* LIGAND DATABASE FILE (OPLS2005)
*
001      66    68    118    174     334
    1     0 S   NP   _N1_     1    28.71747    95.79763   -22.70857
    2     1 S   H    _HN1     2     1.02948    75.49469    12.59388
    3     1 S   H    _H1_     3     1.02830    35.41752   165.44538
    4     1 S   H    _H2_     4     1.02789   103.83332   -93.10877
    5     1 S   CT   _CA1     5     1.50127   138.47430   117.21099
    6     5 S   HC   _HA1     6     1.09581   105.17268    86.98569
    7     5 S   CO3  _C1_     7     1.53705   112.18995   -33.13452
    8     7 S   O2Z  _O11     8     1.26360   115.03373   -48.94120
    9     7 S   O2Z  _O12     9     1.26210   114.91043   129.78925
   10     5 S   CT   _CB1    10     1.53035   107.36840  -155.24845
   11    10 S   HC   HB11    11     1.09843   109.23477   -50.44179
   12    10 S   HC   HB12    12     1.09808   110.56257    66.09483
   13    10 S   CT   _CG1    13     1.53022   112.65945  -171.40054
   14    13 S   HC   HG11    14     1.09583   110.69094   -67.52284
   15    13 S   HC   HG12    15     1.09666   109.77500    51.73909
   16    13 S   C    _CD1    16     1.51850   111.87597   172.12082
   17    16 S   O    _OE1    17     1.22757   123.17669    10.97454
   18    16 S   N    _N2_    18     1.38601   111.87164  -169.17409
   19    18 S   H    _HN2    19     1.01593   118.95854     1.06936
   20    18 S   CT1  _CA2    20     1.46343   123.34002   177.00984
   21    20 S   HC   _HA2    21     1.09733   109.41724     1.59360
   22    20 S   C    _C2_    22     1.53512   108.62170  -113.90386
   23    22 S   O    _O2_    23     1.23052   122.29372  -148.56403
   24    20 S   CT   _CB2    32     1.53238   111.33327   123.68435
   25    24 S   HC   HB21    33     1.09393   109.40740    56.59936
   26    24 S   HC   HB22    34     1.09503   110.73303   175.15827
   27    22 S   N    _N3_    24     1.38331   113.67708    38.94299
   28    27 S   H    _HN3    25     1.01588   119.56069    -3.43735
   29    24 S   S    _SG2    35     1.82830   110.99240   -65.51989
   30    27 S   CT   _CA3    26     1.45280   123.22852   177.09849
   31    30 S   HC   HA31    27     1.09548   107.53100   -64.22174
   32    30 S   HC   HA32    28     1.09556   107.96507    52.21809
   33    29 S   CT   _C14    36     1.87646   100.27259   155.68146
   34    30 S   CO3  _C3_    29     1.52961   114.06834   174.21365
   35    34 S   O2Z  _O31    30     1.26381   116.06524    -0.14402
   36    34 S   O2Z  _O32    31     1.26428   114.41292   179.90721
   37    33 S   CO4  _C11    37     1.53193   105.18153   -73.06676
   38    37 S   O    _O15    38     1.22795   123.74843   101.00920
   39    33 S   OS   _O21    62     1.42744   108.63810    49.06896
   40    37 S   CA   _C5_    39     1.47772   116.71424   -75.20570
   41    39 S   CT   _C16    63     1.42242   116.63444  -172.12052
   42    41 S   HC   _H28    64     1.09381   107.77112  -163.24188
   43    41 S   HC   _H29    65     1.09241   110.69309    79.51063
   44    41 S   HC   _H30    66     1.09315   112.56633   -43.94777
   45    40 S   CA   _C4_    40     1.41977   118.10826   -27.27106
   46    45 S   CA   _C8_    41     1.41979   116.74369   175.80250
   47    45 S   CMA  _C10    54     1.52360   120.91190    -6.01083
   48    47 S   OM   _O14    55     1.26907   119.61707  -156.86529
   49    46 S   CA   _C6_    42     1.38446   120.08777     0.65222
   50    46 S   OH   _O18    52     1.36911   123.48744  -178.81485
   51    50 S   HO   _H31    53     0.97538   107.49606    -5.10879
   52    33 S   CM   _C12    56     1.52172   107.34614   170.16593
   53    49 S   CA   _C7_    43     1.37034   121.60943     0.22555
   54    52 S   OS   _O20    57     1.40065   114.74126   -98.07933
