* LIGAND DATABASE FILE (OPLS2005)
*
001      74    74    134    204     397
    1     0 S   NP   _N1_     1    29.09504    94.60982   -18.95284
    2     1 S   H    _HN1     2     1.02977   106.55617    42.82223
    3     1 S   H    _H1_     3     1.02837    36.34764   139.34871
    4     1 S   H    _H2_     4     1.02783    73.85688   -61.88683
    5     1 S   CT   _CA1     5     1.50101   137.53877  -167.34549
    6     5 S   HC   _HA1     6     1.09572   105.33481    28.88383
    7     5 S   CO3  _C1_     7     1.53893   112.20348   -91.42188
    8     7 S   O2Z  _O11     8     1.26348   115.10598   -48.39249
    9     7 S   O2Z  _O12     9     1.26242   114.89468   130.88447
   10     5 S   CT   _CB1    10     1.53072   107.36551   146.73635
   11    10 S   HC   HB11    11     1.09818   109.53695   -51.28000
   12    10 S   HC   HB12    12     1.09825   110.24747    65.13875
   13    10 S   CT   _CG1    13     1.53054   112.72245  -172.48832
   14    13 S   HC   HG11    14     1.09556   110.19968   -55.55885
   15    13 S   HC   HG12    15     1.09579   110.42557    63.61654
   16    13 S   C    _CD1    16     1.51765   111.55437  -176.24636
   17    16 S   O    _OE1    17     1.22758   122.91772   -23.92568
   18    16 S   N    _N2_    18     1.38533   111.97117   156.46357
   19    18 S   H    _HN2    19     1.01584   119.09392     3.42337
   20    18 S   CT1  _CA2    20     1.46206   123.39798  -173.27180
   21    20 S   HC   _HA2    21     1.09727   109.31544   -20.37763
   22    20 S   C    _C2_    22     1.53346   108.27715  -136.34971
   23    22 S   O    _O2_    23     1.23002   122.32701  -145.12842
   24    20 S   CT   _CB2    32     1.53792   111.16057   101.69448
   25    24 S   HC   HB21    33     1.09289   109.42192    55.98734
   26    24 S   HC   HB22    34     1.09529   109.92803   174.11290
   27    22 S   N    _N3_    24     1.38527   113.24672    42.19810
   28    27 S   H    _HN3    25     1.01541   118.90051    -0.44499
   29    24 S   S    _SG2    35     1.83442   111.41288   -67.21592
   30    27 S   CT   _CA3    26     1.45442   123.36593   175.09679
   31    30 S   HC   HA31    27     1.09530   109.12669    26.27102
   32    30 S   HC   HA32    28     1.09492   107.14321   143.26746
   33    29 S   CT   _C10    36     1.92916   103.94292   153.85560
   34    30 S   CO3  _C3_    29     1.52938   113.22138   -97.12272
   35    34 S   O2Z  _O31    30     1.26394   115.46157   -42.94978
   36    34 S   O2Z  _O32    31     1.26364   114.94377   138.00073
   37    33 S   CT   _C15    37     1.63118   109.21688   152.37962
   38    33 S   CM   _C9_    61     1.53729   104.97211    37.14310
   39    38 S   HC   _H9_    62     1.08933   113.96697    45.61360
   40    37 S   CT   _C14    38     1.55351   112.56487    87.96552
   41    40 S   HC   _H12    39     1.09690   111.25878  -148.93354
   42    40 S   HC   _H13    40     1.09765   111.56570    93.02895
   43    37 S   CT   _C16    53     1.56039   112.19855  -153.14236
   44    43 S   HC   _H14    54     1.09553   111.99003    68.69588
   45    43 S   HC   _H15    55     1.09316   112.44026   -53.31147
   46    43 S   HC   _H16    56     1.09744   110.73618  -172.74174
   47    37 S   CT   _C17    57     1.55444   113.40642   -34.79059
   48    47 S   HC   _H17    58     1.09504   111.73127   -51.30972
   49    47 S   HC   _H18    59     1.09732   110.94638  -170.45721
   50    47 S   HC   _H19    60     1.09473   112.22524    71.18440
   51    38 S   CM   _C8_    63     1.34485   128.26652  -137.04286
   52    51 S   HC   _H8_    64     1.08660   118.44180    -0.87402
   53    40 S   CO4  _C13    41     1.50194   112.88336   -26.43282
   54    53 S   O    _O34    42     1.23058   121.63264  -125.43291
   55    51 S   CM   _C5_    65     1.46780   126.73278  -179.63792
