* LIGAND DATABASE FILE (OPLS2005)
*
001      59    59    105    147     298
    1     0 S   NP   _N1_     1    29.29718    96.47647   -19.44331
    2     1 S   H    _HN1     2     1.02832    52.34579   133.82568
    3     1 S   H    _H1_     3     1.02784    80.53407  -104.72188
    4     1 S   H    _H2_     4     1.02953    74.74699     7.40443
    5     1 S   CT   _CA1     5     1.50102   162.45142   117.09431
    6     5 S   HC   _HA1     6     1.09555   105.27002    73.38273
    7     5 S   CO3  _C1_     7     1.53876   112.47540   -47.10252
    8     7 S   O2Z  _O11     8     1.26386   114.98661   -39.83045
    9     7 S   O2Z  _O12     9     1.26233   115.04620   139.50930
   10     5 S   CT   _CB1    10     1.53097   107.46599  -168.30002
   11    10 S   HC   HB11    11     1.09822   109.75376   -46.86857
   12    10 S   HC   HB12    12     1.09822   110.26115    69.86617
   13    10 S   CT   _CG1    13     1.52954   112.48846  -167.76634
   14    13 S   HC   HG11    14     1.09424   110.54074   -59.40032
   15    13 S   HC   HG12    15     1.09649   109.92236    59.71691
   16    13 S   C    _CD1    16     1.51707   112.34880  -179.69290
   17    16 S   O    _OE1    17     1.22722   123.29110    -0.70914
   18    16 S   N    _N2_    18     1.38634   111.63898   179.26087
   19    18 S   H    _HN2    19     1.01637   119.09238     2.12228
   20    18 S   CT1  _CA2    20     1.46169   123.32706   179.46734
   21    20 S   HC   _HA2    21     1.09731   109.34196     0.58917
   22    20 S   C    _C2_    22     1.53465   108.91026  -115.04460
   23    22 S   O    _O2_    23     1.23061   122.22156  -149.48849
   24    20 S   CT   _CB2    32     1.53286   111.34062   122.40371
   25    24 S   HC   HB21    33     1.09385   109.86757    59.65385
   26    24 S   HC   HB22    34     1.09538   110.39030   177.33090
   27    22 S   N    _N3_    24     1.38317   113.72143    38.08109
   28    27 S   H    _HN3    25     1.01597   119.56424    -3.70761
   29    24 S   S    _SG2    35     1.83143   111.37072   -64.12226
   30    27 S   CT   _CA3    26     1.45286   123.16232   176.97250
   31    30 S   HC   HA31    27     1.09552   107.54125   -63.46158
   32    30 S   HC   HA32    28     1.09557   107.93701    52.95445
   33    29 S   CT   _C9_    36     1.86069   101.06005   131.82341
   34    30 S   CO3  _C3_    29     1.52945   114.11581   174.91246
   35    34 S   O2Z  _O31    30     1.26371   116.06891    -1.08966
   36    34 S   O2Z  _O32    31     1.26433   114.41357   178.96146
   37    33 S   CO4  _C6_    37     1.53540   106.39011   -70.97912
   38    37 S   O    _O10    38     1.23153   123.09247    95.48658
   39    33 S   OS   _O13    55     1.43502   112.31474    44.04817
   40    37 S   CM   _C4_    39     1.48629   118.68580   -82.33643
   41    40 S   HC   _H15    40     1.08571   116.11176   169.32075
   42    39 S   CT   _C12    56     1.42040   116.69652    71.86874
   43    42 S   HC   _H23    57     1.09377   107.83453  -172.07794
   44    42 S   HC   _H24    58     1.09268   111.03610    70.20285
   45    42 S   HC   _H25    59     1.09289   111.85870   -53.39449
   46    40 S   CM   _C5_    41     1.33800   122.69637    -9.07762
   47    46 S   CO4  _C7_    42     1.49046   119.55658    -3.89400
   48    47 S   O    _O33    43     1.23029   120.58505   169.23181
   49    46 S   CT   _C10    51     1.49606   123.01149   176.91219
   50    49 S   HC   _H17    52     1.09497   110.50010   124.03076
   51    49 S   HC   _H18    53     1.09479   111.86288     4.34032
   52    49 S   HC   _H19    54     1.09479   110.45248  -115.77387
   53    33 S   CT   _C8_    44     1.54190   110.29063   170.93429
   54    53 S   HC   _H16    45     1.09761   110.03952   -55.88905
   55    53 S   OS   _O34    46     1.43297   108.82195  -176.14364
   56    55 S   CT   _C11    47     1.42210   113.37690   159.22237
   57    56 S   HC   _H20    48     1.09337   108.14472  -177.93446
   58    56 S   HC   _H21    49     1.09336   111.00282    63.35361
   59    56 S   HC   _H22    50     1.09411   110.58840   -59.33194
  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  10   5   4   3