   55    40 S   CA   _C9_    44     1.40871   119.74241   149.83158
   56    53 S   OS   _O17    47     1.36080   112.41969   179.67195
   57    54 S   CT   _C15    58     1.42451   111.96756    85.03054
   58    57 S   HC   _H25    59     1.09408   107.80044   165.04048
   59    57 S   HC   _H26    60     1.09547   111.95157    46.37844
   60    57 S   HC   _H27    61     1.09371   110.57807   -77.44802
   61    55 S   OH   _O19    45     1.36477   123.87962     2.63076
   62    61 S   HO   _H32    46     0.97343   108.90969     7.75762
   63    56 S   CO   _C13    48     1.43987   101.09770     0.15826
   64    63 S   HC   _H23    49     1.09607   108.65206  -120.96396
   65    63 S   HC   _H24    50     1.09522   108.94640   120.88097
   66    49 S   OS   _O16    51     1.36280   126.19482   179.91607
  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   9   5   4   3
  15   2   1   1  12   5   8  12   4   2   1   1  12  11   7   2
  10   3   1   5   8   4   5   5   3   2   1   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    52    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    47    52    54    39    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    45    55    47    48    52    54    57    39    41    42    43    44  
   35    36  
   36  
    0  
   38    40    45    46    53    55    61    47    52    54    39    41  
   40    45    55    52    39  
   41    42    43    44    40    47    52    54  
   45    46    49    53    55    61    62    56    50    47    48    52  
   42    43    44    52  
   43    44  
   44  
    0  
   46    49    53    55    61    66    50    51    47    48    52    54  
   49    53    55    56    63    66    50    51    47    48    52  
   48    52    54    57    49    50    55  
   52    54  
   53    55    61    56    63    64    65    66    50    51  
   51    53    66  
    0  
   54    57    58    59    60  
   55    61    62    56    63    64    65    66  
   57    58    59    60  
   61    62    56    63    66  
   63    64    65    66    61  
   58    59    60  
   59    60  
   60  
    0  
   62  
    0  
   64    65    66  
   65    66  
   66  
    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   0.465900   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   0.537000   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   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   48   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   49   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5500   0.0760  -0.585200   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   54   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   55   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   57   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   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
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   66   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
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    52   317.000  1.510
   33    39   320.000  1.410
   37    38   570.000  1.229
   37    40   310.000  1.470
   40    45   469.000  1.400
   40    55   469.000  1.400
   45    46   469.000  1.400
   45    47   320.000  1.460
   46    49   469.000  1.400
   46    50   450.000  1.364
   49    53   469.000  1.400
   49    66   450.000  1.364
   53    55   469.000  1.400
   53    56   450.000  1.364
   55    61   450.000  1.364
   61    62   553.000  0.945
   56    63   320.000  1.380
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   320.000  1.380
   50    51   553.000  0.945
   47    48   745.000  1.250
   47    52   465.000  1.376
   52    54   440.000  1.360
   54    57   320.000  1.410