   56    53 S   CT   _C12    43     1.50905   116.80272    58.90343
   57    56 S   HC   _H10    44     1.09621   107.25998    95.52067
   58    56 S   HC   _H11    45     1.09624   106.72697  -148.73130
   59    55 S   CM   _C6_    66     1.34753   117.76824   177.78459
   60    59 S   HC   _H6_    67     1.08811   120.60356    -0.03956
   61    55 S   CT   _C4_    71     1.50753   117.31848    -2.66814
   62    61 S   HC   _H3_    72     1.09575   110.44537    63.09242
   63    61 S   HC   _H4_    73     1.09607   110.49474   -57.26400
   64    61 S   HC   _H5_    74     1.09105   113.99458  -176.79509
   65    33 S   CT   _C11    46     1.59588   107.06487   -89.07435
   66    59 S   CO4  _C7_    68     1.47985   126.03197  -179.75134
   67    66 S   O    _O33    69     1.22633   121.42563  -179.16350
   68    66 S   HC   _H7_    70     1.09791   117.47017     1.00949
   69    65 S   CT   _C18    47     1.54143   116.48571    64.95472
   70    69 S   HC   _H20    48     1.09170   112.84610    55.48590
   71    69 S   HC   _H21    49     1.09158   112.53892   -67.72415
   72    69 S   HC   _H22    50     1.09752   110.29875   173.10164
   73    65 S   OH   _O35    51     1.43861   108.47179  -175.60519
   74    73 S   HO   _H23    52     0.97275   108.61339   179.79633
  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  12   5   4   3
  28   2   1   1  20  13   4  16   6   5   9   3   2   1   5   2
   1   1  10   3   7   4   9   9   4   3   8   4   4   2   1   1
   6   2   1   1   5   3   2   1   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    65    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    56    65    69    73    43    47    38    39    51  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    42    53    56    57    58    65    69    70    71    72    73    74    43    44    45    46    47    48    49    50    38    39    51    52    55  
   35    36  
   36  
    0  
   40    41    42    53    54    56    65    69    73    43    44    45    46    47    48    49    50    38    39    51  
   39    51    52    55    59    61    40    43    47    56    65    69    73  
   51    52    55    65  
   41    42    53    54    56    57    58    65    43    44    45    46    47    48    49    50  
   42    53    54    56    43    47  
   53    54    56    43    47  
   44    45    46    47    48    49    50    53    65  
   45    46    47  
   46    47  
   47  
   48    49    50    53    65  
   49    50  
   50  
    0  
   52    55    59    60    66    61    62    63    64    65  
   55    59    61  
   54    56    57    58    65    69    73  
   56    57    58    65  
   59    60    66    67    68    61    62    63    64  
   57    58    65    69    70    71    72    73    74  
   58    65    69    73  
   65    69    73  
   60    66    67    68    61    62    63    64  
   66    67    68    61  
   62    63    64    66  
   63    64  
   64  
    0  
   69    70    71    72    73    74  
   67    68  
   68  
    0  
   70    71    72    73    74  
   71    72    73  
   72    73  
   73  
   74  
    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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   66   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   67   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   68   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   74   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    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   268.000  1.529
   33    65   268.000  1.529
   33    38   317.000  1.510
   37    40   268.000  1.529
   37    43   268.000  1.529
   37    47   268.000  1.529
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    53   317.000  1.522
   53    54   570.000  1.229
