* LIGAND DATABASE FILE (OPLS2005)
*
001      55    55    101    147     293
    1     0 S   NP   _N1_     1    28.93599    94.13138   -22.37338
    2     1 S   H    _HN1     2     1.02956    87.24037    22.17152
    3     1 S   H    _H1_     3     1.02840    25.79055   162.86970
    4     1 S   H    _H2_     4     1.02780    99.70394   -85.96136
    5     1 S   CT   _CA1     5     1.50099   134.86222   138.61807
    6     5 S   HC   _HA1     6     1.09574   105.24698    70.19040
    7     5 S   CO3  _C1_     7     1.53782   112.35047   -50.08151
    8     7 S   O2Z  _O11     8     1.26361   114.99410   -45.34790
    9     7 S   O2Z  _O12     9     1.26233   114.91197   133.87082
   10     5 S   CT   _CB1    10     1.53106   107.47198  -171.86964
   11    10 S   HC   HB11    11     1.09826   109.38308   -50.70584
   12    10 S   HC   HB12    12     1.09818   110.42462    65.86481
   13    10 S   CT   _CG1    13     1.53023   112.62249  -171.76419
   14    13 S   HC   HG11    14     1.09593   110.50244   -63.49394
   15    13 S   HC   HG12    15     1.09655   109.93035    55.72688
   16    13 S   C    _CD1    16     1.51808   112.30653   176.15672
   17    16 S   O    _OE1    17     1.22740   123.25050     0.56093
   18    16 S   N    _N2_    18     1.38633   111.67345  -179.54200
   19    18 S   H    _HN2    19     1.01602   118.99624     1.10641
   20    18 S   CT1  _CA2    20     1.46105   123.45257   179.38324
   21    20 S   HC   _HA2    21     1.09584   109.30996    -7.39223
   22    20 S   C    _C2_    22     1.53452   108.64866  -122.36481
   23    22 S   O    _O2_    23     1.23020   122.18146  -146.51651
   24    20 S   CT   _CB2    32     1.53332   111.66132   115.10676
   25    24 S   HC   HB21    33     1.09663   109.60390    59.61798
   26    24 S   HC   HB22    34     1.09543   111.00900   176.74574
   27    22 S   N    _N3_    24     1.38492   113.42515    41.16659
   28    27 S   H    _HN3    25     1.01494   118.98230    -0.91150
   29    24 S   S    _SG2    35     1.83065   114.74581   -60.20213
   30    27 S   CT   _CA3    26     1.45442   123.36880   174.10785
   31    30 S   HC   HA31    27     1.09528   109.10286    26.74630
   32    30 S   HC   HA32    28     1.09486   107.14255   143.82735
   33    29 S   CT   _C9_    36     1.82685   100.34062   -63.07587
   34    33 S   HC   _H5_    37     1.09470   108.15485    68.20817
   35    30 S   CO3  _C3_    29     1.52985   113.30414   -96.54657
   36    35 S   O2Z  _O31    30     1.26394   115.57445   -38.42013
   37    35 S   O2Z  _O32    31     1.26377   114.85453   142.49253
   38    33 S   CT   _C8_    38     1.53209   108.94303  -172.43102
   39    38 S   HC   _H9_    39     1.09914   109.51257    62.05872
   40    38 S   HC   _H10    40     1.09708   111.06369   -57.04034
   41    38 S   CT1  _C7_    41     1.52534   109.65354  -178.40357
   42    41 S   HC   _H4_    42     1.09518   111.45113    69.96562
   43    41 S   CO4  _C6_    43     1.51541   110.13059   -50.61163
   44    43 S   O    _O33    44     1.22975   121.84672  -137.85059
   45    41 S   NP   _N4_    52     1.48935   108.99670  -172.74734
   46    45 S   H    _H11    53     1.02862   111.88844   -60.74128
   47    45 S   H    _H12    54     1.02943   110.84469   179.27936
   48    45 S   H    _H13    55     1.02921   111.73113    60.19949
   49    43 S   CT   _C5_    45     1.52504   114.98050    46.63367
   50    49 S   HC   _H3_    46     1.09641   108.62848    70.29027
   51    33 S   OS   _O34    47     1.42903   111.24796   -52.43280
   52    49 S   CT   _C4_    48     1.51992   111.95303  -168.79908
   53    52 S   HC   _H6_    49     1.09599   110.98052    59.49259
   54    52 S   HC   _H7_    50     1.09449   111.45836   -61.23042
   55    52 S   HC   _H8_    51     1.09529   110.49613   177.84160
  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  12   6   5  11   7  12   5   4   2   1   1
   6   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    51    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    49    51  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    49    50    51    52    45  
   38    39    40    41    49    51  
   36    37  
   37  
    0  
   39    40    41    42    43    44    49    51    45    46    47    48  
   40    41    42    43    51    45  
   41    42    43    51    45  
   42    43    44    49    50    51    52    45    46    47    48  
   43    44    49    45    46    47    48  
   44    49    50    51    52    53    54    55    45    46    47    48  
   49    50    51    52    45  
   46    47    48    49  
   47    48  
   48  
    0  
   50    51    52    53    54    55  
   51    52    53    54    55  
   52    53    54    55  
   53    54    55  
   54    55  
   55  
    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   1.6450   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   41   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.4200   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   43   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.2500   0.1700  -0.300000   2.2900   2.0360   0.003973653   1.685851020
