* LIGAND DATABASE FILE (OPLS2005)
*
001      58    60    115    191     341
    1     0 S   NP   _N1_     1    28.64484    94.42595   -21.74720
    2     1 S   H    _HN1     2     1.02776    93.30688   -76.09928
    3     1 S   H    _H1_     3     1.02961    89.69923    32.23686
    4     1 S   H    _H2_     4     1.02834    28.33784   161.10292
    5     1 S   CT   _CA1     5     1.50114   138.93699   153.85619
    6     5 S   HC   _HA1     6     1.09575   105.24430    62.81187
    7     5 S   CO3  _C1_     7     1.53788   112.36276   -57.40147
    8     7 S   O2Z  _O11     8     1.26356   115.00227   -44.60342
    9     7 S   O2Z  _O12     9     1.26238   114.91295   134.57644
   10     5 S   CT   _CB1    10     1.53093   107.42128  -179.30395
   11    10 S   HC   HB11    11     1.09822   109.33085   -51.11376
   12    10 S   HC   HB12    12     1.09821   110.41767    65.43032
   13    10 S   CT   _CG1    13     1.52995   112.66920  -172.24556
   14    13 S   HC   HG11    14     1.09603   110.38767   -63.30516
   15    13 S   HC   HG12    15     1.09646   110.04573    55.91267
   16    13 S   C    _CD1    16     1.51805   112.30919   176.24360
   17    16 S   O    _OE1    17     1.22718   123.29044    -4.41978
   18    16 S   N    _N2_    18     1.38599   111.60857   175.79807
   19    18 S   H    _HN2    19     1.01599   118.97663     1.05906
   20    18 S   CT1  _CA2    20     1.46212   123.42723  -178.88513
   21    20 S   HC   _HA2    21     1.09728   109.44075   -12.53506
   22    20 S   C    _C2_    22     1.53418   108.30210  -128.31055
   23    22 S   O    _O2_    23     1.23017   122.20511  -145.61675
   24    20 S   CT   _CB2    32     1.53470   111.29438   109.67773
   25    24 S   HC   HB21    33     1.09359   109.17563    55.06664
   26    24 S   HC   HB22    34     1.09462   110.19400   173.87747
   27    22 S   N    _N3_    24     1.38487   113.36730    41.69265
   28    27 S   H    _HN3    25     1.01531   118.92173    -0.69717
   29    24 S   S    _SG2    35     1.82501   111.61696   -66.86342
   30    27 S   CT   _CA3    26     1.45458   123.52484   175.15766
   31    30 S   HC   HA31    27     1.09516   109.33936    22.27349
   32    30 S   HC   HA32    28     1.09498   107.09462   139.29639
   33    29 S   CT   _C12    36     1.81178   101.91021   161.65382
   34    30 S   CO3  _C3_    29     1.52920   113.05140  -101.27390
   35    34 S   O2Z  _O31    30     1.26408   115.38416   -44.74558
   36    34 S   O2Z  _O32    31     1.26352   114.99480   136.17091
   37    33 S   CM   _C11    37     1.52326   116.64923   -84.71477
   38    37 S   Cl   Cl5_    38     1.69643   125.18331    23.88213
   39    37 S   CM   _C10    39     1.34005   107.79094  -155.94274
   40    39 S   Cl   Cl6_    40     1.69531   127.75665  -179.96574
   41    39 S   CT   _C9_    41     1.51624   107.94053     0.48295
   42    41 S   Cl   Cl7_    42     1.75176   116.56562   159.75038
   43    41 S   CT   _C6_    43     1.55887   108.92604   -69.85027
   44    43 S   HC   _H4_    44     1.09891   110.79170  -179.15489
   45    33 S   CT   _C13    56     1.58376   112.64242   163.46794
   46    45 S   Cl   Cl3_    57     1.79872   114.88027   -64.94975
   47    45 S   Cl   Cl4_    58     1.81013   115.14651    58.60756
   48    33 S   CT   _C5_    45     1.57115   117.69287    46.75584
   49    48 S   HC   _H3_    46     1.09849   110.63711    43.01695
   50    48 S   CT   _C4_    47     1.53467   120.50065   -84.76768
   51    50 S   HC   _H7_    48     1.09437   112.18275   -20.91445
   52    50 S   HC   _H8_    49     1.09477   111.59057    99.66892
   53    50 S   CT   _C8_    50     1.52957   103.59863  -140.59629