   53    56   317.000  1.522
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    65   268.000  1.529
   65    69   268.000  1.529
   65    73   320.000  1.410
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   73    74   553.000  0.945
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   340.000  1.090
   38    39   340.000  1.080
   38    51   549.000  1.340
   51    52   340.000  1.080
   51    55   380.000  1.444
   55    59   549.000  1.340
   55    61   317.000  1.510
   59    60   340.000  1.080
   59    66   320.000  1.462
   66    67   570.000  1.229
   66    68   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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  111.63000
   29    33    65    75.00000  111.63000
   29    33    38    75.00000  112.20000
   33    37    40    58.35000  112.70000
   33    37    43    58.35000  112.70000
   33    37    47    58.35000  112.70000
   33    65    56    58.35000  112.70000
   33    65    69    58.35000  112.70000
   33    65    73    50.00000  109.50000
   33    38    39    35.00000  117.00000
   33    38    51    70.00000  124.00000
   37    40    41    37.50000  110.70000
   37    40    42    37.50000  110.70000
   37    40    53    63.00000  111.10000
   37    43    44    37.50000  110.70000
   37    43    45    37.50000  110.70000
   37    43    46    37.50000  110.70000
   37    47    48    37.50000  110.70000
   37    47    49    37.50000  110.70000
   37    47    50    37.50000  110.70000
   40    53    54    80.00000  120.40000
   40    53    56    70.00000  116.00000
   42    40    41    33.00000  107.80000
   53    40    41    35.00000  109.50000
   53    40    42    35.00000  109.50000
   53    56    57    35.00000  109.50000
   53    56    58    35.00000  109.50000
   53    56    65    63.00000  111.10000
   56    53    54    80.00000  120.40000
   56    65    69    58.35000  112.70000
   56    65    73    50.00000  109.50000
   58    56    57    33.00000  107.80000
   65    33    37    58.35000  112.70000
   65    56    57    37.50000  110.70000
   65    56    58    37.50000  110.70000
   65    69    70    37.50000  110.70000
   65    69    71    37.50000  110.70000
   65    69    72    37.50000  110.70000
   65    73    74    55.00000  108.50000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   73    65    69    50.00000  109.50000
   43    37    40    58.35000  112.70000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   47    37    40    58.35000  112.70000
   47    37    43    58.35000  112.70000
   49    47    48    33.00000  107.80000
   50    47    48    33.00000  107.80000
   50    47    49    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    65    70.00000  112.02700
   38    51    52    35.00000  120.00000
   38    51    55    70.00000  123.01800
   51    38    39    35.00000  120.00000
   51    55    59    70.00000  123.01800
   51    55    61    70.00000  124.00000
   55    51    52    35.00000  120.00000
   55    59    60    35.00000  120.00000
   55    59    66    65.00000  118.96000
   55    61    62    35.00000  109.50000
   55    61    63    35.00000  109.50000
   55    61    64    35.00000  109.50000
   59    66    67    80.00000  123.72100
   59    66    68    40.00000  115.75000
   66    59    60    40.00000  117.72500
   68    66    67    35.00000  123.00000
   61    55    59    70.00000  124.00000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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    65   0.01700  1.0 1.0
   24    29    33    65  -0.23550 -1.0 2.0
   24    29    33    65   0.21350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    40   0.44750  1.0 1.0
   29    33    37    40  -0.17800 -1.0 2.0
   29    33    37    40   0.20200  1.0 3.0
   29    33    37    43   0.44750  1.0 1.0