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   39    41   320.000  1.410
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   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    52    75.00000  112.20000
   29    33    39    85.00000  114.68000
   33    37    38    80.00000  120.40000
   33    37    40    65.00000  115.47100
   33    52    47    70.00000  124.00000
   33    52    54    85.00000  112.85300
   33    39    41    60.00000  109.50000
   37    40    45    60.00000  119.52600
   37    40    55    60.00000  119.52600
   40    37    38    75.00000  123.78400
   40    45    46    63.00000  120.00000
   40    45    47    60.00000  120.93500
   40    55    53    63.00000  120.00000
   40    55    61    70.00000  120.00000
   45    46    49    63.00000  120.00000
   45    46    50    70.00000  120.00000
   45    47    48    85.00000  114.86500
   45    47    52    60.00000  123.20500
   46    49    53    63.00000  120.00000
   46    49    66    70.00000  120.00000
   46    50    51    35.00000  113.00000
   49    53    55    63.00000  120.00000
   49    53    56    70.00000  120.00000
   49    66    63   100.00000  112.36700
   53    55    61    70.00000  120.00000
   53    56    63   100.00000  112.36700
   55    40    45    63.00000  120.00000
   55    61    62    35.00000  113.00000
   56    53    55    70.00000  120.00000
   56    63    64    35.00000  109.50000
   56    63    65    35.00000  109.50000
   56    63    66    92.60000  111.55000
   65    63    64    33.00000  109.50000
   66    49    53    70.00000  120.00000
   66    63    64    35.00000  109.50000
   66    63    65    35.00000  109.50000
   50    46    49    70.00000  120.00000
   47    45    46    60.00000  120.93500
   47    52    54    80.00000  120.01400
   52    33    37    70.00000  109.06800
   52    47    48    65.00000  137.10300
   52    54    57    90.00000  111.18400
   54    57    58    35.00000  109.50000
   54    57    59    35.00000  109.50000
   54    57    60    35.00000  109.50000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   39    33    37    90.00000  108.74100
   39    33    52    85.00000  110.90400
   39    41    42    35.00000  109.50000
   39    41    43    35.00000  109.50000
   39    41    44    35.00000  109.50000
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    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    52  -0.62250  1.0 1.0
   24    29    33    52  -0.38450 -1.0 2.0
   24    29    33    52   0.81900  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    52    47   0.42700  1.0 1.0
   29    33    52    47  -0.70350 -1.0 2.0
   29    33    52    47  -0.43150  1.0 3.0
   29    33    52    54   0.09700  1.0 1.0
   29    33    52    54   0.15600 -1.0 2.0
   29    33    52    54  -0.50800  1.0 3.0
   29    33    39    41   0.14700  1.0 1.0
   29    33    39    41  -1.16150 -1.0 2.0
   29    33    39    41   0.48700  1.0 3.0
   33    37    40    45   2.26350  1.0 1.0
   33    37    40    45   0.76750 -1.0 2.0
   33    37    40    45   0.22500  1.0 3.0
   33    37    40    55   2.26350  1.0 1.0
   33    37    40    55   0.76750 -1.0 2.0
   33    37    40    55   0.22500  1.0 3.0
   33    52    54    57   2.00000 -1.0 2.0
   33    39    41    42   0.37050  1.0 3.0
   33    39    41    43   0.37050  1.0 3.0
   33    39    41    44   0.37050  1.0 3.0
   37    33    52    47  -0.51250  1.0 1.0
   37    33    52    47  -0.88800 -1.0 2.0
   37    33    52    47   0.08850  1.0 3.0
   37    33    52    54   0.09700  1.0 1.0
   37    33    52    54   0.15600 -1.0 2.0
   37    33    52    54  -0.50800  1.0 3.0
   37    33    39    41  -1.11000  1.0 1.0
   37    33    39    41   0.50250 -1.0 2.0
   37    33    39    41   0.47450  1.0 3.0
   37    40    45    46   3.62500 -1.0 2.0
