* LIGAND DATABASE FILE (OPLS2005)
*
001      63    64    116    178     338
    1     0 S   NP   _N1_     1    29.43381    96.74956   -17.30900
    2     1 S   H    _HN1     2     1.02959    91.49001    23.69661
    3     1 S   H    _H1_     3     1.02837    61.66599   132.34613
    4     1 S   H    _H2_     4     1.02781    56.77409   -87.30485
    5     1 S   CT   _CA1     5     1.50097   158.03140  -152.73718
    6     5 S   HC   _HA1     6     1.09566   105.31252    -6.02405
    7     5 S   CO3  _C1_     7     1.53883   112.24642  -126.42732
    8     7 S   O2Z  _O11     8     1.26363   115.04540   -46.38046
    9     7 S   O2Z  _O12     9     1.26235   114.91829   132.84431
   10     5 S   CT   _CB1    10     1.53084   107.43559   111.99979
   11    10 S   HC   HB11    11     1.09816   109.60324   -49.47853
   12    10 S   HC   HB12    12     1.09839   110.30029    67.11361
   13    10 S   CT   _CG1    13     1.53026   112.60834  -170.60393
   14    13 S   HC   HG11    14     1.09536   110.31080   -56.24172
   15    13 S   HC   HG12    15     1.09602   110.30050    62.82107
   16    13 S   C    _CD1    16     1.51786   111.76239  -177.11500
   17    16 S   O    _OE1    17     1.22749   122.98338   -20.88548
   18    16 S   N    _N2_    18     1.38536   111.88384   159.91413
   19    18 S   H    _HN2    19     1.01577   119.09052     2.09237
   20    18 S   CT1  _CA2    20     1.46263   123.43312  -175.95906
   21    20 S   HC   _HA2    21     1.09726   109.45505   -15.71792
   22    20 S   C    _C2_    22     1.53374   108.23690  -131.59472
   23    22 S   O    _O2_    23     1.23003   122.32133  -145.08282
   24    20 S   CT   _CB2    32     1.53559   110.99991   106.43514
   25    24 S   HC   HB21    33     1.09261   109.04931    54.95934
   26    24 S   HC   HB22    34     1.09500   110.44908   173.21499
   27    22 S   N    _N3_    24     1.38528   113.26901    42.24096
   28    27 S   H    _HN3    25     1.01536   118.88845    -0.58450
   29    24 S   S    _SG2    35     1.82809   111.39879   -67.73619
   30    27 S   CT   _CA3    26     1.45450   123.45425   175.03762
   31    30 S   HC   HA31    27     1.09522   109.23198    24.32856
   32    30 S   HC   HA32    28     1.09494   107.11975   141.34677
   33    29 S   CT   _C9_    36     1.86899   102.25028   148.70129
   34    30 S   CO3  _C3_    29     1.52933   113.13715   -99.13589
   35    34 S   O2Z  _O31    30     1.26400   115.42382   -43.56485
   36    34 S   O2Z  _O32    31     1.26357   114.96494   137.36459
   37    33 S   CM   _C14    37     1.51774   106.65305   176.00394
   38    37 S   CM   _C13    38     1.44597   119.06898    79.46835
   39    38 S   HC   _H16    39     1.08488   118.90738  -166.58011
   40    37 S   CMA  _C15    48     1.35271   111.82621  -104.32834
   41    40 S   OM   _O34    49     1.26334   129.15051   179.25428
   42    38 S   CM   _C12    40     1.34234   120.74941    15.13462
   43    42 S   HC   _H15    41     1.08645   119.37072  -179.44398
   44    40 S   OS   _O33    50     1.43276   107.65701    -3.73439
   45    42 S   CT   _C11    42     1.50665   123.29418     1.94320
   46    45 S   HC   _H13    43     1.09619   109.10586   132.93598
   47    45 S   HC   _H14    44     1.09528   108.60378  -111.08435
   48    33 S   CM   _C8_    51     1.50444   109.33241    68.26574
   49    33 S   CT   _C10    45     1.53900   113.58224   -65.18156
   50    49 S   HC   _H11    46     1.10037   109.16391   176.97832
   51    49 S   HC   _H12    47     1.09498   112.42580    60.62202
   52    48 S   CM   _C7_    52     1.34146   128.59590   -85.21885
   53    52 S   HC   _H10    53     1.08675   119.02159     1.86645