  16   2   1   1  11   5   9   9   3   4   2   1   1   9   9   4
   4   2   1   1   6   2   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    53    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    47    53    54    55    39    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    46    47    48    53    54    55    56    39    42    43    44    45  
   35    36  
   36  
    0  
   38    40    41    46    47    53    54    55    49    39    42  
   40    41    46    53    39  
   42    43    44    45    40    47    53    54    55  
   41    46    47    48    53    49    50    51    52  
   46    47    49  
   43    44    45    53  
   44    45  
   45  
    0  
   47    48    53    54    55    49    50    51    52  
   48    53    54    55    56    49    50    51    52  
   53    54    55    49  
   50    51    52    53  
   51    52  
   52  
    0  
   54    55    56    57    58    59  
   55    56  
   56    57    58    59  
   57    58    59  
   58    59  
   59  
    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   0.396900   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   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   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   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   47   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   0.218000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   56   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.030000   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  1.522
   33    53   268.000  1.529
   33    39   320.000  1.410
   37    38   570.000  1.229
   37    40   320.000  1.462
   40    41   340.000  1.080
   40    46   549.000  1.340
   46    47   320.000  1.462
   46    49   317.000  1.510
   47    48   570.000  1.229
   47    53   317.000  1.522
   53    54   340.000  1.090
   53    55   320.000  1.410
   55    56   320.000  1.410
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   39    42   320.000  1.410
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   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    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  110.18000
   29    33    53    75.00000  111.63000
   29    33    39    85.00000  114.68000
   33    37    38    80.00000  120.40000
   33    37    40    65.00000  118.62400
   33    53    47    63.00000  111.10000
   33    53    54    37.50000  110.70000
   33    53    55    50.00000  109.50000
   33    39    42    60.00000  109.50000
   37    40    41    40.00000  117.72500
   37    40    46    65.00000  118.96000
   40    37    38    80.00000  123.72100
   40    46    47    65.00000  118.96000
   40    46    49    70.00000  124.00000
   46    40    41    35.00000  120.00000
   46    47    48    80.00000  123.72100
   46    47    53    65.00000  118.62400
   46    49    50    35.00000  109.50000
   46    49    51    35.00000  109.50000
   46    49    52    35.00000  109.50000
   47    53    54    35.00000  109.50000
   47    53    55    90.00000  108.74100
   53    33    37    63.00000  111.10000
   53    47    48    80.00000  120.40000
   53    55    56    60.00000  109.50000
   55    53    54    35.00000  109.50000
   55    56    57    35.00000  109.50000
   55    56    58    35.00000  109.50000
   55    56    59    35.00000  109.50000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   49    46    47    65.00000  116.34900
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   39    33    37    90.00000  108.74100
   39    33    53    50.00000  109.50000
   39    42    43    35.00000  109.50000
   39    42    44    35.00000  109.50000
   39    42    45    35.00000  109.50000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    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    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    53   0.01700  1.0 1.0
   24    29    33    53  -0.23550 -1.0 2.0
   24    29    33    53   0.21350  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   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    37    38   0.30150 -1.0 2.0
   29    33    37    40   0.65300  1.0 1.0
