* LIGAND DATABASE FILE (OPLS2005)
*
001      56    56    101    152     298
    1     0 S   NP   _N1_     1    28.73441    96.22796   -23.13076
    2     1 S   H    _HN1     2     1.02950    72.78357    12.26617
    3     1 S   H    _H1_     3     1.02829    37.85545   166.35495
    4     1 S   H    _H2_     4     1.02786   104.37558   -92.86976
    5     1 S   CT   _CA1     5     1.50109   139.20274   113.78194
    6     5 S   HC   _HA1     6     1.09573   105.19692    90.64773
    7     5 S   CO3  _C1_     7     1.53792   112.48734   -29.59493
    8     7 S   O2Z  _O11     8     1.26371   115.00854   -42.07795
    9     7 S   O2Z  _O12     9     1.26242   114.95127   137.08394
   10     5 S   CT   _CB1    10     1.53082   107.42641  -151.35225
   11    10 S   HC   HB11    11     1.09832   109.38330   -49.65480
   12    10 S   HC   HB12    12     1.09813   110.44076    66.96031
   13    10 S   CT   _CG1    13     1.52987   112.59826  -170.63196
   14    13 S   HC   HG11    14     1.09581   110.62804   -65.52907
   15    13 S   HC   HG12    15     1.09671   109.78413    53.69871
   16    13 S   C    _CD1    16     1.51797   112.25124   174.16561
   17    16 S   O    _OE1    17     1.22726   123.29222     6.74081
   18    16 S   N    _N2_    18     1.38657   111.64888  -173.33844
   19    18 S   H    _HN2    19     1.01575   118.91986     1.93856
   20    18 S   CT1  _CA2    20     1.46217   123.42558   177.52504
   21    20 S   HC   _HA2    21     1.09735   109.36405     3.35835
   22    20 S   C    _C2_    22     1.53569   108.56686  -112.12202
   23    22 S   O    _O2_    23     1.23055   122.31597  -147.58234
   24    20 S   CT   _CB2    32     1.53300   111.55629   125.38598
   25    24 S   HC   HB21    33     1.09594   110.17484    56.04622
   26    24 S   HC   HB22    34     1.09502   110.12552   175.19046
   27    22 S   N    _N3_    24     1.38339   113.70659    39.83773
   28    27 S   H    _HN3    25     1.01578   119.59617    -3.20284
   29    24 S   S    _SG2    35     1.82662   111.58431   -64.89912
   30    27 S   CT   _CA3    26     1.45284   123.21306   177.17617
   31    30 S   HC   HA31    27     1.09549   107.50075   -64.86068
   32    30 S   HC   HA32    28     1.09556   107.99958    51.58243
   33    29 S   CT   _C9_    36     1.83008    99.01679   174.58047
   34    33 S   HC   _H7_    37     1.09494   107.16083   -61.61027
   35    30 S   CO3  _C3_    29     1.52960   114.07580   173.58607
   36    35 S   O2Z  _O31    30     1.26377   116.07164    -0.72659
   37    35 S   O2Z  _O32    31     1.26429   114.41126   179.33530
   38    33 S   CT   _C8_    38     1.52773   114.29807   176.29541
   39    38 S   HC   _H6_    39     1.09786   108.67177   154.37958
   40    38 S   CT   _C7_    40     1.50978   102.48699   -91.09316
   41    40 S   F    F1__    41     1.35988   109.59929    76.48627
   42    40 S   HC   _H5_    42     1.09287   113.99022  -162.37047
   43    38 S   OH   _O34    55     1.41068   116.32268    32.67266
   44    43 S   HO   _H10    56     0.97242   107.72706    47.43854
   45    40 S   CT   _C6_    43     1.51993   101.25662   -39.03609
   46    45 S   HC   _H4_    44     1.09769   110.09058   -79.90105
   47    33 S   OS   _O33    45     1.44127   111.37122    57.04147
   48    45 S   CT   _C5_    46     1.52870   115.49413   154.62451
   49    48 S   HC   _H3_    47     1.09638   110.57614   -69.66906
   50    48 S   CT   _C4_    48     1.52624   113.26521    55.33928
   51    50 S   HC   _H8_    49     1.09336   111.78780   -58.08609
   52    50 S   HC   _H9_    50     1.09485   111.02444    64.61080
   53    48 S   OH   _O35    53     1.43400   107.70229   174.77757
   54    53 S   HO   _H11    54     0.97359   106.74341  -177.94196
   55    50 S   OH   _O36    51     1.42536   108.66310  -177.03205
   56    55 S   HO   _H12    52     0.97267   107.01454   179.73756
  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  10   7  11   6   5   3   1  10   5   4   8