   54    52 S   CT   _C6_    54     1.50146   125.10780  -177.63446
   55    54 S   HC   _H8_    55     1.09610   111.32397     5.93062
   56    54 S   HC   _H9_    56     1.09664   108.36673   122.93674
   57    54 S   CT   _C5_    57     1.52904   110.95217  -116.40631
   58    57 S   HC   _H6_    58     1.09693   110.00312    59.57434
   59    57 S   HC   _H7_    59     1.09690   110.13071   -58.16188
   60    57 S   CT   _C4_    60     1.52066   111.44394  -179.31329
   61    60 S   HC   _H3_    61     1.09467   110.99301    60.21948
   62    60 S   HC   _H4_    62     1.09468   111.00162   -60.31222
   63    60 S   HC   _H5_    63     1.09449   110.25670   179.95577
  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  11   5   4   3
  17   2   1   1  13  11   4   6   2   7   4   5   6   4   3   9
   3   1   1   8   4   9   5   4   6   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    49    48    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    45    49    50    51    40    44    48    52  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    45    46    47    49    50    51    40    41    44    48    52    53    54  
   35    36  
   36  
    0  
   38    39    42    43    45    49    50    51    40    41    44    48    52  
   39    42    43    45    46    47    49    40    41    44    48  
   42    43    45    40  
   41    44    48    52    42    49  
   44    48  
   43    45    46    47    49    50    51  
   45    46    47    49  
   48    52    53    54    49  
   46    47    49    50    51    48  
   47    49    50    51  
   49    50    51  
   52    53    54    55    56    57    49    50    51  
   50    51    52  
   51  
    0  
   53    54    55    56    57    58    59    60  
   54    55    56    57  
   55    56    57    58    59    60    61    62    63  
   56    57    58    59    60  
   57    58    59    60  
   58    59    60    61    62    63  
   59    60    61    62    63  
   60    61    62    63  
   61    62    63  
   62    63  
   63  
    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   0.167500   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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   2.8500   0.1400  -0.570000   1.5900   1.4000   0.020110767  -0.896042159
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660  -0.120000   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.120000   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  -0.120000   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
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    49   268.000  1.529
   33    48   317.000  1.510
   37    38   380.000  1.444
   37    40   465.000  1.376
   38    39   340.000  1.080
   38    42   549.000  1.340
   42    43   340.000  1.080
   42    45   317.000  1.510
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   40    41   745.000  1.250
   40    44   440.000  1.360
   44    48   440.000  1.360
   48    52   549.000  1.340
   52    53   340.000  1.080
   52    54   317.000  1.510
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   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  112.20000
   29    33    49    75.00000  111.63000
   29    33    48    75.00000  112.20000
   33    37    38    70.00000  124.00000
   33    37    40    70.00000  124.00000
   33    49    45    58.35000  112.70000
   33    49    50    37.50000  110.70000
   33    49    51    37.50000  110.70000
   33    48    44    85.00000  112.85300
   33    48    52    70.00000  124.00000
   37    38    39    35.00000  120.00000
   37    38    42    70.00000  123.01800
   37    40    41    65.00000  137.10300
