* LIGAND DATABASE FILE (OPLS2005)
*
001      54    54     98    144     286
    1     0 S   NP   _N1_     1    28.75015    95.73377   -23.01387
    2     1 S   H    _HN1     2     1.02829    34.87473   165.10013
    3     1 S   H    _H1_     3     1.02784   102.70104   -91.76561
    4     1 S   H    _H2_     4     1.02950    76.51699    14.37110
    5     1 S   CT   _CA1     5     1.50105   139.00618   120.08118
    6     5 S   HC   _HA1     6     1.09573   105.21048    84.86483
    7     5 S   CO3  _C1_     7     1.53792   112.44296   -35.39196
    8     7 S   O2Z  _O11     8     1.26371   115.01046   -43.19401
    9     7 S   O2Z  _O12     9     1.26239   114.94404   135.97674
   10     5 S   CT   _CB1    10     1.53083   107.42602  -157.15486
   11    10 S   HC   HB11    11     1.09831   109.39044   -49.89277
   12    10 S   HC   HB12    12     1.09813   110.44076    66.71708
   13    10 S   CT   _CG1    13     1.52985   112.59167  -170.88178
   14    13 S   HC   HG11    14     1.09585   110.60333   -64.98746
   15    13 S   HC   HG12    15     1.09669   109.81518    54.23788
   16    13 S   C    _CD1    16     1.51798   112.26524   174.69212
   17    16 S   O    _OE1    17     1.22728   123.30548     5.40943
   18    16 S   N    _N2_    18     1.38656   111.64311  -174.69160
   19    18 S   H    _HN2    19     1.01584   118.93465     1.82070
   20    18 S   CT1  _CA2    20     1.46186   123.38974   177.73912
   21    20 S   HC   _HA2    21     1.09737   109.35542     1.37629
   22    20 S   C    _C2_    22     1.53533   108.63798  -114.08679
   23    22 S   O    _O2_    23     1.23055   122.28050  -148.32472
   24    20 S   CT   _CB2    32     1.53299   111.58950   123.36809
   25    24 S   HC   HB21    33     1.09591   110.20066    56.01924
   26    24 S   HC   HB22    34     1.09498   110.10243   175.14667
   27    22 S   N    _N3_    24     1.38327   113.69477    39.15435
   28    27 S   H    _HN3    25     1.01591   119.58904    -3.41862
   29    24 S   S    _SG2    35     1.82698   111.60870   -64.92998
   30    27 S   CT   _CA3    26     1.45287   123.19479   177.08415
   31    30 S   HC   HA31    27     1.09549   107.51540   -64.40239
   32    30 S   HC   HA32    28     1.09557   107.97659    52.03180
   33    29 S   CT   _C9_    36     1.82891    99.01784   176.25566
   34    33 S   HC   _H5_    37     1.09555   105.76581   -60.89661
   35    30 S   CO3  _C3_    29     1.52955   114.08884   174.02473
   36    35 S   O2Z  _O31    30     1.26374   116.06753    -0.66441
   37    35 S   O2Z  _O32    31     1.26428   114.41204   179.39477
   38    33 S   CT   _C8_    38     1.53217   112.37838  -177.73177
   39    38 S   HC   _H9_    39     1.09989   107.21578   167.82243
   40    38 S   HC   _H10    40     1.09729   110.95635    51.76109
   41    38 S   CT1  _C7_    41     1.52695   112.46554   -73.06622
   42    41 S   HC   _H4_    42     1.09516   111.34532    67.98179
   43    41 S   CO4  _C6_    43     1.52010   108.85753   -50.83935
   44    43 S   O    _O33    44     1.23069   122.78358  -138.07507
   45    41 S   NT   _N4_    52     1.46114   109.98515  -170.82320
   46    45 S   H    _H11    53     1.01911   109.71558   -64.06570
   47    45 S   H    _H12    54     1.01978   109.51590   179.46624
   48    43 S   CT   _C5_    45     1.52820   114.80842    47.54751
   49    48 S   HC   _H3_    46     1.09577   107.92752    72.31327
   50    33 S   OS   _O34    47     1.43177   114.25698    55.56044
   51    48 S   CT   _C4_    48     1.52235   111.59322  -168.61659
   52    51 S   HC   _H6_    49     1.09600   110.90323    60.68739
   53    51 S   HC   _H7_    50     1.09455   111.54341   -60.03673
   54    51 S   HC   _H8_    51     1.09537   110.52519   179.04858
  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  11   6   5  10   6  11   5   3   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    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    48    50  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    48    49    50    51    45  
   38    39    40    41    48    50  
   36    37  
   37  
    0  
   39    40    41    42    43    44    48    50    45    46    47  
   40    41    42    43    50    45  
   41    42    43    50    45  
   42    43    44    48    49    50    51    45    46    47  
   43    44    48    45    46    47  
   44    48    49    50    51    52    53    54    45    46    47  
   48    49    50    51    45  
   46    47    48  
   47  
    0  
   49    50    51    52    53    54  
   50    51    52    53    54  
   51    52    53    54  
   52    53    54  
   53    54  
   54  
    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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.163900   1.9750   1.7500   0.005000000  -0.741685710
   42   2.4200   0.0150   0.060000   1.4250   1.2500   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   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
