* LIGAND DATABASE FILE (OPLS2005)
*
001      64    64    113    154     318
    1     0 S   NP   _N1_     1    28.20721    95.20598   -23.03264
    2     1 S   H    _HN1     2     1.02958    83.97396    -2.08525
    3     1 S   H    _H1_     3     1.02836    27.20612   146.15135
    4     1 S   H    _H2_     4     1.02777   102.81593  -109.56773
    5     1 S   CT   _CA1     5     1.50132   134.25999   110.64013
    6     5 S   HC   _HA1     6     1.09575   105.21693    75.64615
    7     5 S   CO3  _C1_     7     1.53786   112.35765   -44.54658
    8     7 S   O2Z  _O11     8     1.26366   114.99295   -44.02145
    9     7 S   O2Z  _O12     9     1.26234   114.93140   135.06770
   10     5 S   CT   _CB1    10     1.53096   107.42128  -166.44688
   11    10 S   HC   HB11    11     1.09826   109.33330   -50.52041
   12    10 S   HC   HB12    12     1.09816   110.42941    66.03670
   13    10 S   CT   _CG1    13     1.53013   112.66796  -171.59080
   14    13 S   HC   HG11    14     1.09599   110.49065   -64.32704
   15    13 S   HC   HG12    15     1.09656   109.92679    54.87081
   16    13 S   C    _CD1    16     1.51840   112.31836   175.23893
   17    16 S   O    _OE1    17     1.22747   123.30140     0.11869
   18    16 S   N    _N2_    18     1.38524   111.68157  -179.91377
   19    18 S   H    _HN2    19     1.01569   119.02553     4.52273
   20    18 S   CT1  _CA2    20     1.45876   122.96412   178.19626
   21    20 S   HC   _HA2    21     1.09705   109.00797    23.31710
   22    20 S   C    _C2_    22     1.52805   106.74525   -94.11438
   23    22 S   O    _O2_    23     1.22998   122.86369   -33.22738
   24    20 S   CT   _CB2    32     1.53133   111.94449   146.58677
   25    24 S   HC   HB21    33     1.09485   109.66798    52.94692
   26    24 S   HC   HB22    34     1.09497   110.13901   171.73226
   27    22 S   N    _N3_    24     1.38467   112.68643   149.44430
   28    27 S   H    _HN3    25     1.01637   120.34058    -2.25012
   29    24 S   S    _SG2    35     1.82976   110.58026   -68.43460
   30    27 S   CT   _CA3    26     1.45353   122.43518   178.37502
   31    30 S   HC   HA31    27     1.09573   107.38228   -62.73936
   32    30 S   HC   HA32    28     1.09558   108.01098    53.56141
   33    29 S   CT   _C9_    36     1.84570   101.01522   164.24186
   34    33 S   Cl   Cl3_    37     1.80715   107.94257   171.36630
   35    30 S   CO3  _C3_    29     1.52878   114.35592   175.35329
   36    35 S   O2Z  _O31    30     1.26329   116.05560   -10.92752
   37    35 S   O2Z  _O32    31     1.26433   114.44797   169.16922
   38    33 S   CM   _C10    38     1.52132   111.79526   -69.04771
   39    38 S   Cl   Cl2_    39     1.73682   118.42062   -56.61386
   40    38 S   CM   _C11    40     1.34256   122.74040   124.03544
   41    40 S   HC   _H13    41     1.08457   121.95607   179.71264
   42    40 S   CM   _C12    42     1.44071   118.81636    -0.23821
   43    42 S   Cl   Cl1_    43     1.72362   118.08681  -179.04571
   44    42 S   CMA  _C8_    44     1.34743   118.56137     0.60555
   45    33 S   NM   _N4_    45     1.47549   108.76652    59.24128
   46    44 S   OS   _O35    46     1.39441   117.46168  -179.26858
   47    46 S   P1   _P1_    47     1.62260   129.16225   175.18521
   48    47 S   ST   _S1_    48     1.94917   117.32965    68.43640
   49    47 S   OS   _O33    49     1.62816   101.00644  -164.80694
   50    47 S   OS   _O34    57     1.62565   101.90794   -61.04403
   51    49 S   CT   _C5_    50     1.42103   119.57648   -64.20056
   52    51 S   HC   _H6_    51     1.09386   109.23101   -70.90627
   53    51 S   HC   _H7_    52     1.09419   109.91671    48.61708
   54    50 S   CT   _C6_    58     1.41931   119.90933  -169.80489
   55    54 S   HC   _H8_    59     1.09380   109.38550   -67.65062
   56    54 S   HC   _H9_    60     1.09413   109.76559    51.95280
   57    51 S   CT   _C4_    53     1.51449   108.54984   169.05153
   58    57 S   HC   _H3_    54     1.09505   110.59099   -59.41811
   59    57 S   HC   _H4_    55     1.09504   110.63404    58.83200
   60    57 S   HC   _H5_    56     1.09354   110.92291   179.72517
   61    54 S   CT   _C7_    61     1.51392   108.37549   172.33691
   62    61 S   HC   _H10    62     1.09496   110.54559   -58.94299
   63    61 S   HC   _H11    63     1.09504   110.57969    59.25789
