* LIGAND DATABASE FILE (OPLS2005)
*
001      62    63    117    182     346
    1     0 S   NP   _N1_     1    28.92409    95.53835   -21.08785
    2     1 S   H    _HN1     2     1.02778    88.83778   -82.31365
    3     1 S   H    _H1_     3     1.02954    84.09646    26.30092
    4     1 S   H    _H2_     4     1.02832    36.95276   155.11622
    5     1 S   CT   _CA1     5     1.50123   147.38624   145.50239
    6     5 S   HC   _HA1     6     1.09563   105.23588    65.35405
    7     5 S   CO3  _C1_     7     1.53872   112.46903   -54.96734
    8     7 S   O2Z  _O11     8     1.26377   114.98596   -39.59479
    9     7 S   O2Z  _O12     9     1.26237   114.97009   139.61919
   10     5 S   CT   _CB1    10     1.53098   107.44659  -176.48693
   11    10 S   HC   HB11    11     1.09819   109.59095   -48.00729
   12    10 S   HC   HB12    12     1.09826   110.30678    68.67878
   13    10 S   CT   _CG1    13     1.52967   112.58027  -169.01429
   14    13 S   HC   HG11    14     1.09498   110.39444   -60.57353
   15    13 S   HC   HG12    15     1.09644   110.03664    58.52982
   16    13 S   C    _CD1    16     1.51789   112.33321   178.90086
   17    16 S   O    _OE1    17     1.22718   123.26287    -5.95493
   18    16 S   N    _N2_    18     1.38615   111.58948   174.39986
   19    18 S   H    _HN2    19     1.01563   119.06544     2.10152
   20    18 S   CT1  _CA2    20     1.46259   123.48241  -179.23870
   21    20 S   HC   _HA2    21     1.09730   109.38481    -6.04653
   22    20 S   C    _C2_    22     1.53410   108.54179  -121.62597
   23    22 S   O    _O2_    23     1.23036   122.39039  -148.92379
   24    20 S   CT   _CB2    32     1.53327   111.23111   115.96614
   25    24 S   HC   HB21    33     1.09527   109.78830    56.72505
   26    24 S   HC   HB22    34     1.09511   110.72563   175.00676
   27    22 S   N    _N3_    24     1.38370   113.53462    38.61700
   28    27 S   H    _HN3    25     1.01630   119.47660    -3.53280
   29    24 S   S    _SG2    35     1.82732   111.26894   -65.91091
   30    27 S   CT   _CA3    26     1.45286   123.15782   176.99815
   31    30 S   HC   HA31    27     1.09550   107.51612   -64.29290
   32    30 S   HC   HA32    28     1.09558   107.96340    52.12311
   33    29 S   CT   _C11    36     1.82785    99.68416   139.86307
   34    33 S   HC   _H7_    37     1.09490   105.82391    57.81486
   35    30 S   CO3  _C3_    29     1.52937   114.12429   174.12717
   36    35 S   O2Z  _O31    30     1.26367   116.05609    -0.38410
   37    35 S   O2Z  _O32    31     1.26428   114.41274   179.67736
   38    33 S   CM   _C12    38     1.49927   110.30254   175.64513
   39    33 S   OS   _O33    53     1.43313   114.06767   -57.81596
   40    38 S   CT   _C8_    39     1.49821   120.57723    95.08553
   41    40 S   HC   _H4_    40     1.09987   108.44126   144.86828
   42    38 S   CMA  _C13    60     1.51753   119.80118   -92.30507
   43    42 S   OM   _O34    61     1.26236   120.53932   -67.86681
   44    42 S   OM   _O35    62     1.26197   120.48703   112.40338
   45    40 S   CT   _C7_    41     1.52729   115.04781   -94.30712
   46    45 S   HC   _H13    42     1.09588   112.00661    49.44245
   47    45 S   HC   _H14    43     1.09439   112.55945   -72.60329
   48    45 S   CT   _C6_    44     1.52221   102.32949   167.48775
   49    48 S   HC   _H11    45     1.09692   109.71763    79.82419
   50    48 S   HC   _H12    46     1.09463   111.79974  -160.82336
   51    48 S   CT   _C5_    47     1.53555   104.69342   -39.52357
   52    51 S   HC   _H3_    48     1.09714   108.45030   -96.80888
   53    40 S   CT   _C9_    49     1.53624   114.01955    25.14564