   46   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   47   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5000   0.0660   0.218000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   51   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
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    50   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   305.000  1.457
   43    44   570.000  1.229
   43    48   317.000  1.522
   48    49   340.000  1.090
   48    50   320.000  1.410
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   340.000  1.090
   45    46   434.000  1.010
   45    47   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    50    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    50    48    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  111.22000
   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    48    65.00000  117.09000
   41    45    46    50.00000  111.55300
   41    45    47    50.00000  111.55300
   43    41    42    45.00000  110.09800
   43    48    49    35.00000  109.50000
   43    48    50    90.00000  108.74100
   43    48    51    63.00000  111.10000
   48    43    44    80.00000  120.40000
   48    51    52    37.50000  110.70000
   48    51    53    37.50000  110.70000
   48    51    54    37.50000  110.70000
   50    33    34    35.00000  109.50000
   50    33    38    50.00000  109.50000
   50    48    49    35.00000  109.50000
   51    48    49    37.50000  110.70000
   51    48    50    50.00000  109.50000
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    33.00000  107.80000
   45    41    42    50.00000  109.55000
   45    41    43    75.00000  112.91400
   47    45    46    43.60000  106.40000
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    50   0.13850  1.0 1.0
   24    29    33    50  -1.34450 -1.0 2.0
   24    29    33    50   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    50    48   0.14700  1.0 1.0
   29    33    50    48  -1.16150 -1.0 2.0
   29    33    50    48   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   1.85550  1.0 1.0
   33    38    41    45  -0.84100 -1.0 2.0
   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    50    48   0.37050  1.0 3.0
   38    33    50    48   0.06250  1.0 1.0
   38    33    50    48  -0.01100 -1.0 2.0
   38    33    50    48   0.28050  1.0 3.0
   38    41    43    44   0.00000  1.0 1.0
   38    41   -43    48   0.60050  1.0 1.0
   38    41   -43    48   0.05600 -1.0 2.0
   38    41   -43    48   0.26150  1.0 3.0
   38    41    45    46  -0.05950  1.0 1.0
   38    41    45    46   0.08850 -1.0 2.0
   38    41    45    46   0.11750  1.0 3.0
   38    41    45    47  -0.05950  1.0 1.0
   38    41    45    47   0.08850 -1.0 2.0
   38    41    45    47   0.11750  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   0.15000  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   0.15000  1.0 3.0
   41    43    48    49   0.00000  1.0 1.0
   41    43    48    50   0.55300  1.0 1.0
   41    43    48    50   1.25850 -1.0 2.0
   41    43    48    50  -0.23600  1.0 3.0
   41    43    48    51   0.60050  1.0 1.0
   41    43    48    51   0.05600 -1.0 2.0
   41    43    48    51   0.26150  1.0 3.0
   42    41    43    44   0.00000  1.0 1.0
   42    41    43    48   0.00000  1.0 1.0
   42    41    45    46   0.20000  1.0 3.0
   42    41    45    47   0.20000  1.0 3.0
   43    41    45    46   0.21900  1.0 1.0
   43    41    45    46  -0.24900 -1.0 2.0
   43    41    45    46   0.15200  1.0 3.0
   43    41    45    47   0.21900  1.0 1.0
   43    41    45    47  -0.24900 -1.0 2.0
   43    41    45    47   0.15200  1.0 3.0
   43    48   -50    33  -1.11000  1.0 1.0
   43    48   -50    33   0.50250 -1.0 2.0
   43    48   -50    33   0.47450  1.0 3.0
   43    48    51    52  -0.11250  1.0 3.0
   43    48    51    53  -0.11250  1.0 3.0
   43    48    51    54  -0.11250  1.0 3.0
   44    43    48    49   0.00000  1.0 1.0
   44    43    48    50   0.30150 -1.0 2.0
   44    43    48    51   0.30150 -1.0 2.0
   49    48    50    33   0.37050  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    53   0.15000  1.0 3.0
   49    48    51    54   0.15000  1.0 3.0
   50    33    38    39   0.23400  1.0 3.0
   50    33    38    40   0.23400  1.0 3.0
   50    33   -38    41   0.62750  1.0 1.0
   50    33   -38    41  -0.30950 -1.0 2.0
   50    33   -38    41   0.27300  1.0 3.0
   50    48    51    52   0.23400  1.0 3.0
   50    48    51    53   0.23400  1.0 3.0
   50    48    51    54   0.23400  1.0 3.0
   51    48    50    33   0.06250  1.0 1.0
   51    48    50    33  -0.01100 -1.0 2.0
   51    48    50    33   0.28050  1.0 3.0
   45    41    43    44   0.30150 -1.0 2.0
   45    41    43    48  -0.05600  1.0 1.0
   45    41    43    48   0.24350 -1.0 2.0
   45    41    43    48   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    48    43    44  10.50000 -1.0 2.0
END