   54    53 S   Cl   Cl1_    51     1.77253   111.66360   163.85414
   55    53 S   HC   _H6_    52     1.09679   110.09880   -76.35696
   56    43 S   CT   _C7_    53     1.53360   118.78643   -50.73313
   57    56 S   Cl   Cl2_    54     1.77547   111.85494   -97.18979
   58    56 S   HC   _H5_    55     1.09306   112.49515    22.65552
  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  12   5   4   3
  18   2   1   1  12   5  10   4  13   7  15   8   6   2   1  10
   5   8   5   4   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    48    45    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41    43    48    49    50    45    46    47  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    42    43    44    48    49    50    51    52    53    56    45    46    47  
   35    36  
   36  
    0  
   38    39    40    41    42    43    48    49    50    45    46    47  
   39    40    41    48    45  
   40    41    42    43    44    48    56    45    46    47  
   41    42    43    45  
   42    43    44    48    49    50    53    56    57    58    45    46    47  
   43    44    48    56    45    46    47  
   44    48    49    50    51    52    53    54    55    56    57    58    45    46    47  
   48    49    50    53    56    57    58    45  
   46    47    48    49    50    56  
   47    48  
   48  
   49    50    51    52    53    54    55    56    57    58  
   50    51    52    53    56  
   51    52    53    54    55    56    57    58  
   52    53    54    55    56  
   53    54    55    56  
   54    55    56    57    58  
   55    56    57    58  
   56    57    58  
   57    58  
   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  -0.335000   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   0.296100   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   39   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   41   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   43   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.143000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   47   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   48   3.5000   0.0660  -0.060000   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  -0.120000   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   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   54   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   55   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   57   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   58   2.5000   0.0300   0.103000   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    48   268.000  1.529
   33    45   268.000  1.529
   37    38   300.000  1.725
   37    39   549.000  1.340
   39    40   300.000  1.725
   39    41   317.000  1.510
   41    42   245.000  1.781
   41    43   268.000  1.529
   41    45   268.000  1.529
   43    44   340.000  1.090
   43    48   268.000  1.529
   43    56   268.000  1.529
   48    49   340.000  1.090
   48    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   268.000  1.529
   53    54   245.000  1.781
   53    55   340.000  1.090
   53    56   268.000  1.529
   56    57   245.000  1.781
   56    58   340.000  1.090
   45    46   245.000  1.781
   45    47   245.000  1.781
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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  112.20000
   29    33    48    75.00000  111.63000
   29    33    45    75.00000  111.63000
   33    37    38    75.00000  111.02000
   33    37    39    70.00000  124.00000
   33    48    43    58.35000  112.70000
   33    48    49    37.50000  110.70000
   33    48    50    58.35000  112.70000
   33    45    41    58.35000  112.70000
