* LIGAND DATABASE FILE (OPLS2005)
*
001      75    77    135    204     388
    1     0 S   NP   _N1_     1    29.31881    93.32685   -24.88823
    2     1 S   H    _HN1     2     1.02791   116.41363   -94.45605
    3     1 S   H    _H1_     3     1.02949    87.76707    14.97335
    4     1 S   H    _H2_     4     1.02827    19.33537  -162.16467
    5     1 S   CT   _CA1     5     1.50115   118.48109   127.04873
    6     5 S   HC   _HA1     6     1.09573   105.18679    78.74397
    7     5 S   CO3  _C1_     7     1.53783   112.49943   -41.48762
    8     7 S   O2Z  _O11     8     1.26372   115.01088   -42.05241
    9     7 S   O2Z  _O12     9     1.26242   114.94580   137.08839
   10     5 S   CT   _CB1    10     1.53068   107.41230  -163.27168
   11    10 S   HC   HB11    11     1.09836   109.35451   -49.66541
   12    10 S   HC   HB12    12     1.09813   110.44979    66.93561
   13    10 S   CT   _CG1    13     1.52996   112.62507  -170.63939
   14    13 S   HC   HG11    14     1.09577   110.65872   -66.17668
   15    13 S   HC   HG12    15     1.09669   109.77080    53.07132
   16    13 S   C    _CD1    16     1.51783   112.16111   173.52707
   17    16 S   O    _OE1    17     1.22742   123.26213     8.17464
   18    16 S   N    _N2_    18     1.38623   111.74565  -171.92785
   19    18 S   H    _HN2    19     1.01570   118.93101     1.84419
   20    18 S   CT1  _CA2    20     1.46172   123.34381   176.97819
   21    20 S   HC   _HA2    21     1.09734   109.58432     5.74689
   22    20 S   C    _C2_    22     1.53459   107.43699  -109.83056
   23    22 S   O    _O2_    23     1.23015   122.58403  -136.18300
   24    20 S   CT   _CB2    32     1.53397   111.83087   128.03513
   25    24 S   HC   HB21    33     1.09420   109.84542    57.55924
   26    24 S   HC   HB22    34     1.09367   108.95478   176.38253
   27    22 S   N    _N3_    24     1.38427   113.32603    49.84158
   28    27 S   H    _HN3    25     1.01587   119.65807    -1.65965
   29    24 S   S    _SG2    35     1.82957   111.32032   -63.76181
   30    27 S   CT   _CA3    26     1.45272   123.10593   177.67443
   31    30 S   HC   HA31    27     1.09551   107.36806   -67.76694
   32    30 S   HC   HA32    28     1.09557   108.13862    48.67911
   33    29 S   CT   _C20    36     1.86108   102.06836   179.55677
   34    30 S   CO3  _C3_    29     1.52955   114.12958   170.78469
   35    34 S   O2Z  _O31    30     1.26371   116.11563    -1.19091
   36    34 S   O2Z  _O32    31     1.26439   114.40735   178.91052
   37    33 S   CT   _C15    37     1.54050   108.70560   -67.70912
   38    37 S   HC   _H29    38     1.09477   112.00930    70.07922
   39    37 S   HC   _H30    39     1.09643   111.02741  -170.65917
   40    37 S   HC   _H31    40     1.09645   111.84473   -51.47465
   41    33 S   CT   _C16    41     1.54196   105.71601   176.72398
   42    41 S   HC   _H32    42     1.09587   112.16469   -60.42288
   43    41 S   HC   _H33    43     1.09706   111.64264    60.44448
   44    41 S   HC   _H34    44     1.09611   111.14150   179.51141
   45    33 S   CT   _C19    45     1.55470   112.84213    55.03955
   46    45 S   HC   _H40    46     1.09589   109.89284   -65.20733
   47    45 S   CT   _C18    47     1.53551   115.38721    59.18391
   48    47 S   HC   _H38    48     1.09691   110.52007    75.14565
   49    47 S   HC   _H39    49     1.09428   111.17705   -46.74580
   50    45 S   OH   _O21    74     1.43646   109.10413  -179.77100
   51    50 S   HO   _H41    75     0.97347   107.13553  -179.69226
   52    47 S   OS   _O23    50     1.43928   107.25858  -166.92158
   53    52 S   CA   _C11    51     1.37018   110.12380   170.35704
   54    53 S   C56A _C8_    52     1.39330   121.69971    96.23813