   54    53 S   HC   _H5_    50     1.09858   109.06538    86.07262
   55    51 S   CT   _C4_    56     1.52354   111.84446   144.46213
   56    55 S   HC   _H8_    57     1.09525   111.42986   -60.89437
   57    55 S   HC   _H9_    58     1.09492   110.59128   178.98009
   58    55 S   HC   _H10    59     1.09495   110.65731    59.36217
   59    53 S   CO   _C10    51     1.53346   112.06558   -33.81141
   60    59 S   HC   _H6_    52     1.09543   111.20637   -69.66388
   61    59 S   OH   _O36    54     1.42688   107.96913   172.71018
   62    61 S   HO   _H15    55     0.97126   106.86901   155.23455
  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
  13   5   2   1   1  14   9  18   9   4   1   1  11   6   5  11
   5   4  10   7   9   4   4   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    40    59    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    45    53    59    60    39    61    42    43    44  
   38    40    59    39    42  
   36    37  
   37  
    0  
   40    41    45    46    47    48    51    53    54    59    39    42    43    44  
   61    62    42    40    51    53    54    59    60  
   41    45    46    47    48    49    50    51    52    53    54    59    60    61    55    42    43    44  
   45    46    47    48    51    53    54    59    42  
   43    44    45    53  
   44  
    0  
   46    47    48    49    50    51    52    53    54    59    55  
   47    48    49    50    51    53  
   48    49    50    51    53  
   49    50    51    52    53    54    59    55    56    57    58  
   50    51    52    53    55  
   51    52    53    55  
   52    53    54    59    60    61    55    56    57    58  
   53    54    59    55    56    57    58  
   54    59    60    61    62    55    56    57    58  
   59    60    61    55  
   56    57    58    59  
   57    58  
   58  
    0  
   60    61    62  
   61    62  
   62  
    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   0.387900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.670200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   44   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660   0.264700   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   61   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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   340.000  1.090
   33    38   317.000  1.510
   33    39   320.000  1.410
   38    40   317.000  1.510
   38    42   465.000  1.376
   40    41   340.000  1.090
   40    45   268.000  1.529
   40    53   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   268.000  1.529
   51    55   268.000  1.529
   53    54   340.000  1.090
   53    59   250.000  1.527
   59    60   340.000  1.090
   59    39   320.000  1.380
   59    61   380.000  1.407
   61    62   553.000  0.945
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   42    43   745.000  1.250
   42    44   745.000  1.250
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    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    39    85.00000  114.68000
   33    38    40    65.00000  117.92700
   33    38    42    70.00000  124.00000
   33    39    59    60.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  109.50000
   38    40    45    70.00000  112.02700
   38    40    53    70.00000  112.02700
   38    42    43    65.00000  137.10300
   38    42    44    65.00000  137.10300
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    48    58.35000  112.70000
   40    53    51    58.35000  112.70000
   40    53    54    37.50000  110.70000
   40    53    59    75.00000  109.43000
   45    40    41    37.50000  110.70000
   45    48    49    37.50000  110.70000
   45    48    50    37.50000  110.70000