   33    45    46    69.00000  109.80000
   33    45    47    69.00000  109.80000
   37    39    40    75.00000  121.50000
   37    39    41    70.00000  124.00000
   39    37    38    75.00000  121.50000
   39    41    42    75.00000  111.90500
   39    41    43    70.00000  112.02700
   39    41    45    70.00000  112.02700
   41    39    40    75.00000  111.02000
   41    43    44    37.50000  110.70000
   41    43    48    58.35000  112.70000
   41    43    56    58.35000  112.70000
   41    45    46    69.00000  109.80000
   41    45    47    69.00000  109.80000
   43    41    42    69.00000  109.80000
   43    48    49    37.50000  110.70000
   43    48    50    58.35000  112.70000
   43    56    53    58.35000  112.70000
   43    56    57    69.00000  109.80000
   43    56    58    37.50000  110.70000
   48    33    37    70.00000  112.02700
   48    43    44    37.50000  110.70000
   48    50    51    37.50000  110.70000
   48    50    52    37.50000  110.70000
   48    50    53    58.35000  112.70000
   50    48    49    37.50000  110.70000
   50    53    54    69.00000  109.80000
   50    53    55    37.50000  110.70000
   50    53    56    58.35000  112.70000
   52    50    51    33.00000  107.80000
   53    50    51    37.50000  110.70000
   53    50    52    37.50000  110.70000
   53    56    57    69.00000  109.80000
   53    56    58    37.50000  110.70000
   55    53    54    51.00000  107.60000
   56    43    44    37.50000  110.70000
   56    43    48    58.35000  112.70000
   56    53    54    69.00000  109.80000
   56    53    55    37.50000  110.70000
   58    56    57    51.00000  107.60000
   45    33    37    70.00000  112.02700
   45    33    48    58.35000  112.70000
   45    41    42    69.00000  109.80000
   45    41    43    58.35000  112.70000
   47    45    46    80.00000  110.42200
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   0.21350  1.0 3.0
   24    29    33    45   0.01700  1.0 1.0
   24    29    33    45  -0.23550 -1.0 2.0
   24    29    33    45   0.21350  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    37    38   0.09700  1.0 1.0
   29    33    37    38   0.15600 -1.0 2.0
   29    33    37    38  -0.50800  1.0 3.0
   29    33    37    39   0.42700  1.0 1.0
   29    33    37    39  -0.70350 -1.0 2.0
   29    33    37    39  -0.43150  1.0 3.0
   29    33    48    43   0.44750  1.0 1.0
   29    33    48    43  -0.17800 -1.0 2.0
   29    33    48    43   0.20200  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    50   0.44750  1.0 1.0
   29    33    48    50  -0.17800 -1.0 2.0
   29    33    48    50   0.20200  1.0 3.0
   29    33    45    41   0.44750  1.0 1.0
   29    33    45    41  -0.17800 -1.0 2.0
   29    33    45    41   0.20200  1.0 3.0
   29    33    45    46   0.56750  1.0 1.0
   29    33    45    46  -0.07550 -1.0 2.0
   29    33    45    46   0.20000  1.0 3.0
   29    33    45    47   0.56750  1.0 1.0
   29    33    45    47  -0.07550 -1.0 2.0
   29    33    45    47   0.20000  1.0 3.0
   33    37    39    40   7.00000 -1.0 2.0
   33    37   -39    41   7.00000 -1.0 2.0
   33    48    50    51   0.15000  1.0 3.0
   33    48    50    52   0.15000  1.0 3.0
   33    48    50    53   0.56750  1.0 1.0
   33    48    50    53  -0.07550 -1.0 2.0
   33    48    50    53   0.20000  1.0 3.0
   37    33    48    43   0.34400  1.0 1.0
   37    33    48    43   0.09450 -1.0 2.0
   37    33    48    43   0.11100  1.0 3.0
   37    33    48    49   0.15000  1.0 3.0
   37    33    48    50   0.34400  1.0 1.0
   37    33    48    50   0.09450 -1.0 2.0
   37    33    48    50   0.11100  1.0 3.0
   37    33   -45    41   0.34400  1.0 1.0
   37    33   -45    41   0.09450 -1.0 2.0