   55    54 S   C56B _C6_    53     1.39181   123.72183   178.14270
   56    55 S   C5B  _C4_    54     1.42210   105.50457   178.60478
   57    56 S   HA   _H25    55     1.08083   127.47913  -179.54803
   58    55 S   CA   _C10    59     1.41338   118.42644    -1.13505
   59    56 S   C5A  _C5_    56     1.37519   106.53729     0.74283
   60    59 S   HA   _H26    57     1.08037   133.72857   179.73681
   61    58 S   CA   _C7_    60     1.41083   119.62531     1.88440
   62    58 S   OS   _O22    69     1.37948   120.63372   177.84541
   63    54 S   OA   _O19    58     1.36295   125.92616    -2.46696
   64    53 S   CA   _C9_    61     1.40031   121.83021   -86.44521
   65    62 S   CT   _C17    70     1.42820   110.15052    82.12409
   66    65 S   HC   _H35    71     1.09410   107.76120   173.06045
   67    65 S   HC   _H36    72     1.09583   111.45534    54.74396
   68    65 S   HC   _H37    73     1.09464   111.21827   -68.80435
   69    64 S   OS   _O20    62     1.41633   117.12233     2.17853
   70    69 S   CO4  _C14    63     1.38805   122.30429   177.40256
   71    70 S   O    _O18    64     1.22532   122.24672  -178.40676
   72    70 S   CM   _C13    65     1.47120   116.46141     1.60730
   73    72 S   HC   _H28    66     1.08432   117.14315   179.50347
   74    61 S   CM   _C12    67     1.45921   122.73806   177.80492
   75    74 S   HC   _H27    68     1.08453   119.11486    -0.43969
  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  13   5   4   3
  16   2   1   1  11   4   3   2   7   3   2   1   8   6   8   4
   3   2   1   7  11  11  11   7   4  13   2   1   9   6   1   6
   3   2   1   1   5   5   3   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    41    45    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    40    41    42    43    44    45    46    47    50  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    42    43    44    45    46    47    48    49    52    50    51  
   35    36  
   36  
    0  
   38    39    40    41    42    43    44    45    46    47    50  
   39    40    41    45  
   40    41    45  
   41    45  
   42    43    44    45    46    47    50  
   43    44    45  
   44    45  
   45  
   46    47    48    49    52    53    50    51  
   47    48    49    52    50    51  
   48    49    52    53    54    64    50    51  
   49    52    53    50  
   52    53    50  
   51    52  
    0  
   53    54    55    63    61    64    69  
   54    55    56    59    63    58    61    64    69    70    74  
   55    56    57    59    60    63    58    61    64    69    62  
   56    57    59    60    63    58    61    64    74    62    65  
   57    59    60    63    58    61    62  
   59    60    63    58  
   61    64    69    72    74    75    62    65    66    67    68    59    63  
   60    63  
   63  
   64    69    70    72    73    74    75    62    65  
   65    66    67    68    64    74  
   64  
   69    70    71    72    74    75  
   66    67    68  
   67    68  
   68  
    0  
   70    71    72    73    74  
   71    72    73    74    75  
   72    73    74  
   73    74    75  
   74    75  
   75  
    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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   2.9000   0.1400  -0.300000   1.7660   1.5600   0.020110767  -0.896042159
   53   3.5500   0.0700  -0.029000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700   0.323000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0700   0.258100   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700  -0.514600   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.241900   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.0700  -0.010800   2.5000   1.7750   0.001000000  -0.843144165