   29    33    37    43  -0.17800 -1.0 2.0
   29    33    37    43   0.20200  1.0 3.0
   29    33    37    47   0.44750  1.0 1.0
   29    33    37    47  -0.17800 -1.0 2.0
   29    33    37    47   0.20200  1.0 3.0
   29    33    65    56   0.44750  1.0 1.0
   29    33    65    56  -0.17800 -1.0 2.0
   29    33    65    56   0.20200  1.0 3.0
   29    33    65    69   0.44750  1.0 1.0
   29    33    65    69  -0.17800 -1.0 2.0
   29    33    65    69   0.20200  1.0 3.0
   29    33    65    73   0.56750  1.0 1.0
   29    33    65    73  -0.07550 -1.0 2.0
   29    33    65    73   0.20000  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    51   0.42700  1.0 1.0
   29    33    38    51  -0.70350 -1.0 2.0
   29    33    38    51  -0.43150  1.0 3.0
   33    37    40    41   0.15000  1.0 3.0
   33    37    40    42   0.15000  1.0 3.0
   33    37    40    53  -0.95700  1.0 1.0
   33    37    40    53  -0.18200 -1.0 2.0
   33    37    40    53   0.29450  1.0 3.0
   33    37    43    44   0.15000  1.0 3.0
   33    37    43    45   0.15000  1.0 3.0
   33    37    43    46   0.15000  1.0 3.0
   33    37    47    48   0.15000  1.0 3.0
   33    37    47    49   0.15000  1.0 3.0
   33    37    47    50   0.15000  1.0 3.0
   33    65    69    70   0.15000  1.0 3.0
   33    65    69    71   0.15000  1.0 3.0
   33    65    69    72   0.15000  1.0 3.0
   33    65    73    74  -0.11600  1.0 1.0
   33    65    73    74  -0.09450 -1.0 2.0
   33    65    73    74   0.21250  1.0 3.0
   33    38    51    52   7.00000 -1.0 2.0
   33    38    51    55   7.00000 -1.0 2.0
   37    33    65    56   0.56750  1.0 1.0
   37    33    65    56  -0.07550 -1.0 2.0
   37    33    65    56   0.20000  1.0 3.0
   37    33    65    69   0.56750  1.0 1.0
   37    33    65    69  -0.07550 -1.0 2.0
   37    33    65    69   0.20000  1.0 3.0
   37    33    65    73   0.86500  1.0 1.0
   37    33    65    73  -0.17500 -1.0 2.0
   37    33    65    73   0.20800  1.0 3.0
   37    33    38    39   0.00000  1.0 1.0
   37    33    38    51   0.09850  1.0 1.0
   37    33    38    51   0.15250 -1.0 2.0
   37    33    38    51  -0.50650  1.0 3.0
   37    40    53    54   0.30150 -1.0 2.0
   37    40   -53    56   0.60050  1.0 1.0
   37    40   -53    56   0.05600 -1.0 2.0
   37    40   -53    56   0.26150  1.0 3.0
   40    37    43    44   0.15000  1.0 3.0
   40    37    43    45   0.15000  1.0 3.0
   40    37    43    46   0.15000  1.0 3.0
   40    37    47    48   0.15000  1.0 3.0
   40    37    47    49   0.15000  1.0 3.0
   40    37    47    50   0.15000  1.0 3.0
   40    53    56    57   0.00000  1.0 1.0
   40    53    56    58   0.00000  1.0 1.0
   40    53    56    65   0.60050  1.0 1.0
   40    53    56    65   0.05600 -1.0 2.0
   40    53    56    65   0.26150  1.0 3.0
   41    40    53    54   0.00000  1.0 1.0
   41    40    53    56   0.00000  1.0 1.0
   42    40    53    54   0.00000  1.0 1.0
   42    40    53    56   0.00000  1.0 1.0
   53    56   -65    33  -0.95700  1.0 1.0
   53    56   -65    33  -0.18200 -1.0 2.0
   53    56   -65    33   0.29450  1.0 3.0
   53    56    65    69  -0.95700  1.0 1.0
   53    56    65    69  -0.18200 -1.0 2.0
   53    56    65    69   0.29450  1.0 3.0
   53    56    65    73  -0.09450  1.0 1.0
   53    56    65    73  -1.12950 -1.0 2.0
   53    56    65    73   0.54000  1.0 3.0
   54    53    56    57   0.00000  1.0 1.0
   54    53    56    58   0.00000  1.0 1.0
   54    53    56    65   0.30150 -1.0 2.0
   56    65    69    70   0.15000  1.0 3.0
   56    65    69    71   0.15000  1.0 3.0
   56    65    69    72   0.15000  1.0 3.0
   56    65    73    74  -0.11600  1.0 1.0
   56    65    73    74  -0.09450 -1.0 2.0
   56    65    73    74   0.21250  1.0 3.0
   57    56    65    33   0.15000  1.0 3.0
   57    56    65    69   0.15000  1.0 3.0