   37    33   -45    41   0.11100  1.0 3.0
   37    33    45    46   0.56750  1.0 1.0
   37    33    45    46  -0.07550 -1.0 2.0
   37    33    45    46   0.20000  1.0 3.0
   37    33    45    47   0.56750  1.0 1.0
   37    33    45    47  -0.07550 -1.0 2.0
   37    33    45    47   0.20000  1.0 3.0
   37    39    41    42   0.09700  1.0 1.0
   37    39    41    42   0.15600 -1.0 2.0
   37    39    41    42  -0.50800  1.0 3.0
   37    39   -41    43   0.09850  1.0 1.0
   37    39   -41    43   0.15250 -1.0 2.0
   37    39   -41    43  -0.50650  1.0 3.0
   37    39   -41    45   0.09850  1.0 1.0
   37    39   -41    45   0.15250 -1.0 2.0
   37    39   -41    45  -0.50650  1.0 3.0
   38    37    39    40   7.00000 -1.0 2.0
   38    37    39    41   7.00000 -1.0 2.0
   39    41    43    44   0.15000  1.0 3.0
   39    41    43    48   0.34400  1.0 1.0
   39    41    43    48   0.09450 -1.0 2.0
   39    41    43    48   0.11100  1.0 3.0
   39    41    43    56   0.34400  1.0 1.0
   39    41    43    56   0.09450 -1.0 2.0
   39    41    43    56   0.11100  1.0 3.0
   39    41   -45    33   0.34400  1.0 1.0
   39    41   -45    33   0.09450 -1.0 2.0
   39    41   -45    33   0.11100  1.0 3.0
   39    41    45    46   0.56750  1.0 1.0
   39    41    45    46  -0.07550 -1.0 2.0
   39    41    45    46   0.20000  1.0 3.0
   39    41    45    47   0.56750  1.0 1.0
   39    41    45    47  -0.07550 -1.0 2.0
   39    41    45    47   0.20000  1.0 3.0
   40    39    41    42   0.09700  1.0 1.0
   40    39    41    42   0.15600 -1.0 2.0
   40    39    41    42  -0.50800  1.0 3.0
   40    39    41    43   0.09700  1.0 1.0
   40    39    41    43   0.15600 -1.0 2.0
   40    39    41    43  -0.50800  1.0 3.0
   40    39    41    45   0.09700  1.0 1.0
   40    39    41    45   0.15600 -1.0 2.0
   40    39    41    45  -0.50800  1.0 3.0
   41    43   -48    33   0.56750  1.0 1.0
   41    43   -48    33  -0.07550 -1.0 2.0
   41    43   -48    33   0.20000  1.0 3.0
   41    43    48    49   0.15000  1.0 3.0
   41    43    48    50   0.56750  1.0 1.0
   41    43    48    50  -0.07550 -1.0 2.0
   41    43    48    50   0.20000  1.0 3.0
   41    43    56    53   0.56750  1.0 1.0
   41    43    56    53  -0.07550 -1.0 2.0
   41    43    56    53   0.20000  1.0 3.0
   41    43    56    57   0.35600  1.0 1.0
   41    43    56    57  -0.14650 -1.0 2.0
   41    43    56    57   0.33350  1.0 3.0
   41    43    56    58   0.15000  1.0 3.0
   42    41    43    44   0.27000  1.0 3.0
   42    41    43    48   0.35600  1.0 1.0
   42    41    43    48  -0.14650 -1.0 2.0
   42    41    43    48   0.33350  1.0 3.0
   42    41    43    56   0.35600  1.0 1.0
   42    41    43    56  -0.14650 -1.0 2.0
   42    41    43    56   0.33350  1.0 3.0
   42    41    45    33   0.35600  1.0 1.0
   42    41    45    33  -0.14650 -1.0 2.0
   42    41    45    33   0.33350  1.0 3.0
   42    41    45    46   0.22500  1.0 1.0
   42    41    45    47   0.22500  1.0 1.0
   43    41   -45    33   0.56750  1.0 1.0
   43    41   -45    33  -0.07550 -1.0 2.0
   43    41   -45    33   0.20000  1.0 3.0
   43    41    45    46   0.35600  1.0 1.0
   43    41    45    46  -0.14650 -1.0 2.0
   43    41    45    46   0.33350  1.0 3.0
   43    41    45    47   0.35600  1.0 1.0
   43    41    45    47  -0.14650 -1.0 2.0
   43    41    45    47   0.33350  1.0 3.0
   43    48    50    51   0.15000  1.0 3.0
   43    48    50    52   0.15000  1.0 3.0
   43    48   -50    53   0.56750  1.0 1.0
   43    48   -50    53  -0.07550 -1.0 2.0
   43    48   -50    53   0.20000  1.0 3.0
   44    43    48    33   0.15000  1.0 3.0
   44    43    48    49   0.15000  1.0 3.0
   44    43    48    50   0.15000  1.0 3.0