   64    61 S   HC   _H12    64     1.09345   110.97632  -179.85598
  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   7   5   4   3
   9   5   2   1   1   7   4   6   3   5   3   6   2   6  11   4
   9   8   6   5   4   6   5   4   3   2   1   1   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    45    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    44    45    46  
   38    39    40    44    45  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45  
   40    41    42    45  
   41    42    43    44    45    46  
   42    43    44  
   43    44    45    46    47  
   44    45    46  
   45    46    47    48    49    50  
   46    47  
   47    48    49    51    50    54  
   48    49    51    52    53    57    50    54    55    56    61  
   49    51    50    54  
   51    52    53    57    58    59    60    50    54  
   54    55    56    61    62    63    64    51  
   52    53    57    58    59    60  
   53    57    58    59    60  
   57    58    59    60  
   55    56    61    62    63    64  
   56    61    62    63    64  
   61    62    63    64  
   58    59    60  
   59    60  
   60  
    0  
   62    63    64  
   63    64  
   64  
    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  -0.175000   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   0.330000   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   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   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760  -0.499200   2.0020   1.7750   0.023028004  -0.852763146
   43   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   44   3.5500   0.0760   0.826700   2.0020   1.7750   0.023028004  -0.852763146
   45   3.4200   0.1700  -1.245000   1.9310   1.7100   0.005000000   0.000000000
   46   2.8500   0.1400  -0.273200   1.5900   1.4000   0.020110767  -0.896042159
   47   3.7400   0.2000   1.154100   2.1070   1.8700   0.005000000   0.000000000
   48   4.2500   0.5000  -0.589500   2.3875   2.1250   0.025682759  -1.666211680
   49   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   50   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   51   3.5000   0.0660   0.152900   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   3.5000   0.0660   0.152900   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   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   245.000  1.781
   33    38   317.000  1.510
   33    45   320.000  1.444
   38    39   300.000  1.725
   38    40   549.000  1.340
   40    41   340.000  1.080
   40    42   380.000  1.444
   42    43   300.000  1.725
   42    44   465.000  1.376
   44    45   500.000  1.344
   44    46   440.000  1.360
   46    47   405.000  1.623
   47    48   270.000  1.959
   47    49   405.000  1.623
   47    50   405.000  1.623
   49    51   320.000  1.410
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   50    54   320.000  1.410
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
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  110.65400
   29    33    38    75.00000  112.20000
   29    33    45    85.00000  109.00000
   33    38    39    75.00000  111.02000
   33    38    40    70.00000  124.00000
   33    45    44    70.00000  118.22000
   38    33    34    75.00000  111.90500
   38    40    41    35.00000  120.00000
   38    40    42    70.00000  123.01800
   40    38    39    75.00000  121.50000
   40    42    43    75.00000  121.50000
   40    42    44    70.00000  117.34000
   42    40    41    35.00000  120.00000
   42    44    45    65.00000  126.19400
   42    44    46    80.00000  120.01400
   44    42    43    60.00000  123.80000
   44    46    47    80.00000  120.00000
   45    33    34    85.00000  105.00000
   45    33    38    75.00000  116.00000
   46    44    45    65.00000  121.00000
   46    47    48    80.00000  117.31900
   46    47    49   120.00000  102.38000
   46    47    50   120.00000  102.38000
   47    49    51    75.00000  119.24600
   47    50    54    75.00000  119.24600
   49    47    48    80.00000  117.31900
   49    51    52    35.00000  109.50000
   49    51    53    35.00000  109.50000
   49    51    57    50.00000  109.50000
   51    57    58    37.50000  110.70000
   51    57    59    37.50000  110.70000
   51    57    60    37.50000  110.70000
   53    51    52    33.00000  107.80000
   57    51    52    37.50000  110.70000