   6   6   4   3   2   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    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    47    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    45    46    47    48    43    44  
   38    39    40    45    47    43  
   36    37  
   37  
    0  
   39    40    41    42    45    46    47    48    43    44  
   40    41    42    45    47    43    44  
   41    42    45    46    47    48    49    50    53    43    44  
   42    45    46    47    48    43  
   45    46    47    48    43  
   44    45    47  
    0  
   46    47    48    49    50    51    52    55    53    54  
   47    48    49    50    53  
   48    49    50    53  
   49    50    51    52    55    56    53    54  
   50    51    52    55    53    54  
   51    52    55    56    53    54  
   52    55    56    53  
   55    56    53  
   54    55  
    0  
   56  
    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   0.072400   1.9750   1.7500   0.005000000  -0.741685710
   41   2.9400   0.0610  -0.220000   2.4980   2.2250   0.001000000   0.985400000
   42   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   43   3.1200   0.1700  -0.683000   1.8380   1.6250   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660   0.217600   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   47   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   56   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    47   320.000  1.410
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    43   320.000  1.410
   40    41   367.000  1.332
   40    42   340.000  1.090
   40    45   268.000  1.529
   45    46   340.000  1.090
   45    47   320.000  1.410
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    53   320.000  1.410
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    55   320.000  1.410
   55    56   553.000  0.945
   53    54   553.000  0.945
   43    44   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    47    85.00000  114.68000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    43    50.00000  109.50000
   33    47    45    60.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    50.00000  109.50000
   38    40    42    37.50000  110.70000
   38    40    45    58.35000  112.70000
   38    43    44    55.00000  108.50000
   40    38    39    37.50000  110.70000
   40    45    46    37.50000  110.70000
   40    45    47    50.00000  109.50000
   40    45    48    58.35000  112.70000
   42    40    41    40.00000  107.00000
   45    40    41    50.00000  109.50000
   45    40    42    37.50000  110.70000
   45    48    49    37.50000  110.70000
   45    48    50    58.35000  112.70000
   45    48    53    50.00000  109.50000
   47    33    34    35.00000  109.50000
   47    33    38    50.00000  109.50000
   47    45    46    35.00000  109.50000
   48    45    46    37.50000  110.70000
   48    45    47    50.00000  109.50000
   48    50    51    37.50000  110.70000
   48    50    52    37.50000  110.70000
   48    50    55    50.00000  109.50000
   48    53    54    55.00000  108.50000
   50    48    49    37.50000  110.70000
   50    55    56    55.00000  108.50000
   52    50    51    33.00000  107.80000
   55    50    51    35.00000  109.50000
   55    50    52    35.00000  109.50000
   53    48    49    35.00000  109.50000
   53    48    50    50.00000  109.50000
   43    38    39    35.00000  109.50000
   43    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    47   0.13850  1.0 1.0
   24    29    33    47  -1.34450 -1.0 2.0
   24    29    33    47   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    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    47    45   0.14700  1.0 1.0
   29    33    47    45  -1.16150 -1.0 2.0
   29    33    47    45   0.48700  1.0 3.0
   33    38    40    41   0.39650  1.0 1.0
   33    38    40    41  -0.18350 -1.0 2.0
   33    38    40    41   0.41450  1.0 3.0
   33    38    40    42   0.15000  1.0 3.0
   33    38   -40    45   0.56750  1.0 1.0
