* LIGAND DATABASE FILE (OPLS2005)
*
001      53    53     95    143     280
    1     0 S   NP   _N1_     1    28.78764    95.51100   -23.89597
    2     1 S   H    _HN1     2     1.02948    76.38076    11.13979
    3     1 S   H    _H1_     3     1.02828    32.31214   172.61624
    4     1 S   H    _H2_     4     1.02787   109.08696   -93.88710
    5     1 S   CT   _CA1     5     1.50116   132.68680   116.48135
    6     5 S   HC   _HA1     6     1.09572   105.18767    87.57968
    7     5 S   CO3  _C1_     7     1.53786   112.48349   -32.66124
    8     7 S   O2Z  _O11     8     1.26374   115.00524   -41.98038
    9     7 S   O2Z  _O12     9     1.26239   114.95138   137.14422
   10     5 S   CT   _CB1    10     1.53075   107.42087  -154.41440
   11    10 S   HC   HB11    11     1.09835   109.38065   -49.43259
   12    10 S   HC   HB12    12     1.09812   110.44343    67.18051
   13    10 S   CT   _CG1    13     1.52996   112.61092  -170.39000
   14    13 S   HC   HG11    14     1.09577   110.66613   -65.95416
   15    13 S   HC   HG12    15     1.09670   109.75625    53.28361
   16    13 S   C    _CD1    16     1.51800   112.17493   173.76627
   17    16 S   O    _OE1    17     1.22734   123.26667     8.57861
   18    16 S   N    _N2_    18     1.38653   111.71110  -171.54794
   19    18 S   H    _HN2    19     1.01581   118.93864     1.73077
   20    18 S   CT1  _CA2    20     1.46204   123.39257   177.28589
   21    20 S   HC   _HA2    21     1.09734   109.35405     4.55122
   22    20 S   C    _C2_    22     1.53588   108.68137  -110.97479
   23    22 S   O    _O2_    23     1.23066   122.24482  -147.97522
   24    20 S   CT   _CB2    32     1.53328   111.57052   126.57315
   25    24 S   HC   HB21    33     1.09533   109.91414    56.42589
   26    24 S   HC   HB22    34     1.09521   110.21011   175.48191
   27    22 S   N    _N3_    24     1.38317   113.76686    39.45585
   28    27 S   H    _HN3    25     1.01570   119.60309    -3.21053
   29    24 S   S    _SG2    35     1.82666   111.57559   -64.64805
   30    27 S   CT   _CA3    26     1.45287   123.24357   177.20173
   31    30 S   HC   HA31    27     1.09548   107.50417   -64.88804
   32    30 S   HC   HA32    28     1.09556   107.99920    51.56131
   33    29 S   CT   _C7_    36     1.82216    99.39172  -175.80208
   34    33 S   HC   _H4_    37     1.09622   108.04554    60.45296
   35    30 S   CO3  _C3_    29     1.52969   114.06022   173.56785
   36    35 S   O2Z  _O31    30     1.26379   116.06788    -0.51472
   37    35 S   O2Z  _O32    31     1.26427   114.41380   179.54458
   38    33 S   CT   _C6_    38     1.53331   115.28260   -63.55482
   39    38 S   HC   _H3_    39     1.09470   111.68586    81.83566
   40    38 S   CT   _C5_    40     1.52231   101.20705  -157.76713
   41    38 S   OH   _O34    52     1.42566   112.08757   -40.18033
   42    41 S   HO   _H7_    53     0.97322   108.21316   -32.41915
   43    40 S   CT   _C4_    41     1.52479   102.03740    37.76558
   44    43 S   HC   _H5_    42     1.09510   112.26074    88.04170
   45    43 S   HC   _H6_    43     1.09423   113.20014  -147.90551
   46    40 S   CT   _C8_    45     1.52566   115.55764   161.80989
   47    46 S   HC   _H8_    46     1.09504   110.60350    64.93486
   48    46 S   HC   _H9_    47     1.09432   112.02537   -57.10583
   49    40 S   OH   _O36    50     1.43387   108.01422   -76.55321
   50    49 S   HO   _H11    51     0.97400   107.14469  -178.39112
   51    33 S   OS   _O33    44     1.44300   111.09831   176.25707
   52    46 S   OH   _O35    48     1.42541   109.25571  -176.70087
   53    52 S   HO   _H10    49     0.97282   106.97865  -179.34598
