* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    143    227     425
    1     0 S   NP   _N1_     1    27.99192    96.08846   -23.30702
    2     1 S   H    _HN1     2     1.02776   102.47921  -103.97371
    3     1 S   H    _H1_     3     1.02958    80.14469     2.80498
    4     1 S   H    _H2_     4     1.02835    31.26911   152.02556
    5     1 S   CT   _CA1     5     1.50127   137.06017   112.21408
    6     5 S   HC   _HA1     6     1.09574   105.21886    79.96103
    7     5 S   CO3  _C1_     7     1.53791   112.38549   -40.23860
    8     7 S   O2Z  _O11     8     1.26366   114.99446   -43.37343
    9     7 S   O2Z  _O12     9     1.26237   114.93862   135.75653
   10     5 S   CT   _CB1    10     1.53101   107.42595  -162.11278
   11    10 S   HC   HB11    11     1.09825   109.34748   -50.44606
   12    10 S   HC   HB12    12     1.09816   110.41885    66.11954
   13    10 S   CT   _CG1    13     1.53006   112.65955  -171.51997
   14    13 S   HC   HG11    14     1.09599   110.48122   -64.16369
   15    13 S   HC   HG12    15     1.09656   109.93166    55.02950
   16    13 S   C    _CD1    16     1.51834   112.35029   175.41017
   17    16 S   O    _OE1    17     1.22740   123.32265    -0.33977
   18    16 S   N    _N2_    18     1.38538   111.65154   179.62622
   19    18 S   H    _HN2    19     1.01559   118.96924     4.74842
   20    18 S   CT1  _CA2    20     1.45865   122.98114   178.28902
   21    20 S   HC   _HA2    21     1.09722   109.03102    22.49534
   22    20 S   C    _C2_    22     1.52874   106.89033   -94.68950
   23    22 S   O    _O2_    23     1.22982   122.97356   -28.53271
   24    20 S   CT   _CB2    32     1.53367   112.03507   145.74588
   25    24 S   HC   HB21    33     1.09256   109.26065    54.69346
   26    24 S   HC   HB22    34     1.09404   109.62407   173.29764
   27    22 S   N    _N3_    24     1.38469   112.59929   154.32192
   28    27 S   H    _HN3    25     1.01659   120.39465    -2.03240
   29    24 S   S    _SG2    35     1.82646   110.42634   -67.04320
   30    27 S   CT   _CA3    26     1.45361   122.46189   178.58404
   31    30 S   HC   HA31    27     1.09566   107.69774   -58.32670
   32    30 S   HC   HA32    28     1.09565   107.71259    58.00039
   33    29 S   CT   _C14    36     1.90910   104.06826   169.05628
   34    30 S   CO3  _C3_    29     1.52889   114.33344   179.84805
   35    34 S   O2Z  _O31    30     1.26332   116.05189    -0.22728
   36    34 S   O2Z  _O32    31     1.26439   114.41023   179.77794
   37    33 S   CM   _C4_    37     1.56413   102.21242   150.40146
   38    33 S   CT   _C13    60     1.55862   111.82952    28.10501
   39    38 S   HC   _H30    61     1.09664   108.94350   -61.36601
   40    37 S   CMA  _C5_    38     1.36328   124.36169   100.44109
   41    40 S   OM   _O16    39     1.26537   130.05358   178.89606
   42    37 S   CT   _C16    70     1.52400   116.78765   -77.77700
   43    42 S   HC   _H31    71     1.09358   110.65541   -76.76611
   44    42 S   HC   _H32    72     1.09503   113.10278   163.43074
   45    42 S   HC   _H33    73     1.09397   111.37577    44.76560
   46    40 S   CT   _C7_    40     1.52438   120.93235    -1.47246
   47    46 S   HC   _H20    41     1.10040   109.06464   114.62084
   48    46 S   HC   _H21    42     1.10094   110.39738  -129.61555
   49    46 S   CT   _C8_    43     1.52404   116.10458    -7.94493
   50    49 S   HC   _H22    44     1.09837   108.46612   161.53822
   51    49 S   HC   _H23    45     1.09749   108.75450   -84.40371
   52    33 S   CT   _C15    46     1.60191   111.74320   -91.29158
   53    52 S   CT   _C10    47     1.57456   111.18226   173.05683
   54    53 S   HC   _H26    48     1.09763   109.94781  -174.05782
   55    53 S   HC   _H27    49     1.09575   110.51827    69.84883
   56    52 S   CT   _C18    66     1.55187   114.08018    52.26224
   57    56 S   HC   _H37    67     1.09261   112.78770    57.97755
   58    56 S   HC   _H38    68     1.09426   112.17690   -64.52608
