* LIGAND DATABASE FILE (OPLS2005)
*
001      58    58    104    150     300
    1     0 S   NP   _N1_     1    28.05224    95.83752   -22.99446
    2     1 S   H    _HN1     2     1.02957    81.30270    -5.09301
    3     1 S   H    _H1_     3     1.02834    29.95078   144.18525
    4     1 S   H    _H2_     4     1.02777   102.77760  -112.06373
    5     1 S   CT   _CA1     5     1.50152   136.04926   105.29588
    6     5 S   HC   _HA1     6     1.09577   105.17887    78.74814
    7     5 S   CO3  _C1_     7     1.53758   112.34757   -41.36416
    8     7 S   O2Z  _O11     8     1.26365   114.97904   -43.58275
    9     7 S   O2Z  _O12     9     1.26230   114.91794   135.35225
   10     5 S   CT   _CB1    10     1.53078   107.39767  -163.39755
   11    10 S   HC   HB11    11     1.09831   109.23014   -50.54556
   12    10 S   HC   HB12    12     1.09814   110.46713    65.97614
   13    10 S   CT   _CG1    13     1.53038   112.73134  -171.61770
   14    13 S   HC   HG11    14     1.09590   110.52841   -66.27739
   15    13 S   HC   HG12    15     1.09663   109.87931    52.94273
   16    13 S   C    _CD1    16     1.51860   112.23276   173.23572
   17    16 S   O    _OE1    17     1.22767   123.24810     2.97223
   18    16 S   N    _N2_    18     1.38558   111.79562  -176.88756
   19    18 S   H    _HN2    19     1.01551   119.13581     3.30512
   20    18 S   CT1  _CA2    20     1.45860   122.78393   177.17423
   21    20 S   HC   _HA2    21     1.09723   108.85988    26.60284
   22    20 S   C    _C2_    22     1.52941   106.77383   -90.50895
   23    22 S   O    _O2_    23     1.23004   122.98042   -29.44305
   24    20 S   CT   _CB2    32     1.53171   112.39315   149.94145
   25    24 S   HC   HB21    33     1.09574   109.99594    54.05242
   26    24 S   HC   HB22    34     1.09495   109.88989   172.86716
   27    22 S   N    _N3_    24     1.38502   112.67725   153.18992
   28    27 S   H    _HN3    25     1.01661   120.36072    -1.43258
   29    24 S   S    _SG2    35     1.82900   110.99859   -66.62431
   30    27 S   CT   _CA3    26     1.45359   122.38494   178.79066
   31    30 S   HC   HA31    27     1.09568   107.60905   -60.11151
   32    30 S   HC   HA32    28     1.09570   107.76894    56.16824
   33    29 S   CT   _C9_    36     1.84585   100.37860  -179.12732
   34    33 S   OM   _O35    37     1.32044   108.91755    74.92606
   35    30 S   CO3  _C3_    29     1.52876   114.46057   178.09895
   36    35 S   O2Z  _O31    30     1.26320   116.12036    -0.23903
   37    35 S   O2Z  _O32    31     1.26459   114.38736   179.79158
   38    33 S   CT   _C8_    38     1.54471   111.12221  -163.52363
   39    38 S   HC   _H5_    39     1.09653   115.02826   -90.83067
   40    38 S   CO4  _C7_    40     1.50114   100.26113   149.29618
   41    40 S   O    _O33    41     1.22475   124.78683   165.04434
   42    38 S   OS   _O36    54     1.42533   112.90778    40.78332
   43    40 S   CT   _C6_    42     1.50588   111.13799   -16.52511
   44    43 S   HC   _H4_    43     1.09547   109.01187   112.65818
   45    42 S   SY   _S1_    55     1.63875   119.89992  -136.30279
   46    45 S   OY   _O39    56     1.46163   104.48065   -60.70362
   47    45 S   OY   _O37    57     1.46180   103.47368   179.58551
   48    45 S   OY   _O38    58     1.46175   104.52540    59.81209
   49    33 S   OS   _O34    44     1.44360   110.74315   -47.34230
   50    43 S   CT   _C5_    45     1.52476   113.62760  -121.73538
   51    50 S   HC   _H3_    46     1.09562   110.49239   -59.90614
   52    50 S   CT   _C4_    47     1.52837   111.48289   177.41018
   53    52 S   HC   _H6_    48     1.09497   111.39597   -71.44503
   54    52 S   HC   _H7_    49     1.09445   111.00048    50.86810
   55    50 S   OH   _O40    52     1.43170   109.91663    57.37537
   56    55 S   HO   _H8_    53     0.97371   107.50780    49.20502
   57    52 S   OH   _O41    50     1.42477   109.23551   169.68783
   58    57 S   HO   _H9_    51     0.97227   107.00129   178.58142
  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
  11   6   2   1   1  12   6  10   5   6  10   5   3   2   1   1
   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    49    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    49    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    43    44    49    50    42    45  
   38    39    40    43    49    42  