  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   8   5   4   3
  12   6   2   1   1  14   7  13   5   1   9   4   3   7   4   3
   3   1   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    51    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    51    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    44    45    51    46    49    41    42  
   38    39    40    43    51    41  
   36    37  
   37  
    0  
   39    40    43    44    45    51    46    47    48    52    49    50    41    42  
   40    43    51    46    49    41    42  
   43    44    45    51    46    47    48    52    53    49    50    41    42  
   42    43    46    49    51  
    0  
   44    45    51    46    47    48    52    49    50  
   45    51    46    49  
   51    46    49  
   47    48    52    53    49    50    51  
   48    52    53    49  
   52    53    49  
   50    51    52  
    0  
    0  
   53  
    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  -0.316400   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   0.318900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   42   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   43   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   50   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   51   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   52   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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    51   320.000  1.410
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    41   320.000  1.410
   40    43   268.000  1.529
   40    46   268.000  1.529
   40    49   320.000  1.410
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    51   320.000  1.410
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    52   320.000  1.410
   52    53   553.000  0.945
   49    50   553.000  0.945
   41    42   553.000  0.945
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    51    85.00000  114.68000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    41    50.00000  109.50000
   33    51    43    60.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    43    58.35000  112.70000
   38    40    46    58.35000  112.70000
   38    40    49    50.00000  109.50000
   38    41    42    55.00000  108.50000
   40    38    39    37.50000  110.70000
   40    43    44    37.50000  110.70000
   40    43    45    37.50000  110.70000
   40    43    51    50.00000  109.50000
   40    46    47    37.50000  110.70000
   40    46    48    37.50000  110.70000
   40    46    52    50.00000  109.50000
   40    49    50    55.00000  108.50000
   45    43    44    33.00000  107.80000
   51    33    34    35.00000  109.50000
   51    33    38    50.00000  109.50000
   51    43    44    35.00000  109.50000
   51    43    45    35.00000  109.50000
   46    40    43    58.35000  112.70000
   46    52    53    55.00000  108.50000
   48    46    47    33.00000  107.80000
   52    46    47    35.00000  109.50000
   52    46    48    35.00000  109.50000
   49    40    43    50.00000  109.50000
   49    40    46    50.00000  109.50000
   41    38    39    35.00000  109.50000
   41    38    40    50.00000  109.50000
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    51   0.13850  1.0 1.0
   24    29    33    51  -1.34450 -1.0 2.0
   24    29    33    51   0.57400  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   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  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    51    43   0.14700  1.0 1.0
   29    33    51    43  -1.16150 -1.0 2.0
   29    33    51    43   0.48700  1.0 3.0