   45    48    51    58.35000  112.70000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    53    58.35000  112.70000
   48    51    55    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    53    54    37.50000  110.70000
   51    53    59    75.00000  109.43000
   51    55    56    37.50000  110.70000
   51    55    57    37.50000  110.70000
   51    55    58    37.50000  110.70000
   53    40    41    37.50000  110.70000
   53    40    45    58.35000  112.70000
   53    51    52    37.50000  110.70000
   53    59    60    45.00000  112.01100
   53    59    39    90.00000  108.56700
   53    59    61    90.00000  110.19100
   59    53    54    45.00000  108.72000
   59    61    62    70.00000  107.92000
   39    33    34    35.00000  109.50000
   39    33    38    85.00000  110.90400
   39    59    60    35.00000  109.50000
   61    59    60    60.00000  108.02500
   61    59    39   110.00000  112.08000
   55    51    52    37.50000  110.70000
   55    51    53    58.35000  112.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   42    38    40    70.00000  124.00000
   44    42    43    65.00000  121.00000
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   0.32350  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    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    38    40   0.30250  1.0 1.0
   29    33    38    40  -0.14950 -1.0 2.0
   29    33    38    40   0.36900  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    39    59   0.14700  1.0 1.0
   29    33    39    59  -1.16150 -1.0 2.0
   29    33    39    59   0.48700  1.0 3.0
   33    38    40    41   0.34800  1.0 3.0
   33    38    40    45   0.46850  1.0 1.0
   33    38    40    45   0.08550 -1.0 2.0
   33    38    40    45   0.09800  1.0 3.0
   33    38    40    53   0.46850  1.0 1.0
   33    38    40    53   0.08550 -1.0 2.0
   33    38    40    53   0.09800  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    44   7.00000 -1.0 2.0
   34    33    38    40   0.34800  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    39    59   0.37050  1.0 3.0
   38    33    39    59  -0.77900  1.0 1.0
   38    33    39    59  -0.36900 -1.0 2.0
   38    33    39    59   0.40400  1.0 3.0
   38    40    45    46   0.15000  1.0 3.0
   38    40    45    47   0.15000  1.0 3.0
   38    40    45    48   0.34400  1.0 1.0
   38    40    45    48   0.09450 -1.0 2.0
   38    40    45    48   0.11100  1.0 3.0
   38    40    53    51   0.34400  1.0 1.0
   38    40    53    51   0.09450 -1.0 2.0
   38    40    53    51   0.11100  1.0 3.0
   38    40    53    54   0.15000  1.0 3.0
   38    40   -53    59   0.34400  1.0 1.0
   38    40   -53    59   0.09450 -1.0 2.0
   38    40   -53    59   0.11100  1.0 3.0
   40    38    42    43   7.00000 -1.0 2.0
   40    38    42    44   7.00000 -1.0 2.0
   40    45    48    49   0.15000  1.0 3.0
   40    45    48    50   0.15000  1.0 3.0
   40    45   -48    51   0.56750  1.0 1.0
   40    45   -48    51  -0.07550 -1.0 2.0
   40    45   -48    51   0.20000  1.0 3.0
   40    53    59    60   0.15000  1.0 3.0
   40    53    59    39   0.62750  1.0 1.0
   40    53    59    39  -0.30950 -1.0 2.0
   40    53    59    39   0.27300  1.0 3.0
   40    53    59    61   0.86500  1.0 1.0
   40    53    59    61  -0.17500 -1.0 2.0
   40    53    59    61   0.20800  1.0 3.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    47   0.15000  1.0 3.0
   41    40    45    48   0.15000  1.0 3.0
   41    40    53    51   0.15000  1.0 3.0
   41    40    53    54   0.15000  1.0 3.0
   41    40    53    59   0.15000  1.0 3.0
   45    40   -53    51   0.56750  1.0 1.0
   45    40   -53    51  -0.07550 -1.0 2.0
   45    40   -53    51   0.20000  1.0 3.0
