 2.0
   38    39   -44    46   7.00000 -1.0 2.0
   39    38    41    42   7.00000 -1.0 2.0
   39    38    41    43   7.00000 -1.0 2.0
   39    44    46    47   0.00000  1.0 1.0
   39    44    46    48   0.09850  1.0 1.0
   39    44    46    48   0.15250 -1.0 2.0
   39    44    46    48  -0.50650  1.0 3.0
   39    44    46    50   0.80850  1.0 1.0
   39    44    46    50  -0.47300 -1.0 2.0
   39    44    46    50  -0.52300  1.0 3.0
   40    39    44    45   7.00000 -1.0 2.0
   40    39    44    46   7.00000 -1.0 2.0
   44    46   -48    33   0.34400  1.0 1.0
   44    46   -48    33   0.09450 -1.0 2.0
   44    46   -48    33   0.11100  1.0 3.0
   44    46    48    49   0.15000  1.0 3.0
   44    46    48    54   0.61850  1.0 1.0
   44    46    48    54  -0.22750 -1.0 2.0
   44    46    48    54   0.15300  1.0 3.0
   44    46    50    51   0.17350  1.0 3.0
   44    46    50    52   0.17350  1.0 3.0
   44    46    50    53   0.17350  1.0 3.0
   45    44    46    47   0.33100  1.0 3.0
   45    44    46    48   0.00000  1.0 1.0
   45    44    46    50   0.00000  1.0 1.0
   46    48    54    55  -0.46850  1.0 1.0
   46    48    54    55   0.09300 -1.0 2.0
   46    48    54    55  -0.12850  1.0 3.0
   47    46    48    33   0.15000  1.0 3.0
   47    46    48    49   0.15000  1.0 3.0
   47    46    48    54   0.23400  1.0 3.0
   47    46    50    51   0.13050  1.0 3.0
   47    46    50    52   0.13050  1.0 3.0
   47    46    50    53   0.13050  1.0 3.0
   48    33   -38    39   0.98200  1.0 1.0
   48    33   -38    39  -0.11900 -1.0 2.0
   48    33   -38    39   0.24250  1.0 3.0
   48    33    38    41   0.09850  1.0 1.0
   48    33    38    41   0.15250 -1.0 2.0
   48    33    38    41  -0.50650  1.0 3.0
   48    46    50    51   0.17350  1.0 3.0
   48    46    50    52   0.17350  1.0 3.0
   48    46    50    53   0.17350  1.0 3.0
   48    54    55    56  -2.26850  1.0 1.0
   48    54    55    56   3.39050 -1.0 2.0
   48    54    55    59   0.15100 -1.0 2.0
   49    48    54    55   0.08050  1.0 3.0
   54    55    56    57   7.00000 -1.0 2.0
   54    55    56    58   7.00000 -1.0 2.0
   54    55    59    60  -0.11900  1.0 1.0
   54    55    59    60   0.76850 -1.0 2.0
   54    55    59    60   0.14100  1.0 3.0
   54    55    59    61  -0.11900  1.0 1.0
   54    55    59    61   0.76850 -1.0 2.0
   54    55    59    61   0.14100  1.0 3.0
   56    55    59    60  -0.04000 -1.0 2.0
   56    55    59    60  -0.29050  1.0 3.0
   56    55    59    61  -0.04000 -1.0 2.0
   56    55    59    61  -0.29050  1.0 3.0
   59    55    56    57   7.00000 -1.0 2.0
   59    55    56    58   7.00000 -1.0 2.0
   50    46    48    33   1.36600  1.0 1.0
   50    46    48    33  -0.11450 -1.0 2.0
   50    46    48    33   0.24250  1.0 3.0
   50    46    48    49   0.19200  1.0 3.0
   50    46    48    54   1.69300  1.0 1.0
   50    46    48    54  -0.48450 -1.0 2.0
   41    38    39    40  -0.18600  1.0 3.0
   41    38    39    44   0.28850  1.0 1.0
   41    38    39    44   2.61350 -1.0 2.0
   41    38    39    44   0.78400  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
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    41   1.10000 -1.0 2.0
   38    40    39    44   1.10000 -1.0 2.0
   46    45    44    39   1.10000 -1.0 2.0
   54    59    55    56  15.00000 -1.0 2.0
   57    58    56    55  15.00000 -1.0 2.0
   60    55    59    61  10.50000 -1.0 2.0
   42    43    41    38   1.10000 -1.0 2.0
END