   33    38   -40    43   0.56750  1.0 1.0
   33    38   -40    43  -0.07550 -1.0 2.0
   33    38   -40    43   0.20000  1.0 3.0
   33    38    40    46   0.56750  1.0 1.0
   33    38    40    46  -0.07550 -1.0 2.0
   33    38    40    46   0.20000  1.0 3.0
   33    38    40    49   0.86500  1.0 1.0
   33    38    40    49  -0.17500 -1.0 2.0
   33    38    40    49   0.20800  1.0 3.0
   33    38    41    42  -0.11600  1.0 1.0
   33    38    41    42  -0.09450 -1.0 2.0
   33    38    41    42   0.21250  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   0.23400  1.0 3.0
   34    33    51    43   0.37050  1.0 3.0
   38    33   -51    43   0.06250  1.0 1.0
   38    33   -51    43  -0.01100 -1.0 2.0
   38    33   -51    43   0.28050  1.0 3.0
   38    40    43    44   0.15000  1.0 3.0
   38    40    43    45   0.15000  1.0 3.0
   38    40   -43    51   0.62750  1.0 1.0
   38    40   -43    51  -0.30950 -1.0 2.0
   38    40   -43    51   0.27300  1.0 3.0
   38    40    46    47   0.15000  1.0 3.0
   38    40    46    48   0.15000  1.0 3.0
   38    40    46    52   0.86500  1.0 1.0
   38    40    46    52  -0.17500 -1.0 2.0
   38    40    46    52   0.20800  1.0 3.0
   38    40    49    50  -0.11600  1.0 1.0
   38    40    49    50  -0.09450 -1.0 2.0
   38    40    49    50   0.21250  1.0 3.0
   39    38    40    43   0.15000  1.0 3.0
   39    38    40    46   0.15000  1.0 3.0
   39    38    40    49   0.23400  1.0 3.0
   39    38    41    42   0.19450  1.0 3.0
   40    38    41    42  -0.11600  1.0 1.0
   40    38    41    42  -0.09450 -1.0 2.0
   40    38    41    42   0.21250  1.0 3.0
   40    43   -51    33   0.06250  1.0 1.0
   40    43   -51    33  -0.01100 -1.0 2.0
   40    43   -51    33   0.28050  1.0 3.0
   40    46    52    53  -0.11600  1.0 1.0
   40    46    52    53  -0.09450 -1.0 2.0
   40    46    52    53   0.21250  1.0 3.0
   43    40    46    47   0.15000  1.0 3.0
   43    40    46    48   0.15000  1.0 3.0
   43    40    46    52   0.86500  1.0 1.0
   43    40    46    52  -0.17500 -1.0 2.0
   43    40    46    52   0.20800  1.0 3.0
   43    40    49    50  -0.11600  1.0 1.0
   43    40    49    50  -0.09450 -1.0 2.0
   43    40    49    50   0.21250  1.0 3.0
   44    43    51    33   0.37050  1.0 3.0
   45    43    51    33   0.37050  1.0 3.0
   51    33    38    39   0.23400  1.0 3.0
   51    33   -38    40   0.62750  1.0 1.0
   51    33   -38    40  -0.30950 -1.0 2.0
   51    33   -38    40   0.27300  1.0 3.0
   51    33    38    41   3.69350  1.0 1.0
   51    33    38    41  -1.82950 -1.0 2.0
   46    40    43    44   0.15000  1.0 3.0
   46    40    43    45   0.15000  1.0 3.0
   46    40    43    51   0.62750  1.0 1.0
   46    40    43    51  -0.30950 -1.0 2.0
   46    40    43    51   0.27300  1.0 3.0
   46    40    49    50  -0.11600  1.0 1.0
   46    40    49    50  -0.09450 -1.0 2.0
   46    40    49    50   0.21250  1.0 3.0
   47    46    52    53   0.19450  1.0 3.0
   48    46    52    53   0.19450  1.0 3.0
   49    40    43    44   0.23400  1.0 3.0
   49    40    43    45   0.23400  1.0 3.0
   49    40    43    51   3.69350  1.0 1.0
   49    40    43    51  -1.82950 -1.0 2.0
   49    40    46    47   0.23400  1.0 3.0
   49    40    46    48   0.23400  1.0 3.0
   49    40    46    52   3.75450  1.0 1.0
   41    38    40    43   0.86500  1.0 1.0
   41    38    40    43  -0.17500 -1.0 2.0
   41    38    40    43   0.20800  1.0 3.0
   41    38    40    46   0.86500  1.0 1.0
   41    38    40    46  -0.17500 -1.0 2.0
   41    38    40    46   0.20800  1.0 3.0
   41    38    40    49   3.75450  1.0 1.0
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
END