   45    40    53    54   0.15000  1.0 3.0
   45    40    53    59   3.97050  1.0 1.0
   45    48    51    52   0.15000  1.0 3.0
   45    48   -51    53   0.56750  1.0 1.0
   45    48   -51    53  -0.07550 -1.0 2.0
   45    48   -51    53   0.20000  1.0 3.0
   45    48    51    55   0.56750  1.0 1.0
   45    48    51    55  -0.07550 -1.0 2.0
   45    48    51    55   0.20000  1.0 3.0
   46    45    48    49   0.15000  1.0 3.0
   46    45    48    50   0.15000  1.0 3.0
   46    45    48    51   0.15000  1.0 3.0
   47    45    48    49   0.15000  1.0 3.0
   47    45    48    50   0.15000  1.0 3.0
   47    45    48    51   0.15000  1.0 3.0
   48    51   -53    40   0.56750  1.0 1.0
   48    51   -53    40  -0.07550 -1.0 2.0
   48    51   -53    40   0.20000  1.0 3.0
   48    51    53    54   0.15000  1.0 3.0
   48    51    53    59   3.97050  1.0 1.0
   48    51    55    56   0.15000  1.0 3.0
   48    51    55    57   0.15000  1.0 3.0
   48    51    55    58   0.15000  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    53   0.15000  1.0 3.0
   49    48    51    55   0.15000  1.0 3.0
   50    48    51    52   0.15000  1.0 3.0
   50    48    51    53   0.15000  1.0 3.0
   50    48    51    55   0.15000  1.0 3.0
   51    53    59    60   0.15000  1.0 3.0
   51    53    59    39   0.62750  1.0 1.0
   51    53    59    39  -0.30950 -1.0 2.0
   51    53    59    39   0.27300  1.0 3.0
   51    53    59    61   0.86500  1.0 1.0
   51    53    59    61  -0.17500 -1.0 2.0
   51    53    59    61   0.20800  1.0 3.0
   52    51    53    40   0.15000  1.0 3.0
   52    51    53    54   0.15000  1.0 3.0
   52    51    53    59   0.15000  1.0 3.0
   52    51    55    56   0.15000  1.0 3.0
   52    51    55    57   0.15000  1.0 3.0
   52    51    55    58   0.15000  1.0 3.0
   53    40    45    46   0.15000  1.0 3.0
   53    40    45    47   0.15000  1.0 3.0
   53    40   -45    48   0.56750  1.0 1.0
   53    40   -45    48  -0.07550 -1.0 2.0
   53    40   -45    48   0.20000  1.0 3.0
   53    51    55    56   0.15000  1.0 3.0
   53    51    55    57   0.15000  1.0 3.0
   53    51    55    58   0.15000  1.0 3.0
   53    59   -39    33   0.06250  1.0 1.0
   53    59   -39    33  -0.01100 -1.0 2.0
   53    59   -39    33   0.28050  1.0 3.0
   53    59    61    62  -0.11600  1.0 1.0
   53    59    61    62  -0.09450 -1.0 2.0
   53    59    61    62   0.21250  1.0 3.0
   54    53    59    60   0.15000  1.0 3.0
   54    53    59    39   0.23400  1.0 3.0
   54    53    59    61   0.23400  1.0 3.0
   60    59    39    33   0.37050  1.0 3.0
   60    59    61    62   0.19450  1.0 3.0
   39    33   -38    40   0.09700  1.0 1.0
   39    33   -38    40   0.15600 -1.0 2.0
   39    33   -38    40  -0.50800  1.0 3.0
   39    33    38    42   0.39000  1.0 1.0
   39    33    38    42  -0.05800 -1.0 2.0
   39    33    38    42  -0.55150  1.0 3.0
   39    59    61    62  -0.50000  1.0 1.0
   39    59    61    62  -0.73950 -1.0 2.0
   39    59    61    62   0.17150  1.0 3.0
   61    59    39    33  -0.81800  1.0 1.0
   55    51    53    40   0.56750  1.0 1.0
   55    51    53    40  -0.07550 -1.0 2.0
   55    51    53    40   0.20000  1.0 3.0
   55    51    53    54   0.15000  1.0 3.0
   55    51    53    59   3.97050  1.0 1.0
   42    38    40    41   0.00000  1.0 1.0
   42    38    40    45   0.09850  1.0 1.0
   42    38    40    45   0.15250 -1.0 2.0
   42    38    40    45  -0.50650  1.0 3.0
   42    38    40    53   0.09850  1.0 1.0
   42    38    40    53   0.15250 -1.0 2.0
   42    38    40    53  -0.50650  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    40    38    42   1.10000 -1.0 2.0
   43    44    42    38   1.10000 -1.0 2.0
END