   29    33    37    40  -0.03850 -1.0 2.0
   29    33    37    40   0.33900  1.0 3.0
   29    33    53    47   0.56750  1.0 1.0
   29    33    53    47  -0.07550 -1.0 2.0
   29    33    53    47   0.20000  1.0 3.0
   29    33    53    54   0.15000  1.0 3.0
   29    33    53    55   0.56750  1.0 1.0
   29    33    53    55  -0.07550 -1.0 2.0
   29    33    53    55   0.20000  1.0 3.0
   29    33    39    42   0.14700  1.0 1.0
   29    33    39    42  -1.16150 -1.0 2.0
   29    33    39    42   0.48700  1.0 3.0
   33    37    40    41   0.04550  1.0 1.0
   33    37    40    41   0.83000 -1.0 2.0
   33    37    40    41  -0.04000  1.0 3.0
   33    37    40    46  -0.33500  1.0 1.0
   33    37    40    46   1.06600 -1.0 2.0
   33    37    40    46  -0.14000  1.0 3.0
   33    53    55    56   0.06250  1.0 1.0
   33    53    55    56  -0.01100 -1.0 2.0
   33    53    55    56   0.28050  1.0 3.0
   33    39    42    43   0.37050  1.0 3.0
   33    39    42    44   0.37050  1.0 3.0
   33    39    42    45   0.37050  1.0 3.0
   37    33    53    47   0.11950  1.0 1.0
   37    33    53    47   0.20300 -1.0 2.0
   37    33    53    47  -0.70800  1.0 3.0
   37    33    53    54  -0.11250  1.0 3.0
   37    33    53    55  -0.09450  1.0 1.0
   37    33    53    55  -1.12950 -1.0 2.0
   37    33    53    55   0.54000  1.0 3.0
   37    33    39    42  -1.11000  1.0 1.0
   37    33    39    42   0.50250 -1.0 2.0
   37    33    39    42   0.47450  1.0 3.0
   37    40   -46    47   7.00000 -1.0 2.0
   37    40    46    49   7.00000 -1.0 2.0
   38    37    40    41   0.00000  1.0 1.0
   38    37    40    46   1.00000 -1.0 2.0
   40    46    47    48   1.00000 -1.0 2.0
   40    46    47    53  -0.33500  1.0 1.0
   40    46    47    53   1.06600 -1.0 2.0
   40    46    47    53  -0.14000  1.0 3.0
   40    46    49    50   0.00000  1.0 1.0
   40    46    49    51   0.00000  1.0 1.0
   40    46    49    52   0.00000  1.0 1.0
   41    40    46    47   7.00000 -1.0 2.0
   41    40    46    49   7.00000 -1.0 2.0
   46    47   -53    33   0.65300  1.0 1.0
   46    47   -53    33  -0.03850 -1.0 2.0
   46    47   -53    33   0.33900  1.0 3.0
   46    47    53    54   0.00000  1.0 1.0
   46    47    53    55   0.65300  1.0 1.0
   46    47    53    55  -0.03850 -1.0 2.0
   46    47    53    55   0.33900  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    51   0.15000  1.0 3.0
   47    46    49    52   0.15000  1.0 3.0
   47    53    55    56  -1.11000  1.0 1.0
   47    53    55    56   0.50250 -1.0 2.0
   47    53    55    56   0.47450  1.0 3.0
   48    47    53    33   0.30150 -1.0 2.0
   48    47    53    54   0.00000  1.0 1.0
   48    47    53    55   0.30150 -1.0 2.0
   53    33    37    38   0.30150 -1.0 2.0
   53    33   -37    40   0.65300  1.0 1.0
   53    33   -37    40  -0.03850 -1.0 2.0
   53    33   -37    40   0.33900  1.0 3.0
   53    33    39    42   0.06250  1.0 1.0
   53    33    39    42  -0.01100 -1.0 2.0
   53    33    39    42   0.28050  1.0 3.0
   53    55    56    57   0.37050  1.0 3.0
   53    55    56    58   0.37050  1.0 3.0
   53    55    56    59   0.37050  1.0 3.0
   54    53    55    56   0.37050  1.0 3.0
   49    46    47    48  -0.64400  1.0 1.0
   49    46    47    48   0.26850 -1.0 2.0
   49    46    47    53   0.25700  1.0 1.0
   49    46    47    53   0.66200 -1.0 2.0
   49    46    47    53   0.04450  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    40   0.65300  1.0 1.0
   39    33    37    40  -0.03850 -1.0 2.0
   39    33    37    40   0.33900  1.0 3.0
   39    33    53    47  -0.09450  1.0 1.0
   39    33    53    47  -1.12950 -1.0 2.0
   39    33    53    47   0.54000  1.0 3.0
   39    33    53    54   0.23400  1.0 3.0
   39    33    53    55   1.11900  1.0 1.0
   39    33    53    55  -1.16350 -1.0 2.0
   39    33    53    55  -0.34150  1.0 3.0
IPHI
    9     5     7     8  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    34    35  10.50000 -1.0 2.0
   33    40    37    38  10.50000 -1.0 2.0
   37    41    40    46   1.10000 -1.0 2.0
   47    49    46    40   1.10000 -1.0 2.0
   46    53    47    48  10.50000 -1.0 2.0
END