   46   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   47   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   48   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660   0.218000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.4200   0.0150   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
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   340.000  1.090
   38    41   268.000  1.529
   41    42   340.000  1.090
   41    43   255.000  1.522
   41    45   367.000  1.471
   43    44   570.000  1.229
   43    49   317.000  1.522
   49    50   340.000  1.090
   49    51   320.000  1.410
   49    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
   45    46   434.000  1.010
   45    47   434.000  1.010
   45    48   434.000  1.010
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    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    51    49    60.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    42    37.50000  110.70000
   38    41    43    70.00000  110.61500
   38    41    45    80.00000  111.20000
   40    38    39    33.00000  107.80000
   41    38    39    37.50000  110.70000
   41    38    40    37.50000  110.70000
   41    43    44    75.00000  123.42600
   41    43    49    65.00000  117.09000
   41    45    46    35.00000  109.50000
   41    45    47    35.00000  109.50000
   41    45    48    35.00000  109.50000
   43    41    42    45.00000  110.09800
   43    49    50    35.00000  109.50000
   43    49    51    90.00000  108.74100
   43    49    52    63.00000  111.10000
   49    43    44    80.00000  120.40000
   49    52    53    37.50000  110.70000
   49    52    54    37.50000  110.70000
   49    52    55    37.50000  110.70000
   51    33    34    35.00000  109.50000
   51    33    38    50.00000  109.50000
   51    49    50    35.00000  109.50000
   52    49    50    37.50000  110.70000
   52    49    51    50.00000  109.50000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
   45    41    42    35.00000  109.50000
   45    41    43    85.00000  107.27000
   47    45    46    35.00000  109.50000
   48    45    46    35.00000  109.50000
   48    45    47    35.00000  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   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    51    49   0.14700  1.0 1.0
   29    33    51    49  -1.16150 -1.0 2.0
   29    33    51    49   0.48700  1.0 3.0
   33    38    41    42   0.15000  1.0 3.0
   33    38    41    43  -0.84850  1.0 1.0
   33    38    41    43  -0.22800 -1.0 2.0
   33    38    41    43   0.29250  1.0 3.0
   33    38    41    45   0.42250  1.0 1.0
   33    38    41    45  -0.48100 -1.0 2.0
   33    38    41    45   0.35650  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   0.15000  1.0 3.0
   34    33    51    49   0.37050  1.0 3.0
   38    33    51    49   0.06250  1.0 1.0
   38    33    51    49  -0.01100 -1.0 2.0
   38    33    51    49   0.28050  1.0 3.0
   38    41    43    44   0.00000  1.0 1.0
   38    41   -43    49   0.60050  1.0 1.0
   38    41   -43    49   0.05600 -1.0 2.0
   38    41   -43    49   0.26150  1.0 3.0
   38    41    45    46   0.17350  1.0 3.0
   38    41    45    47   0.17350  1.0 3.0
   38    41    45    48   0.17350  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    43  -0.03800  1.0 3.0
   39    38    41    45   0.23200  1.0 3.0
   40    38    41    42   0.15000  1.0 3.0
   40    38    41    43  -0.03800  1.0 3.0
   40    38    41    45   0.23200  1.0 3.0
   41    43    49    50   0.00000  1.0 1.0
   41    43    49    51   0.55300  1.0 1.0
   41    43    49    51   1.25850 -1.0 2.0
   41    43    49    51  -0.23600  1.0 3.0
   41    43    49    52   0.60050  1.0 1.0
   41    43    49    52   0.05600 -1.0 2.0
   41    43    49    52   0.26150  1.0 3.0
   42    41    43    44   0.00000  1.0 1.0
   42    41    43    49   0.00000  1.0 1.0
   42    41    45    46   0.13050  1.0 3.0
   42    41    45    47   0.13050  1.0 3.0
   42    41    45    48   0.13050  1.0 3.0
   43    41    45    46   0.17350  1.0 3.0
   43    41    45    47   0.17350  1.0 3.0
   43    41    45    48   0.17350  1.0 3.0
   43    49   -51    33  -1.11000  1.0 1.0
   43    49   -51    33   0.50250 -1.0 2.0
   43    49   -51    33   0.47450  1.0 3.0
   43    49    52    53  -0.11250  1.0 3.0
   43    49    52    54  -0.11250  1.0 3.0
   43    49    52    55  -0.11250  1.0 3.0
   44    43    49    50   0.00000  1.0 1.0
   44    43    49    51   0.30150 -1.0 2.0
   44    43    49    52   0.30150 -1.0 2.0
   50    49    51    33   0.37050  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    54   0.15000  1.0 3.0
   50    49    52    55   0.15000  1.0 3.0
   51    33    38    39   0.23400  1.0 3.0
   51    33    38    40   0.23400  1.0 3.0
   51    33   -38    41   0.62750  1.0 1.0
   51    33   -38    41  -0.30950 -1.0 2.0
   51    33   -38    41   0.27300  1.0 3.0
   51    49    52    53   0.23400  1.0 3.0
   51    49    52    54   0.23400  1.0 3.0
   51    49    52    55   0.23400  1.0 3.0
   52    49    51    33   0.06250  1.0 1.0
   52    49    51    33  -0.01100 -1.0 2.0
   52    49    51    33   0.28050  1.0 3.0
   45    41    43    44   0.00000  1.0 1.0
   45    41    43    49  -0.05600  1.0 1.0
   45    41    43    49   0.24350 -1.0 2.0
   45    41    43    49   1.01150  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
   41    49    43    44  10.50000 -1.0 2.0
END