   36    37  
   37  
    0  
   39    40    41    43    44    49    50    42    45    46    47    48  
   40    41    43    49    42    45  
   41    43    44    49    50    51    52    55    42    45  
   43    44    49    50    42  
   45    46    47    48    43    49  
   44    49    50    51    52    53    54    57    55    56  
   49    50    51    52    55  
   46    47    48  
   47    48  
   48  
    0  
   50    51    52    55  
   51    52    53    54    57    58    55    56  
   52    53    54    57    55    56  
   53    54    57    58    55    56  
   54    57    58    55  
   57    58    55  
   56    57  
    0  
   58  
    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   0.571400   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -1.222500   1.7825   1.5750   0.001000000  -0.126889456
   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   0.111100   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   2.9000   0.1400  -0.500300   1.7660   1.5600   0.020110767  -0.896042159
   43   3.5000   0.0660   0.218000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.4200   0.0150   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5500   0.2500   1.628500   2.0025   1.7750   0.025682759  -1.666211680
   46   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   47   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   48   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   49   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.145000   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   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
   57   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   58   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   570.000  1.307
   33    38   268.000  1.529
   33    49   320.000  1.410
   38    39   340.000  1.090
   38    40   317.000  1.522
   38    42   320.000  1.410
   40    41   570.000  1.229
   40    43   317.000  1.522
   43    44   340.000  1.090
   43    49   320.000  1.410
   43    50   268.000  1.529
   50    51   340.000  1.090
   50    52   268.000  1.529
   50    55   320.000  1.410
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    57   320.000  1.410
   57    58   553.000  0.945
   55    56   553.000  0.945
   42    45   335.000  1.682
   45    46   735.000  1.471
   45    47   735.000  1.471
   45    48   735.000  1.471
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    85.00000  114.68000
   29    33    38    75.00000  111.63000
   29    33    49    85.00000  114.68000
   33    38    39    37.50000  110.70000
   33    38    40    63.00000  111.10000
   33    38    42    50.00000  109.50000
   33    49    43    60.00000  109.50000
   38    33    34    50.00000  109.50000
   38    40    41    80.00000  120.40000
   38    40    43    70.00000  116.00000
   38    42    45   100.00000  113.05000
   40    38    39    35.00000  109.50000
   40    43    44    35.00000  109.50000
   40    43    49    90.00000  108.74100
   40    43    50    63.00000  111.10000
   43    40    41    80.00000  120.40000
   43    50    51    37.50000  110.70000
   43    50    52    58.35000  112.70000
   43    50    55    50.00000  109.50000
   49    33    34   110.00000  112.65000
   49    33    38    50.00000  109.50000
   49    43    44    35.00000  109.50000
   50    43    44    37.50000  110.70000
   50    43    49    50.00000  109.50000
   50    52    53    37.50000  110.70000
   50    52    54    37.50000  110.70000
   50    52    57    50.00000  109.50000
   50    55    56    55.00000  108.50000
   52    50    51    37.50000  110.70000
   52    57    58    55.00000  108.50000
   54    52    53    33.00000  107.80000
   57    52    53    35.00000  109.50000
   57    52    54    35.00000  109.50000
   55    50    51    35.00000  109.50000
   55    50    52    50.00000  109.50000
   42    38    39    35.00000  109.50000
   42    38    40    90.00000  108.74100
   42    45    46   135.00000  106.70400
   42    45    47   135.00000  106.70400
   42    45    48   135.00000  106.70400
   47    45    46   115.00000  120.17200
   48    45    46   115.00000  120.17200
   48    45    47   115.00000  120.17200
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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  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    49   0.13850  1.0 1.0
   24    29    33    49  -1.34450 -1.0 2.0