   57    56    65    73   0.23400  1.0 3.0
   58    56    65    33   0.15000  1.0 3.0
   58    56    65    69   0.15000  1.0 3.0
   58    56    65    73   0.23400  1.0 3.0
   65    33   -37    40   0.56750  1.0 1.0
   65    33   -37    40  -0.07550 -1.0 2.0
   65    33   -37    40   0.20000  1.0 3.0
   65    33    37    43   0.56750  1.0 1.0
   65    33    37    43  -0.07550 -1.0 2.0
   65    33    37    43   0.20000  1.0 3.0
   65    33    37    47   0.56750  1.0 1.0
   65    33    37    47  -0.07550 -1.0 2.0
   65    33    37    47   0.20000  1.0 3.0
   65    33    38    39   0.00000  1.0 1.0
   65    33    38    51   0.09850  1.0 1.0
   65    33    38    51   0.15250 -1.0 2.0
   65    33    38    51  -0.50650  1.0 3.0
   69    65    73    74  -0.11600  1.0 1.0
   69    65    73    74  -0.09450 -1.0 2.0
   69    65    73    74   0.21250  1.0 3.0
   73    65    69    70   0.23400  1.0 3.0
   73    65    69    71   0.23400  1.0 3.0
   73    65    69    72   0.23400  1.0 3.0
   43    37    40    41   0.15000  1.0 3.0
   43    37    40    42   0.15000  1.0 3.0
   43    37    40    53  -0.95700  1.0 1.0
   43    37    40    53  -0.18200 -1.0 2.0
   43    37    40    53   0.29450  1.0 3.0
   43    37    47    48   0.15000  1.0 3.0
   43    37    47    49   0.15000  1.0 3.0
   43    37    47    50   0.15000  1.0 3.0
   47    37    40    41   0.15000  1.0 3.0
   47    37    40    42   0.15000  1.0 3.0
   47    37    40    53  -0.95700  1.0 1.0
   47    37    40    53  -0.18200 -1.0 2.0
   47    37    40    53   0.29450  1.0 3.0
   47    37    43    44   0.15000  1.0 3.0
   47    37    43    45   0.15000  1.0 3.0
   47    37    43    46   0.15000  1.0 3.0
   38    33    37    40   0.34400  1.0 1.0
   38    33    37    40   0.09450 -1.0 2.0
   38    33    37    40   0.11100  1.0 3.0
   38    33    37    43   0.34400  1.0 1.0
   38    33    37    43   0.09450 -1.0 2.0
   38    33    37    43   0.11100  1.0 3.0
   38    33    37    47   0.34400  1.0 1.0
   38    33    37    47   0.09450 -1.0 2.0
   38    33    37    47   0.11100  1.0 3.0
   38    33    65    56   0.34400  1.0 1.0
   38    33    65    56   0.09450 -1.0 2.0
   38    33    65    56   0.11100  1.0 3.0
   38    33    65    69   0.34400  1.0 1.0
   38    33    65    69   0.09450 -1.0 2.0
   38    33    65    69   0.11100  1.0 3.0
   38    33    65    73   1.05650  1.0 1.0
   38    33    65    73   0.15600 -1.0 2.0
   38    33    65    73   0.53150  1.0 3.0
   38    51    55    59   0.28850  1.0 1.0
   38    51    55    59   2.61350 -1.0 2.0
   38    51    55    59   0.78400  1.0 3.0
   38    51    55    61  -0.18600  1.0 3.0
   39    38    51    52   7.00000 -1.0 2.0
   39    38    51    55   7.00000 -1.0 2.0
   51    55    59    60   7.00000 -1.0 2.0
   51    55    59    66   7.00000 -1.0 2.0
   51    55    61    62   0.00000  1.0 1.0
   51    55    61    63   0.00000  1.0 1.0
   51    55    61    64   0.00000  1.0 1.0
   52    51    55    59  -0.18600  1.0 3.0
   52    51    55    61   0.00000  1.0 1.0
   55    59    66    67   1.00000 -1.0 2.0
   55    59    66    68  -0.79650  1.0 1.0
   55    59    66    68   1.60950 -1.0 2.0
   55    59    66    68  -0.26250  1.0 3.0
   59    55    61    62   0.00000  1.0 1.0
   59    55    61    63   0.00000  1.0 1.0
   59    55    61    64   0.00000  1.0 1.0
   60    59    66    67   0.00000  1.0 1.0
   60    59    66    68   0.93100 -1.0 2.0
   61    55    59    60   7.00000 -1.0 2.0
   61    55    59    66   7.00000 -1.0 2.0
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
   40    56    53    54  10.50000 -1.0 2.0
   33    39    38    51  15.00000 -1.0 2.0
   55    52    51    38  15.00000 -1.0 2.0
   51    61    55    59  15.00000 -1.0 2.0
   66    60    59    55  15.00000 -1.0 2.0
   59    68    66    67  10.50000 -1.0 2.0
END