   59   3.5500   0.0700   0.079700   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.171600   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700  -0.035400   2.5000   1.7750   0.001000000  -0.843144165
   62   2.9000   0.1400  -0.300000   1.7660   1.5600   0.020110767  -0.896042159
   63   3.0000   0.1700  -0.311500   1.7000   1.5000   0.001000000  -0.126889456
   64   3.5500   0.0700   0.127000   2.5000   1.7750   0.001000000  -0.843144165
   65   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   69   3.0000   0.1700  -0.180000   1.7660   1.5600   0.020110767  -0.896042159
   70   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   71   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   72   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   73   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   75   2.4200   0.0300   0.115000   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   268.000  1.529
   33    41   268.000  1.529
   33    45   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    40   340.000  1.090
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   340.000  1.090
   45    46   340.000  1.090
   45    47   268.000  1.529
   45    50   320.000  1.410
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    52   320.000  1.410
   52    53   450.000  1.364
   53    54   469.000  1.400
   53    64   469.000  1.400
   54    55   447.000  1.419
   54    63   425.000  1.380
   55    56   380.000  1.440
   55    58   469.000  1.404
   56    57   367.000  1.080
   56    59   520.000  1.370
   59    60   367.000  1.080
   59    63   340.000  1.360
   58    61   469.000  1.400
   58    62   450.000  1.364
   61    64   469.000  1.400
   61    74   320.000  1.460
   64    69   450.000  1.364
   69    70   214.000  1.327
   70    71   570.000  1.229
   70    72   320.000  1.462
   72    73   340.000  1.080
   72    74   549.000  1.340
   74    75   340.000  1.080
   62    65   320.000  1.410
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   50    51   553.000  0.945
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    41    75.00000  111.63000
   29    33    45    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    40    37.50000  110.70000
   33    41    42    37.50000  110.70000
   33    41    43    37.50000  110.70000
   33    41    44    37.50000  110.70000
   33    45    46    37.50000  110.70000
   33    45    47    58.35000  112.70000
   33    45    50    50.00000  109.50000
   39    37    38    33.00000  107.80000
   40    37    38    33.00000  107.80000
   40    37    39    33.00000  107.80000
   41    33    37    58.35000  112.70000
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    33.00000  107.80000
   45    33    37    58.35000  112.70000
   45    33    41    58.35000  112.70000
   45    47    48    37.50000  110.70000
   45    47    49    37.50000  110.70000
   45    47    52    50.00000  109.50000
   45    50    51    55.00000  108.50000
   47    45    46    37.50000  110.70000
   47    52    53    75.00000  111.00000
   49    47    48    33.00000  107.80000
   52    47    48    35.00000  109.50000
   52    47    49    35.00000  109.50000
   52    53    54    70.00000  120.00000
   52    53    64    70.00000  120.00000
   53    54    55    85.00000  122.70000
   53    54    63    70.00000  124.10000
   53    64    61    63.00000  120.00000
   53    64    69    70.00000  120.00000
   54    55    56    80.00000  107.43600
   54    55    58    85.00000  116.20000
   54    63    59   110.00000  105.28000
   55    56    57    35.00000  127.20800
   55    56    59    80.00000  105.82900
   55    58    61    63.00000  120.00000
   55    58    62    70.00000  120.00000
   56    59    60    35.00000  130.70000
   56    59    63    70.00000  108.00000