   37    40   -45    47   3.62500 -1.0 2.0
   37    40    55    53   3.62500 -1.0 2.0
   37    40    55    61   3.62500 -1.0 2.0
   38    37    40    45   1.05000 -1.0 2.0
   38    37    40    55   1.05000 -1.0 2.0
   40    45    46    49   3.62500 -1.0 2.0
   40    45    46    50   3.62500 -1.0 2.0
   40    45    47    48  -0.01750  1.0 1.0
   40    45    47    48  -0.32000 -1.0 2.0
   40    45    47    48   0.00600  1.0 3.0
   40    45    47    52   0.15800  1.0 1.0
   40    45    47    52   1.85350 -1.0 2.0
   40    45    47    52  -0.48700  1.0 3.0
   40    55    61    62   0.84100 -1.0 2.0
   45    40    55    53   3.62500 -1.0 2.0
   45    40    55    61   3.62500 -1.0 2.0
   45    46   -49    53   3.62500 -1.0 2.0
   45    46    49    66   3.62500 -1.0 2.0
   45    46    50    51   0.84100 -1.0 2.0
   45    47   -52    33   7.00000 -1.0 2.0
   45    47    52    54   7.00000 -1.0 2.0
   46    45    47    48  -0.01750  1.0 1.0
   46    45    47    48  -0.32000 -1.0 2.0
   46    45    47    48   0.00600  1.0 3.0
   46    45    47    52   0.15800  1.0 1.0
   46    45    47    52   1.85350 -1.0 2.0
   46    45    47    52  -0.48700  1.0 3.0
   46    49    53    55   3.62500 -1.0 2.0
   46    49    53    56   3.62500 -1.0 2.0
   46    49    66    63   1.63200 -1.0 2.0
   49    46    50    51   0.84100 -1.0 2.0
   49    53   -55    40   3.62500 -1.0 2.0
   49    53    55    61   3.62500 -1.0 2.0
   49    53   -56    63   1.63200 -1.0 2.0
   53    49   -66    63   1.63200 -1.0 2.0
   53    55    61    62   0.84100 -1.0 2.0
   53    56    63    64   0.08050  1.0 3.0
   53    56    63    65   0.08050  1.0 3.0
   53    56   -63    66  -0.25600  1.0 1.0
   53    56   -63    66  -0.40050 -1.0 2.0
   53    56   -63    66   0.34700  1.0 3.0
   55    40   -45    46   3.62500 -1.0 2.0
   55    40    45    47   3.62500 -1.0 2.0
   55    53    56    63   1.63200 -1.0 2.0
   56    53    55    40   3.62500 -1.0 2.0
   56    53    55    61   3.62500 -1.0 2.0
   56    63   -66    49  -0.25600  1.0 1.0
   56    63   -66    49  -0.40050 -1.0 2.0
   56    63   -66    49   0.34700  1.0 3.0
   64    63    66    49   0.08050  1.0 3.0
   65    63    66    49   0.08050  1.0 3.0
   66    49    53    55   3.62500 -1.0 2.0
   66    49   -53    56   3.62500 -1.0 2.0
   50    46    49    53   3.62500 -1.0 2.0
   50    46    49    66   3.62500 -1.0 2.0
   47    45    46    49   3.62500 -1.0 2.0
   47    45    46    50   3.62500 -1.0 2.0
   47    52    54    57  -2.26850  1.0 1.0
   47    52    54    57   3.39050 -1.0 2.0
   48    47    52    33   7.00000 -1.0 2.0
   48    47    52    54   7.00000 -1.0 2.0
   52    33    37    38   0.30150 -1.0 2.0
   52    33   -37    40   0.65300  1.0 1.0
   52    33   -37    40  -0.03850 -1.0 2.0
   52    33   -37    40   0.33900  1.0 3.0
   52    33    39    41  -0.77900  1.0 1.0
   52    33    39    41  -0.36900 -1.0 2.0
   52    33    39    41   0.40400  1.0 3.0
   52    54    57    58   0.08050  1.0 3.0
   52    54    57    59   0.08050  1.0 3.0
   52    54    57    60   0.08050  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    52    47   0.39000  1.0 1.0
   39    33    52    47  -0.05800 -1.0 2.0
   39    33    52    47  -0.55150  1.0 3.0
   39    33    52    54   0.09700  1.0 1.0
   39    33    52    54   0.15600 -1.0 2.0
   39    33    52    54  -0.50800  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
   45    55    40    37   4.00000 -1.0 2.0
   46    47    45    40   4.00000 -1.0 2.0
   49    50    46    45   4.00000 -1.0 2.0
   53    66    49    46   4.00000 -1.0 2.0
   55    56    53    49   4.00000 -1.0 2.0
   53    61    55    40   4.00000 -1.0 2.0
   45    48    47    52   1.10000 -1.0 2.0
   33    54    52    47   1.10000 -1.0 2.0
END