   44    43    56    53   0.15000  1.0 3.0
   44    43    56    57   0.27000  1.0 3.0
   44    43    56    58   0.15000  1.0 3.0
   48    33    37    38   0.09700  1.0 1.0
   48    33    37    38   0.15600 -1.0 2.0
   48    33    37    38  -0.50800  1.0 3.0
   48    33   -37    39   0.09850  1.0 1.0
   48    33   -37    39   0.15250 -1.0 2.0
   48    33   -37    39  -0.50650  1.0 3.0
   48    33   -45    41   0.56750  1.0 1.0
   48    33   -45    41  -0.07550 -1.0 2.0
   48    33   -45    41   0.20000  1.0 3.0
   48    33    45    46   0.35600  1.0 1.0
   48    33    45    46  -0.14650 -1.0 2.0
   48    33    45    46   0.33350  1.0 3.0
   48    33    45    47   0.35600  1.0 1.0
   48    33    45    47  -0.14650 -1.0 2.0
   48    33    45    47   0.33350  1.0 3.0
   48    43   -56    53   0.56750  1.0 1.0
   48    43   -56    53  -0.07550 -1.0 2.0
   48    43   -56    53   0.20000  1.0 3.0
   48    43    56    57   0.35600  1.0 1.0
   48    43    56    57  -0.14650 -1.0 2.0
   48    43    56    57   0.33350  1.0 3.0
   48    43    56    58   0.15000  1.0 3.0
   48    50    53    54   0.35600  1.0 1.0
   48    50    53    54  -0.14650 -1.0 2.0
   48    50    53    54   0.33350  1.0 3.0
   48    50    53    55   0.15000  1.0 3.0
   48    50   -53    56   0.56750  1.0 1.0
   48    50   -53    56  -0.07550 -1.0 2.0
   48    50   -53    56   0.20000  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    53   0.15000  1.0 3.0
   50    53   -56    43   0.56750  1.0 1.0
   50    53   -56    43  -0.07550 -1.0 2.0
   50    53   -56    43   0.20000  1.0 3.0
   50    53    56    57   0.35600  1.0 1.0
   50    53    56    57  -0.14650 -1.0 2.0
   50    53    56    57   0.33350  1.0 3.0
   50    53    56    58   0.15000  1.0 3.0
   51    50    53    54   0.27000  1.0 3.0
   51    50    53    55   0.15000  1.0 3.0
   51    50    53    56   0.15000  1.0 3.0
   52    50    53    54   0.27000  1.0 3.0
   52    50    53    55   0.15000  1.0 3.0
   52    50    53    56   0.15000  1.0 3.0
   54    53    56    43   0.35600  1.0 1.0
   54    53    56    43  -0.14650 -1.0 2.0
   54    53    56    43   0.33350  1.0 3.0
   54    53    56    57   0.22500  1.0 1.0
   54    53    56    58   0.27000  1.0 3.0
   55    53    56    43   0.15000  1.0 3.0
   55    53    56    57   0.27000  1.0 3.0
   55    53    56    58   0.15000  1.0 3.0
   56    43    48    33   0.56750  1.0 1.0
   56    43    48    33  -0.07550 -1.0 2.0
   56    43    48    33   0.20000  1.0 3.0
   56    43    48    49   0.15000  1.0 3.0
   56    43   -48    50   0.56750  1.0 1.0
   56    43   -48    50  -0.07550 -1.0 2.0
   56    43   -48    50   0.20000  1.0 3.0
   45    33    37    38   0.09700  1.0 1.0
   45    33    37    38   0.15600 -1.0 2.0
   45    33    37    38  -0.50800  1.0 3.0
   45    33   -37    39   0.09850  1.0 1.0
   45    33   -37    39   0.15250 -1.0 2.0
   45    33   -37    39  -0.50650  1.0 3.0
   45    33   -48    43   0.56750  1.0 1.0
   45    33   -48    43  -0.07550 -1.0 2.0
   45    33   -48    43   0.20000  1.0 3.0
   45    33    48    49   0.15000  1.0 3.0
   45    33    48    50   0.56750  1.0 1.0
   45    33    48    50  -0.07550 -1.0 2.0
   45    33    48    50   0.20000  1.0 3.0
   45    41    43    44   0.15000  1.0 3.0
   45    41   -43    48   0.56750  1.0 1.0
   45    41   -43    48  -0.07550 -1.0 2.0
   45    41   -43    48   0.20000  1.0 3.0
   45    41    43    56   0.56750  1.0 1.0
   45    41    43    56  -0.07550 -1.0 2.0
   45    41    43    56   0.20000  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
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    39   1.10000 -1.0 2.0
   41    40    39    37   1.10000 -1.0 2.0
END