   33    38   -40    45  -0.07550 -1.0 2.0
   33    38   -40    45   0.20000  1.0 3.0
   33    38    43    44  -0.11600  1.0 1.0
   33    38    43    44  -0.09450 -1.0 2.0
   33    38    43    44   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    43   0.23400  1.0 3.0
   34    33    47    45   0.37050  1.0 3.0
   38    33   -47    45   0.06250  1.0 1.0
   38    33   -47    45  -0.01100 -1.0 2.0
   38    33   -47    45   0.28050  1.0 3.0
   38    40    45    46   0.15000  1.0 3.0
   38    40   -45    47   0.62750  1.0 1.0
   38    40   -45    47  -0.30950 -1.0 2.0
   38    40   -45    47   0.27300  1.0 3.0
   38    40    45    48   0.56750  1.0 1.0
   38    40    45    48  -0.07550 -1.0 2.0
   38    40    45    48   0.20000  1.0 3.0
   39    38    40    41   0.22100  1.0 3.0
   39    38    40    42   0.15000  1.0 3.0
   39    38    40    45   0.15000  1.0 3.0
   39    38    43    44   0.19450  1.0 3.0
   40    38    43    44  -0.11600  1.0 1.0
   40    38    43    44  -0.09450 -1.0 2.0
   40    38    43    44   0.21250  1.0 3.0
   40    45   -47    33   0.06250  1.0 1.0
   40    45   -47    33  -0.01100 -1.0 2.0
   40    45   -47    33   0.28050  1.0 3.0
   40    45    48    49   0.15000  1.0 3.0
   40    45    48    50   0.56750  1.0 1.0
   40    45    48    50  -0.07550 -1.0 2.0
   40    45    48    50   0.20000  1.0 3.0
   40    45    48    53   0.86500  1.0 1.0
   40    45    48    53  -0.17500 -1.0 2.0
   40    45    48    53   0.20800  1.0 3.0
   41    40    45    46   0.22100  1.0 3.0
   41    40    45    47   0.51850  1.0 1.0
   41    40    45    47  -0.72850 -1.0 2.0
   41    40    45    48   0.39650  1.0 1.0
   41    40    45    48  -0.18350 -1.0 2.0
   41    40    45    48   0.41450  1.0 3.0
   42    40    45    46   0.15000  1.0 3.0
   42    40    45    47   0.23400  1.0 3.0
   42    40    45    48   0.15000  1.0 3.0
   45    48    50    51   0.15000  1.0 3.0
   45    48    50    52   0.15000  1.0 3.0
   45    48    50    55   0.86500  1.0 1.0
   45    48    50    55  -0.17500 -1.0 2.0
   45    48    50    55   0.20800  1.0 3.0
   45    48    53    54  -0.11600  1.0 1.0
   45    48    53    54  -0.09450 -1.0 2.0
   45    48    53    54   0.21250  1.0 3.0
   46    45    47    33   0.37050  1.0 3.0
   46    45    48    49   0.15000  1.0 3.0
   46    45    48    50   0.15000  1.0 3.0
   46    45    48    53   0.23400  1.0 3.0
   47    33    38    39   0.23400  1.0 3.0
   47    33   -38    40   0.62750  1.0 1.0
   47    33   -38    40  -0.30950 -1.0 2.0
   47    33   -38    40   0.27300  1.0 3.0
   47    33    38    43   3.69350  1.0 1.0
   47    33    38    43  -1.82950 -1.0 2.0
   47    45    48    49   0.23400  1.0 3.0
   47    45    48    50   0.62750  1.0 1.0
   47    45    48    50  -0.30950 -1.0 2.0
   47    45    48    50   0.27300  1.0 3.0
   47    45    48    53   3.69350  1.0 1.0
   47    45    48    53  -1.82950 -1.0 2.0
   48    45    47    33   0.06250  1.0 1.0
   48    45    47    33  -0.01100 -1.0 2.0
   48    45    47    33   0.28050  1.0 3.0
   48    50    55    56  -0.11600  1.0 1.0
   48    50    55    56  -0.09450 -1.0 2.0
   48    50    55    56   0.21250  1.0 3.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    52   0.15000  1.0 3.0
   49    48    50    55   0.23400  1.0 3.0
   49    48    53    54   0.19450  1.0 3.0
   50    48    53    54  -0.11600  1.0 1.0
   50    48    53    54  -0.09450 -1.0 2.0
   50    48    53    54   0.21250  1.0 3.0
   51    50    55    56   0.19450  1.0 3.0
   52    50    55    56   0.19450  1.0 3.0
   53    48    50    51   0.23400  1.0 3.0
   53    48    50    52   0.23400  1.0 3.0
   53    48    50    55   3.75450  1.0 1.0
   43    38    40    41   1.44150  1.0 1.0
   43    38    40    41  -0.96950 -1.0 2.0
   43    38    40    41   0.13600  1.0 3.0
   43    38    40    42   0.23400  1.0 3.0
   43    38    40    45   0.86500  1.0 1.0
   43    38    40    45  -0.17500 -1.0 2.0
   43    38    40    45   0.20800  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
END