   37    40    44    80.00000  120.01400
   38    42    43    35.00000  120.00000
   38    42    45    70.00000  124.00000
   42    38    39    35.00000  120.00000
   42    45    46    35.00000  109.50000
   42    45    47    35.00000  109.50000
   42    45    49    70.00000  112.02700
   45    42    43    35.00000  117.00000
   45    49    50    37.50000  110.70000
   45    49    51    37.50000  110.70000
   47    45    46    33.00000  107.80000
   49    33    37    70.00000  112.02700
   49    45    46    37.50000  110.70000
   49    45    47    37.50000  110.70000
   51    49    50    33.00000  107.80000
   40    37    38    70.00000  117.34000
   40    44    48    90.00000  114.05000
   44    40    41    65.00000  121.00000
   44    48    52    80.00000  120.01400
   48    33    37    70.00000  110.12100
   48    33    49    70.00000  112.02700
   48    52    53    35.00000  120.00000
   48    52    54    70.00000  124.00000
   52    54    55    35.00000  109.50000
   52    54    56    35.00000  109.50000
   52    54    57    70.00000  112.02700
   54    52    53    35.00000  117.00000
   54    57    58    37.50000  110.70000
   54    57    59    37.50000  110.70000
   54    57    60    58.35000  112.70000
   56    54    55    33.00000  107.80000
   57    54    55    37.50000  110.70000
   57    54    56    37.50000  110.70000
   57    60    61    37.50000  110.70000
   57    60    62    37.50000  110.70000
   57    60    63    37.50000  110.70000
   59    57    58    33.00000  107.80000
   60    57    58    37.50000  110.70000
   60    57    59    37.50000  110.70000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    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  -0.62250  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    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   24    29    33    48  -0.62250  1.0 1.0
   24    29    33    48  -0.38450 -1.0 2.0
   24    29    33    48   0.81900  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   0.42700  1.0 1.0
   29    33    37    38  -0.70350 -1.0 2.0
   29    33    37    38  -0.43150  1.0 3.0
   29    33    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    49    45   0.44750  1.0 1.0
   29    33    49    45  -0.17800 -1.0 2.0
   29    33    49    45   0.20200  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    51   0.15000  1.0 3.0
   29    33    48    44   0.09700  1.0 1.0
   29    33    48    44   0.15600 -1.0 2.0
   29    33    48    44  -0.50800  1.0 3.0
   29    33    48    52   0.42700  1.0 1.0
   29    33    48    52  -0.70350 -1.0 2.0
   29    33    48    52  -0.43150  1.0 3.0
   33    37    38    39   0.00000  1.0 1.0
   33    37    38    42  -0.18600  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37   -40    44   7.00000 -1.0 2.0
   33    48    52    53   7.00000 -1.0 2.0
   33    48    52    54   7.00000 -1.0 2.0
   37    33    49    45   0.34400  1.0 1.0
   37    33    49    45   0.09450 -1.0 2.0
   37    33    49    45   0.11100  1.0 3.0
   37    33    49    50   0.15000  1.0 3.0
   37    33    49    51   0.15000  1.0 3.0
   37    33   -48    44   0.09700  1.0 1.0
   37    33   -48    44   0.15600 -1.0 2.0
   37    33   -48    44  -0.50800  1.0 3.0
   37    33    48    52  -0.28300  1.0 1.0
   37    33    48    52   0.26700 -1.0 2.0
   37    33    48    52  -0.63300  1.0 3.0
   37    38    42    43   7.00000 -1.0 2.0
   37    38   -42    45   7.00000 -1.0 2.0
   37    40   -44    48   2.00000 -1.0 2.0
   38    37    40    41   7.00000 -1.0 2.0
   38    37    40    44   7.00000 -1.0 2.0
   38    42    45    46   0.00000  1.0 1.0
   38    42    45    47   0.00000  1.0 1.0
   38    42    45    49   0.09850  1.0 1.0