   59    56    57    35.00000  128.20000
   63    54    55   100.00000  108.43400
   63    59    60    35.00000  113.40000
   58    55    56    50.00000  134.85500
   58    61    64    63.00000  120.00000
   58    61    74    60.00000  120.93500
   58    62    65    75.00000  111.00000
   61    64    69    70.00000  120.00000
   61    74    72    60.00000  123.20500
   61    74    75    40.00000  117.26300
   64    53    54    85.00000  120.00000
   64    69    70    85.00000  115.98000
   69    70    71    83.00000  123.40000
   69    70    72    90.00000  111.29400
   70    72    73    40.00000  117.72500
   70    72    74    65.00000  118.96000
   72    70    71    80.00000  123.72100
   72    74    75    35.00000  120.00000
   74    61    64    60.00000  120.93500
   74    72    73    35.00000  120.00000
   62    58    61    70.00000  120.00000
   62    65    66    35.00000  109.50000
   62    65    67    35.00000  109.50000
   62    65    68    35.00000  109.50000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   50    45    46    35.00000  109.50000
   50    45    47    50.00000  109.50000
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    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   0.21350  1.0 3.0
   24    29    33    45   0.01700  1.0 1.0
   24    29    33    45  -0.23550 -1.0 2.0
   24    29    33    45   0.21350  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   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    40   0.15000  1.0 3.0
   29    33    41    42   0.15000  1.0 3.0
   29    33    41    43   0.15000  1.0 3.0
   29    33    41    44   0.15000  1.0 3.0
   29    33    45    46   0.15000  1.0 3.0
   29    33    45    47   0.44750  1.0 1.0
   29    33    45    47  -0.17800 -1.0 2.0
   29    33    45    47   0.20200  1.0 3.0
   29    33    45    50   0.56750  1.0 1.0
   29    33    45    50  -0.07550 -1.0 2.0
   29    33    45    50   0.20000  1.0 3.0
   33    45    47    48   0.15000  1.0 3.0
   33    45    47    49   0.15000  1.0 3.0
   33    45    47    52   0.62750  1.0 1.0
   33    45    47    52  -0.30950 -1.0 2.0
   33    45    47    52   0.27300  1.0 3.0
   33    45    50    51  -0.11600  1.0 1.0
   33    45    50    51  -0.09450 -1.0 2.0
   33    45    50    51   0.21250  1.0 3.0
   37    33    41    42   0.15000  1.0 3.0
   37    33    41    43   0.15000  1.0 3.0
   37    33    41    44   0.15000  1.0 3.0
   37    33    45    46   0.15000  1.0 3.0
   37    33    45    47   0.56750  1.0 1.0
   37    33    45    47  -0.07550 -1.0 2.0
   37    33    45    47   0.20000  1.0 3.0
   37    33    45    50   0.86500  1.0 1.0
   37    33    45    50  -0.17500 -1.0 2.0
   37    33    45    50   0.20800  1.0 3.0
   41    33    37    38   0.15000  1.0 3.0
   41    33    37    39   0.15000  1.0 3.0
   41    33    37    40   0.15000  1.0 3.0
   41    33    45    46   0.15000  1.0 3.0
   41    33    45    47   0.56750  1.0 1.0
   41    33    45    47  -0.07550 -1.0 2.0
   41    33    45    47   0.20000  1.0 3.0
   41    33    45    50   0.86500  1.0 1.0
   41    33    45    50  -0.17500 -1.0 2.0
   41    33    45    50   0.20800  1.0 3.0
   45    33    37    38   0.15000  1.0 3.0
   45    33    37    39   0.15000  1.0 3.0
   45    33    37    40   0.15000  1.0 3.0
   45    33    41    42   0.15000  1.0 3.0
   45    33    41    43   0.15000  1.0 3.0
   45    33    41    44   0.15000  1.0 3.0
   45    47    52    53  -0.32850  1.0 1.0
   45    47    52    53  -0.35800 -1.0 2.0
   45    47    52    53   0.33950  1.0 3.0
   46    45    47    48   0.15000  1.0 3.0
   46    45    47    49   0.15000  1.0 3.0
   46    45    47    52   0.23400  1.0 3.0
   46    45    50    51   0.19450  1.0 3.0
   47    45    50    51  -0.11600  1.0 1.0
   47    45    50    51  -0.09450 -1.0 2.0