   59    56 S   HC   _H39    69     1.09718   110.60095   177.23409
   60    53 S   CT   _C9_    50     1.53319   114.64847   -51.02227
   61    60 S   HC   _H24    51     1.09590   109.55988   174.50549
   62    60 S   HC   _H25    52     1.09592   110.31354   -68.33204
   63    60 S   CT   _C12    53     1.51631   108.97660    53.81483
   64    63 S   HC   _H29    54     1.09856   109.01391    62.27861
   65    63 S   CT   _C11    55     1.51862   117.55159  -173.76395
   66    65 S   HC   _H28    56     1.09630   111.59617    41.81475
   67    65 S   CO4  _C6_    57     1.51648   100.22995   156.14000
   68    67 S   O    _O17    58     1.22097   126.11743   160.25198
   69    65 S   CT   _C17    62     1.51737   113.11512   -83.75110
   70    69 S   HC   _H34    63     1.09564   111.55910   -58.92508
   71    69 S   HC   _H35    64     1.09528   110.55420  -178.09813
   72    69 S   HC   _H36    65     1.09440   111.00617    61.99581
   73    67 S   OS   _O18    59     1.37593   109.62699   -20.59379
  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
  27   2   1   1  17  18   7  12   5   5   2   1   1   8   5   4
  11   4   3  12  12   6   5   4   2   1   1   9   4   3  10   5
   8   7   6   2   4   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    52    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    49    52    53    63    73    38    39    56    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    46    49    50    51    52    53    54    55    60    63    64    65    67    73    38    39    56    57    58    59    42    43    44    45  
   35    36  
   36  
    0  
   40    41    46    47    48    49    52    53    63    73    38    39    56    42    43    44    45  
   39    69    56    42    40    49    52    53    60    61    62    63    64    65    66    67    68    73  
   52    60    63    64    65    67    73  
   41    46    47    48    49    50    51    52    42    43    44    45  
   46    47    48    49    42  
   43    44    45    46    52  
   44    45  
   45  
    0  
   47    48    49    50    51    52    53    56  
   48    49    50    51    52  
   49    50    51    52  
   50    51    52    53    54    55    60    56    57    58    59  
   51    52    53    56  
   52    53    56  
   53    54    55    60    61    62    63    73    56    57    58    59  
   54    55    60    61    62    63    64    65    56    57    58    59  
   55    60    61    62    63    56  
   60    61    62    63    56  
   57    58    59    60  
   58    59  
   59  
    0  
   61    62    63    64    65    66    67    73    69  
   62    63    64    65  
   63    64    65  
   64    65    66    67    68    73    69    70    71    72  
   65    66    67    73    69  
   66    67    68    73    69    70    71    72  
   67    68    73    69    70    71    72  
   68    73    69    70    71    72  
   73    69  
   70    71    72    73  
   71    72  
   72  
    0  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   67   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   68   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    52   268.000  1.529
   33    38   268.000  1.529
   37    40   465.000  1.376
   37    42   317.000  1.510
   40    41   745.000  1.250
   40    46   270.000  1.512
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   268.000  1.529
   52    53   268.000  1.529
   52    56   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   268.000  1.529
   63    64   340.000  1.090
   63    65   268.000  1.529
   63    38   268.000  1.529
   65    66   340.000  1.090
   65    67   317.000  1.522
   65    69   268.000  1.529
   67    68   570.000  1.229
   67    73   214.000  1.327
   73    38   320.000  1.410
   38    39   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    52    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    40    70.00000  124.00000
   33    37    42    65.00000  117.92700
   33    52    49    58.35000  112.70000