   24    29    33    49   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   0.56750  1.0 1.0
   29    33    38    40  -0.07550 -1.0 2.0
   29    33    38    40   0.20000  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    49    43   0.14700  1.0 1.0
   29    33    49    43  -1.16150 -1.0 2.0
   29    33    49    43   0.48700  1.0 3.0
   33    38    40    41   0.30150 -1.0 2.0
   33    38   -40    43   0.60050  1.0 1.0
   33    38   -40    43   0.05600 -1.0 2.0
   33    38   -40    43   0.26150  1.0 3.0
   33    38    42    45   0.37500  1.0 3.0
   34    33    38    39   0.23400  1.0 3.0
   34    33    38    40  -0.09450  1.0 1.0
   34    33    38    40  -1.12950 -1.0 2.0
   34    33    38    40   0.54000  1.0 3.0
   34    33    38    42   1.11900  1.0 1.0
   34    33    38    42  -1.16350 -1.0 2.0
   34    33    38    42  -0.34150  1.0 3.0
   34    33    49    43  -0.11650  1.0 1.0
   34    33    49    43  -1.14850 -1.0 2.0
   34    33    49    43   0.58850  1.0 3.0
   38    33   -49    43   0.06250  1.0 1.0
   38    33   -49    43  -0.01100 -1.0 2.0
   38    33   -49    43   0.28050  1.0 3.0
   38    40    43    44   0.00000  1.0 1.0
   38    40   -43    49   0.55300  1.0 1.0
   38    40   -43    49   1.25850 -1.0 2.0
   38    40   -43    49  -0.23600  1.0 3.0
   38    40    43    50   0.60050  1.0 1.0
   38    40    43    50   0.05600 -1.0 2.0
   38    40    43    50   0.26150  1.0 3.0
   38    42    45    46   0.29800  1.0 3.0
   38    42    45    47   0.29800  1.0 3.0
   38    42    45    48   0.29800  1.0 3.0
   39    38    40    41   0.00000  1.0 1.0
   39    38    40    43   0.00000  1.0 1.0
   39    38    42    45   0.00000  1.0 1.0
   40    38    42    45   0.37500  1.0 3.0
   40    43   -49    33  -1.11000  1.0 1.0
   40    43   -49    33   0.50250 -1.0 2.0
   40    43   -49    33   0.47450  1.0 3.0
   40    43    50    51  -0.11250  1.0 3.0
   40    43    50    52  -0.95700  1.0 1.0
   40    43    50    52  -0.18200 -1.0 2.0
   40    43    50    52   0.29450  1.0 3.0
   40    43    50    55  -0.09450  1.0 1.0
   40    43    50    55  -1.12950 -1.0 2.0
   40    43    50    55   0.54000  1.0 3.0
   41    40    43    44   0.00000  1.0 1.0
   41    40    43    49   0.30150 -1.0 2.0
   41    40    43    50   0.30150 -1.0 2.0
   43    50    52    53   0.15000  1.0 3.0
   43    50    52    54   0.15000  1.0 3.0
   43    50    52    57   0.86500  1.0 1.0
   43    50    52    57  -0.17500 -1.0 2.0
   43    50    52    57   0.20800  1.0 3.0
   43    50    55    56  -0.11600  1.0 1.0
   43    50    55    56  -0.09450 -1.0 2.0
   43    50    55    56   0.21250  1.0 3.0
   44    43    49    33   0.37050  1.0 3.0
   44    43    50    51   0.15000  1.0 3.0
   44    43    50    52   0.15000  1.0 3.0
   44    43    50    55   0.23400  1.0 3.0
   49    33    38    39   0.23400  1.0 3.0
   49    33   -38    40  -0.09450  1.0 1.0
   49    33   -38    40  -1.12950 -1.0 2.0
   49    33   -38    40   0.54000  1.0 3.0
   49    33    38    42   1.11900  1.0 1.0
   49    33    38    42  -1.16350 -1.0 2.0
   49    33    38    42  -0.34150  1.0 3.0
   49    43    50    51   0.23400  1.0 3.0
   49    43    50    52   0.62750  1.0 1.0
   49    43    50    52  -0.30950 -1.0 2.0
   49    43    50    52   0.27300  1.0 3.0
   49    43    50    55   3.69350  1.0 1.0
   49    43    50    55  -1.82950 -1.0 2.0
   50    43    49    33   0.06250  1.0 1.0
   50    43    49    33  -0.01100 -1.0 2.0
   50    43    49    33   0.28050  1.0 3.0
   50    52    57    58  -0.11600  1.0 1.0
   50    52    57    58  -0.09450 -1.0 2.0
   50    52    57    58   0.21250  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    54   0.15000  1.0 3.0
   51    50    52    57   0.23400  1.0 3.0
   51    50    55    56   0.19450  1.0 3.0
   52    50    55    56  -0.11600  1.0 1.0
   52    50    55    56  -0.09450 -1.0 2.0
   52    50    55    56   0.21250  1.0 3.0
   53    52    57    58   0.19450  1.0 3.0
   54    52    57    58   0.19450  1.0 3.0
   55    50    52    53   0.23400  1.0 3.0
   55    50    52    54   0.23400  1.0 3.0
   55    50    52    57   3.75450  1.0 1.0
   42    38    40    41   0.30150 -1.0 2.0
   42    38    40    43   0.55300  1.0 1.0
   42    38    40    43   1.25850 -1.0 2.0
   42    38    40    43  -0.23600  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
   38    43    40    41  10.50000 -1.0 2.0
END