   47    45    50    51   0.21250  1.0 3.0
   47    52    53    54   1.63200 -1.0 2.0
   47    52    53    64   1.63200 -1.0 2.0
   48    47    52    53   0.08050  1.0 3.0
   49    47    52    53   0.08050  1.0 3.0
   52    53    54    55   3.62500 -1.0 2.0
   52    53    54    63   3.62500 -1.0 2.0
   52    53    64    61   3.62500 -1.0 2.0
   52    53    64    69   3.62500 -1.0 2.0
   53    54    55    56   3.00000 -1.0 2.0
   53    54    55    58   3.00000 -1.0 2.0
   53    54    63    59   3.62500 -1.0 2.0
   53    64    69    70   0.01300  1.0 1.0
   53    64    69    70   0.97950 -1.0 2.0
   53    64    69    70  -0.55700  1.0 3.0
   54    53    64    61   3.62500 -1.0 2.0
   54    53    64    69   3.62500 -1.0 2.0
   54    55    56    57   3.50000 -1.0 2.0
   54    55   -56    59   3.50000 -1.0 2.0
   54    55   -58    61   3.50000 -1.0 2.0
   54    55    58    62   3.62500 -1.0 2.0
   55    54   -63    59   3.62500 -1.0 2.0
   55    56    59    60   3.62500 -1.0 2.0
   55    56   -59    63   3.62500 -1.0 2.0
   55    58    61    64   3.62500 -1.0 2.0
   55    58    61    74   3.62500 -1.0 2.0
   55    58    62    65   1.63200 -1.0 2.0
   56    55    58    61   3.62500 -1.0 2.0
   56    55    58    62   3.62500 -1.0 2.0
   56    59   -63    54   3.62500 -1.0 2.0
   57    56    59    60   3.62500 -1.0 2.0
   57    56    59    63   3.62500 -1.0 2.0
   60    59    63    54   3.62500 -1.0 2.0
   63    54   -55    56   3.62500 -1.0 2.0
   63    54    55    58   3.62500 -1.0 2.0
   58    55    56    57   3.62500 -1.0 2.0
   58    55    56    59   3.62500 -1.0 2.0
   58    61   -64    53   3.62500 -1.0 2.0
   58    61    64    69   3.62500 -1.0 2.0
   58    61    74    72   0.15800  1.0 1.0
   58    61    74    72   1.85350 -1.0 2.0
   58    61    74    72  -0.48700  1.0 3.0
   58    61    74    75   0.56550  1.0 3.0
   58    62    65    66   0.08050  1.0 3.0
   58    62    65    67   0.08050  1.0 3.0
   58    62    65    68   0.08050  1.0 3.0
   61    58    62    65   1.63200 -1.0 2.0
   61    64    69    70   0.01300  1.0 1.0
   61    64    69    70   0.97950 -1.0 2.0
   61    64    69    70  -0.55700  1.0 3.0
   64    53   -54    55   3.62500 -1.0 2.0
   64    53    54    63   3.62500 -1.0 2.0
   64    61    74    72   0.15800  1.0 1.0
   64    61    74    72   1.85350 -1.0 2.0
   64    61    74    72  -0.48700  1.0 3.0
   64    61    74    75   0.56550  1.0 3.0
   64    69    70    71   3.00000 -1.0 2.0
   64    69   -70    72   2.00000 -1.0 2.0
   69    70    72    73   1.63100 -1.0 2.0
   69    70    72    74  -0.56150  1.0 1.0
   69    70    72    74   2.19150 -1.0 2.0
   70    72   -74    61   7.00000 -1.0 2.0
   70    72    74    75   7.00000 -1.0 2.0
   71    70    72    73   0.00000  1.0 1.0
   71    70    72    74   1.00000 -1.0 2.0
   73    72    74    61   7.00000 -1.0 2.0
   73    72    74    75   7.00000 -1.0 2.0
   74    61    64    53   3.62500 -1.0 2.0
   74    61   -64    69   3.62500 -1.0 2.0
   62    58    61    64   3.62500 -1.0 2.0
   62    58    61    74   3.62500 -1.0 2.0
   50    45    47    48   0.23400  1.0 3.0
   50    45    47    49   0.23400  1.0 3.0
   50    45    47    52   3.69350  1.0 1.0
   50    45    47    52  -1.82950 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   54    64    53    52   4.00000 -1.0 2.0
   55    63    54    53   4.00000 -1.0 2.0
   56    58    55    54   4.00000 -1.0 2.0
   59    57    56    55   1.10000 -1.0 2.0
   63    60    59    56   1.10000 -1.0 2.0
   61    62    58    55   4.00000 -1.0 2.0
   64    74    61    58   4.00000 -1.0 2.0
   61    69    64    53   4.00000 -1.0 2.0
   69    72    70    71  10.50000 -1.0 2.0
   70    73    72    74   1.10000 -1.0 2.0
   61    75    74    72   1.10000 -1.0 2.0
END