   33    52    53    58.35000  112.70000
   33    52    56    58.35000  112.70000
   33    38    63    58.35000  112.70000
   33    38    73    50.00000  109.50000
   33    38    39    37.50000  110.70000
   37    40    41    65.00000  137.10300
   37    40    46    65.00000  122.18000
   37    42    43    35.00000  109.50000
   37    42    44    35.00000  109.50000
   37    42    45    35.00000  109.50000
   40    46    47    45.00000  110.52000
   40    46    48    45.00000  110.52000
   40    46    49    70.00000  112.02700
   46    40    41    85.00000  112.85300
   46    49    50    37.50000  110.70000
   46    49    51    37.50000  110.70000
   46    49    52    58.35000  112.70000
   48    46    47    33.00000  107.80000
   49    46    47    37.50000  110.70000
   49    46    48    37.50000  110.70000
   49    52    53    58.35000  112.70000
   49    52    56    58.35000  112.70000
   51    49    50    33.00000  107.80000
   52    33    37    70.00000  112.02700
   52    49    50    37.50000  110.70000
   52    49    51    37.50000  110.70000
   52    53    54    37.50000  110.70000
   52    53    55    37.50000  110.70000
   52    53    60    58.35000  112.70000
   52    56    57    37.50000  110.70000
   52    56    58    37.50000  110.70000
   52    56    59    37.50000  110.70000
   53    60    61    37.50000  110.70000
   53    60    62    37.50000  110.70000
   53    60    63    58.35000  112.70000
   55    53    54    33.00000  107.80000
   60    53    54    37.50000  110.70000
   60    53    55    37.50000  110.70000
   60    63    64    37.50000  110.70000
   60    63    65    58.35000  112.70000
   60    63    38    58.35000  112.70000
   62    60    61    33.00000  107.80000
   63    60    61    37.50000  110.70000
   63    60    62    37.50000  110.70000
   63    65    66    37.50000  110.70000
   63    65    67    63.00000  111.10000
   63    65    69    58.35000  112.70000
   63    38    73    50.00000  109.50000
   63    38    39    37.50000  110.70000
   65    63    64    37.50000  110.70000
   65    67    68    80.00000  120.40000
   65    67    73    81.00000  111.40000
   65    69    70    37.50000  110.70000
   65    69    71    37.50000  110.70000
   65    69    72    37.50000  110.70000
   67    65    66    35.00000  109.50000
   67    73    38    83.00000  116.90000
   73    67    68    83.00000  123.40000
   73    38    39    35.00000  109.50000
   38    33    37    70.00000  112.02700
   38    33    52    58.35000  112.70000
   38    63    64    37.50000  110.70000
   38    63    65    58.35000  112.70000
   69    65    66    37.50000  110.70000
   69    65    67    63.00000  111.10000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   56    52    53    58.35000  112.70000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   42    37    40    70.00000  124.00000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   0.21350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   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    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    37    42   0.30250  1.0 1.0
   29    33    37    42  -0.14950 -1.0 2.0
   29    33    37    42   0.36900  1.0 3.0
   29    33    52    49   0.44750  1.0 1.0
   29    33    52    49  -0.17800 -1.0 2.0
   29    33    52    49   0.20200  1.0 3.0
   29    33    52    53   0.44750  1.0 1.0
   29    33    52    53  -0.17800 -1.0 2.0
   29    33    52    53   0.20200  1.0 3.0
   29    33    52    56   0.44750  1.0 1.0
   29    33    52    56  -0.17800 -1.0 2.0
   29    33    52    56   0.20200  1.0 3.0
   29    33    38    63   0.44750  1.0 1.0
   29    33    38    63  -0.17800 -1.0 2.0
   29    33    38    63   0.20200  1.0 3.0
   29    33    38    73   0.56750  1.0 1.0
   29    33    38    73  -0.07550 -1.0 2.0
   29    33    38    73   0.20000  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    46   7.00000 -1.0 2.0
   33    37    42    43   0.34800  1.0 3.0
   33    37    42    44   0.34800  1.0 3.0
   33    37    42    45   0.34800  1.0 3.0