   38    42    45    49   0.15250 -1.0 2.0
   38    42    45    49  -0.50650  1.0 3.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    45   7.00000 -1.0 2.0
   42    45   -49    33   0.34400  1.0 1.0
   42    45   -49    33   0.09450 -1.0 2.0
   42    45   -49    33   0.11100  1.0 3.0
   42    45    49    50   0.15000  1.0 3.0
   42    45    49    51   0.15000  1.0 3.0
   43    42    45    46   0.33100  1.0 3.0
   43    42    45    47   0.33100  1.0 3.0
   43    42    45    49   0.00000  1.0 1.0
   46    45    49    33   0.15000  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    51   0.15000  1.0 3.0
   47    45    49    33   0.15000  1.0 3.0
   47    45    49    50   0.15000  1.0 3.0
   47    45    49    51   0.15000  1.0 3.0
   49    33   -37    38   0.98200  1.0 1.0
   49    33   -37    38  -0.11900 -1.0 2.0
   49    33   -37    38   0.24250  1.0 3.0
   49    33    37    40   0.09850  1.0 1.0
   49    33    37    40   0.15250 -1.0 2.0
   49    33    37    40  -0.50650  1.0 3.0
   49    33    48    44   0.09700  1.0 1.0
   49    33    48    44   0.15600 -1.0 2.0
   49    33    48    44  -0.50800  1.0 3.0
   49    33    48    52   0.09850  1.0 1.0
   49    33    48    52   0.15250 -1.0 2.0
   49    33    48    52  -0.50650  1.0 3.0
   40    37    38    39  -0.18600  1.0 3.0
   40    37    38    42   0.28850  1.0 1.0
   40    37    38    42   2.61350 -1.0 2.0
   40    37    38    42   0.78400  1.0 3.0
   40    44   -48    33   2.00000 -1.0 2.0
   40    44    48    52   2.00000 -1.0 2.0
   41    40    44    48   2.00000 -1.0 2.0
   44    48    52    53   7.00000 -1.0 2.0
   44    48    52    54   7.00000 -1.0 2.0
   48    33    37    38  -0.28300  1.0 1.0
   48    33    37    38   0.26700 -1.0 2.0
   48    33    37    38  -0.63300  1.0 3.0
   48    33   -37    40  -0.28300  1.0 1.0
   48    33   -37    40   0.26700 -1.0 2.0
   48    33   -37    40  -0.63300  1.0 3.0
   48    33    49    45   0.34400  1.0 1.0
   48    33    49    45   0.09450 -1.0 2.0
   48    33    49    45   0.11100  1.0 3.0
   48    33    49    50   0.15000  1.0 3.0
   48    33    49    51   0.15000  1.0 3.0
   48    52    54    55   0.00000  1.0 1.0
   48    52    54    56   0.00000  1.0 1.0
   48    52    54    57   0.09850  1.0 1.0
   48    52    54    57   0.15250 -1.0 2.0
   48    52    54    57  -0.50650  1.0 3.0
   52    54    57    58   0.15000  1.0 3.0
   52    54    57    59   0.15000  1.0 3.0
   52    54    57    60   0.34400  1.0 1.0
   52    54    57    60   0.09450 -1.0 2.0
   52    54    57    60   0.11100  1.0 3.0
   53    52    54    55   0.33100  1.0 3.0
   53    52    54    56   0.33100  1.0 3.0
   53    52    54    57   0.00000  1.0 1.0
   54    57    60    61   0.15000  1.0 3.0
   54    57    60    62   0.15000  1.0 3.0
   54    57    60    63   0.15000  1.0 3.0
   55    54    57    58   0.15000  1.0 3.0
   55    54    57    59   0.15000  1.0 3.0
   55    54    57    60   0.15000  1.0 3.0
   56    54    57    58   0.15000  1.0 3.0
   56    54    57    59   0.15000  1.0 3.0
   56    54    57    60   0.15000  1.0 3.0
   58    57    60    61   0.15000  1.0 3.0
   58    57    60    62   0.15000  1.0 3.0
   58    57    60    63   0.15000  1.0 3.0
   59    57    60    61   0.15000  1.0 3.0
   59    57    60    62   0.15000  1.0 3.0
   59    57    60    63   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
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    40   1.10000 -1.0 2.0
   37    39    38    42   1.10000 -1.0 2.0
   45    43    42    38   1.10000 -1.0 2.0
   41    44    40    37   1.10000 -1.0 2.0
   33    44    48    52   1.10000 -1.0 2.0
   54    53    52    48   1.10000 -1.0 2.0
END