   57    51    53    37.50000  110.70000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   50    47    48    80.00000  117.31900
   50    47    49   120.00000  102.38000
   50    54    55    35.00000  109.50000
   50    54    56    35.00000  109.50000
   50    54    61    50.00000  109.50000
   54    61    62    37.50000  110.70000
   54    61    63    37.50000  110.70000
   54    61    64    37.50000  110.70000
   56    54    55    33.00000  107.80000
   61    54    55    37.50000  110.70000
   61    54    56    37.50000  110.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  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    38    39   0.09700  1.0 1.0
   29    33    38    39   0.15600 -1.0 2.0
   29    33    38    39  -0.50800  1.0 3.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    45    44   0.00000  1.0 1.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   34    33    38    39   0.09700  1.0 1.0
   34    33    38    39   0.15600 -1.0 2.0
   34    33    38    39  -0.50800  1.0 3.0
   34    33    38    40   0.09700  1.0 1.0
   34    33    38    40   0.15600 -1.0 2.0
   34    33    38    40  -0.50800  1.0 3.0
   34    33    45    44   0.00000  1.0 1.0
   38    33    45    44   0.00000  1.0 1.0
   38    40    42    43  -0.18600  1.0 3.0
   38    40   -42    44   0.28850  1.0 1.0
   38    40   -42    44   2.61350 -1.0 2.0
   38    40   -42    44   0.78400  1.0 3.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    44    45   7.00000 -1.0 2.0
   40    42    44    46   7.00000 -1.0 2.0
   41    40    42    43   0.00000  1.0 1.0
   41    40    42    44  -0.18600  1.0 3.0
   42    44   -45    33   0.00000  1.0 1.0
   42    44    46    47   2.00000 -1.0 2.0
   43    42    44    45   7.00000 -1.0 2.0
   43    42    44    46   7.00000 -1.0 2.0
   44    46    47    48   0.15000  1.0 3.0
   44    46    47    49   0.88300  1.0 1.0
   44    46    47    49   0.16450 -1.0 2.0
   44    46    47    49   0.32850  1.0 3.0
   44    46    47    50   0.88300  1.0 1.0
   44    46    47    50   0.16450 -1.0 2.0
   44    46    47    50   0.32850  1.0 3.0
   45    33    38    39   0.09700  1.0 1.0
   45    33    38    39   0.15600 -1.0 2.0
   45    33    38    39  -0.50800  1.0 3.0
   45    33   -38    40   0.09700  1.0 1.0
   45    33   -38    40   0.15600 -1.0 2.0
   45    33   -38    40  -0.50800  1.0 3.0
   45    44    46    47   2.00000 -1.0 2.0
   46    44    45    33   0.00000  1.0 1.0
   46    47    49    51   0.91800  1.0 1.0
   46    47    49    51   0.22900 -1.0 2.0
   46    47    49    51   0.32050  1.0 3.0
   46    47    50    54   0.91800  1.0 1.0
   46    47    50    54   0.22900 -1.0 2.0
   46    47    50    54   0.32050  1.0 3.0
   47    49    51    52   0.03000  1.0 3.0
   47    49    51    53   0.03000  1.0 3.0
   47    49    51    57  -2.65550  1.0 1.0
   47    49    51    57  -0.22350 -1.0 2.0
   47    49    51    57   0.24150  1.0 3.0
   47    50    54    55   0.03000  1.0 3.0
   47    50    54    56   0.03000  1.0 3.0
   47    50    54    61  -2.65550  1.0 1.0
   47    50    54    61  -0.22350 -1.0 2.0
   47    50    54    61   0.24150  1.0 3.0
   48    47    49    51   0.15000  1.0 3.0
   48    47    50    54   0.15000  1.0 3.0
   49    47    50    54   0.91800  1.0 1.0
   49    47    50    54   0.22900 -1.0 2.0
   49    47    50    54   0.32050  1.0 3.0
   49    51    57    58   0.23400  1.0 3.0
   49    51    57    59   0.23400  1.0 3.0
   49    51    57    60   0.23400  1.0 3.0
   52    51    57    58   0.15000  1.0 3.0
   52    51    57    59   0.15000  1.0 3.0
   52    51    57    60   0.15000  1.0 3.0
   53    51    57    58   0.15000  1.0 3.0
   53    51    57    59   0.15000  1.0 3.0
   53    51    57    60   0.15000  1.0 3.0
   50    47    49    51   0.91800  1.0 1.0
   50    47    49    51   0.22900 -1.0 2.0
   50    47    49    51   0.32050  1.0 3.0
   50    54    61    62   0.23400  1.0 3.0
   50    54    61    63   0.23400  1.0 3.0
   50    54    61    64   0.23400  1.0 3.0
   55    54    61    62   0.15000  1.0 3.0
   55    54    61    63   0.15000  1.0 3.0
   55    54    61    64   0.15000  1.0 3.0
   56    54    61    62   0.15000  1.0 3.0
   56    54    61    63   0.15000  1.0 3.0
   56    54    61    64   0.15000  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
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   40    43    42    44   1.10000 -1.0 2.0
   45    46    44    42   1.10000 -1.0 2.0
END