   33    52    53    54   0.15000  1.0 3.0
   33    52    53    55   0.15000  1.0 3.0
   33    52    53    60   0.56750  1.0 1.0
   33    52    53    60  -0.07550 -1.0 2.0
   33    52    53    60   0.20000  1.0 3.0
   33    52    56    57   0.15000  1.0 3.0
   33    52    56    58   0.15000  1.0 3.0
   33    52    56    59   0.15000  1.0 3.0
   37    33    52    49   0.34400  1.0 1.0
   37    33    52    49   0.09450 -1.0 2.0
   37    33    52    49   0.11100  1.0 3.0
   37    33    52    53   0.34400  1.0 1.0
   37    33    52    53   0.09450 -1.0 2.0
   37    33    52    53   0.11100  1.0 3.0
   37    33    52    56   0.34400  1.0 1.0
   37    33    52    56   0.09450 -1.0 2.0
   37    33    52    56   0.11100  1.0 3.0
   37    33    38    63   0.34400  1.0 1.0
   37    33    38    63   0.09450 -1.0 2.0
   37    33    38    63   0.11100  1.0 3.0
   37    33    38    73   0.61850  1.0 1.0
   37    33    38    73  -0.22750 -1.0 2.0
   37    33    38    73   0.15300  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    40    46    47   0.00000  1.0 1.0
   37    40    46    48   0.00000  1.0 1.0
   37    40   -46    49   0.09850  1.0 1.0
   37    40   -46    49   0.15250 -1.0 2.0
   37    40   -46    49  -0.50650  1.0 3.0
   40    37    42    43   0.00000  1.0 1.0
   40    37    42    44   0.00000  1.0 1.0
   40    37    42    45   0.00000  1.0 1.0
   40    46    49    50   0.15000  1.0 3.0
   40    46    49    51   0.15000  1.0 3.0
   40    46    49    52   0.34400  1.0 1.0
   40    46    49    52   0.09450 -1.0 2.0
   40    46    49    52   0.11100  1.0 3.0
   41    40    46    47   0.00000  1.0 1.0
   41    40    46    48   0.00000  1.0 1.0
   41    40    46    49   0.09700  1.0 1.0
   41    40    46    49   0.15600 -1.0 2.0
   41    40    46    49  -0.50800  1.0 3.0
   46    49   -52    33   0.56750  1.0 1.0
   46    49   -52    33  -0.07550 -1.0 2.0
   46    49   -52    33   0.20000  1.0 3.0
   46    49    52    53   0.56750  1.0 1.0
   46    49    52    53  -0.07550 -1.0 2.0
   46    49    52    53   0.20000  1.0 3.0
   46    49    52    56   0.56750  1.0 1.0
   46    49    52    56  -0.07550 -1.0 2.0
   46    49    52    56   0.20000  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    51   0.15000  1.0 3.0
   47    46    49    52   0.15000  1.0 3.0
   48    46    49    50   0.15000  1.0 3.0
   48    46    49    51   0.15000  1.0 3.0
   48    46    49    52   0.15000  1.0 3.0
   49    52    53    54   0.15000  1.0 3.0
   49    52    53    55   0.15000  1.0 3.0
   49    52    53    60   0.56750  1.0 1.0
   49    52    53    60  -0.07550 -1.0 2.0
   49    52    53    60   0.20000  1.0 3.0
   49    52    56    57   0.15000  1.0 3.0
   49    52    56    58   0.15000  1.0 3.0
   49    52    56    59   0.15000  1.0 3.0
   50    49    52    33   0.15000  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    56   0.15000  1.0 3.0
   51    49    52    33   0.15000  1.0 3.0
   51    49    52    53   0.15000  1.0 3.0
   51    49    52    56   0.15000  1.0 3.0
   52    33   -37    40   0.09850  1.0 1.0
   52    33   -37    40   0.15250 -1.0 2.0
   52    33   -37    40  -0.50650  1.0 3.0
   52    33    37    42   0.46850  1.0 1.0
   52    33    37    42   0.08550 -1.0 2.0
   52    33    37    42   0.09800  1.0 3.0
   52    33    38    63   0.56750  1.0 1.0
   52    33    38    63  -0.07550 -1.0 2.0
   52    33    38    63   0.20000  1.0 3.0
   52    33    38    73   0.62750  1.0 1.0
   52    33    38    73  -0.30950 -1.0 2.0
   52    33    38    73   0.27300  1.0 3.0
   52    33    38    39   0.15000  1.0 3.0
   52    53    60    61   0.15000  1.0 3.0
   52    53    60    62   0.15000  1.0 3.0
   52    53   -60    63   0.56750  1.0 1.0
   52    53   -60    63  -0.07550 -1.0 2.0
   52    53   -60    63   0.20000  1.0 3.0
   53    52    56    57   0.15000  1.0 3.0
   53    52    56    58   0.15000  1.0 3.0
   53    52    56    59   0.15000  1.0 3.0
   53    60    63    64   0.15000  1.0 3.0
   53    60    63    65   0.56750  1.0 1.0
   53    60    63    65  -0.07550 -1.0 2.0
   53    60    63    65   0.20000  1.0 3.0
   53    60    63    38   0.56750  1.0 1.0
   53    60    63    38  -0.07550 -1.0 2.0
   53    60    63    38   0.20000  1.0 3.0
   54    53    60    61   0.15000  1.0 3.0
   54    53    60    62   0.15000  1.0 3.0
   54    53    60    63   0.15000  1.0 3.0
   55    53    60    61   0.15000  1.0 3.0
   55    53    60    62   0.15000  1.0 3.0
   55    53    60    63   0.15000  1.0 3.0
   60    63    65    66   0.15000  1.0 3.0
   60    63    65    67  -0.95700  1.0 1.0
   60    63    65    67  -0.18200 -1.0 2.0
   60    63    65    67   0.29450  1.0 3.0
   60    63    65    69   0.56750  1.0 1.0
   60    63    65    69  -0.07550 -1.0 2.0
   60    63    65    69   0.20000  1.0 3.0
   60    63   -38    33   0.56750  1.0 1.0
   60    63   -38    33  -0.07550 -1.0 2.0
   60    63   -38    33   0.20000  1.0 3.0
   60    63    38    73   0.62750  1.0 1.0
   60    63    38    73  -0.30950 -1.0 2.0
   60    63    38    73   0.27300  1.0 3.0
   60    63    38    39   0.15000  1.0 3.0
   61    60    63    64   0.15000  1.0 3.0
   61    60    63    65   0.15000  1.0 3.0
   61    60    63    38   0.15000  1.0 3.0
   62    60    63    64   0.15000  1.0 3.0
   62    60    63    65   0.15000  1.0 3.0
   62    60    63    38   0.15000  1.0 3.0
   63    65    67    68   0.30150 -1.0 2.0
   63    65   -67    73   0.36750  1.0 3.0
   63    65    69    70   0.15000  1.0 3.0
   63    65    69    71   0.15000  1.0 3.0
   63    65    69    72   0.15000  1.0 3.0
   64    63    65    66   0.15000  1.0 3.0
   64    63    65    67  -0.11250  1.0 3.0
   64    63    65    69   0.15000  1.0 3.0
   64    63    38    33   0.15000  1.0 3.0
   64    63    38    73   0.23400  1.0 3.0
   64    63    38    39   0.15000  1.0 3.0
   65    63    38    33   0.56750  1.0 1.0
   65    63    38    33  -0.07550 -1.0 2.0
   65    63    38    33   0.20000  1.0 3.0
   65    63   -38    73   0.62750  1.0 1.0
   65    63   -38    73  -0.30950 -1.0 2.0
   65    63   -38    73   0.27300  1.0 3.0
   65    63    38    39   0.15000  1.0 3.0
   65    67   -73    38   1.63150  1.0 1.0
   65    67   -73    38   2.92000 -1.0 2.0
   66    65    67    68   0.00000  1.0 1.0
   66    65    67    73   0.00000  1.0 1.0
   66    65    69    70   0.15000  1.0 3.0
   66    65    69    71   0.15000  1.0 3.0
   66    65    69    72   0.15000  1.0 3.0
   67    65    69    70  -0.11250  1.0 3.0
   67    65    69    71  -0.11250  1.0 3.0
   67    65    69    72  -0.11250  1.0 3.0
   67    73    38    33  -0.25900  1.0 1.0
   67    73    38    33  -0.47000 -1.0 2.0
   67    73    38    33   0.11750  1.0 3.0
   67    73   -38    63  -0.25900  1.0 1.0
   67    73   -38    63  -0.47000 -1.0 2.0
   67    73   -38    63   0.11750  1.0 3.0
   67    73    38    39   0.08050  1.0 3.0
   68    67    73    38   3.00000 -1.0 2.0
   38    33    37    40   0.09850  1.0 1.0
   38    33    37    40   0.15250 -1.0 2.0
   38    33    37    40  -0.50650  1.0 3.0
   38    33    37    42   0.46850  1.0 1.0
   38    33    37    42   0.08550 -1.0 2.0
   38    33    37    42   0.09800  1.0 3.0
   38    33    52    49   0.56750  1.0 1.0
   38    33    52    49  -0.07550 -1.0 2.0
   38    33    52    49   0.20000  1.0 3.0
   38    33   -52    53   0.56750  1.0 1.0
   38    33   -52    53  -0.07550 -1.0 2.0
   38    33   -52    53   0.20000  1.0 3.0
   38    33    52    56   0.56750  1.0 1.0
   38    33    52    56  -0.07550 -1.0 2.0
   38    33    52    56   0.20000  1.0 3.0
   38    63    65    66   0.15000  1.0 3.0
   38    63   -65    67  -0.95700  1.0 1.0
   38    63   -65    67  -0.18200 -1.0 2.0
   38    63   -65    67   0.29450  1.0 3.0
   38    63    65    69   0.56750  1.0 1.0
   38    63    65    69  -0.07550 -1.0 2.0
   38    63    65    69   0.20000  1.0 3.0
   69    65    67    68   0.30150 -1.0 2.0
   69    65    67    73   0.36750  1.0 3.0
   56    52    53    54   0.15000  1.0 3.0
   56    52    53    55   0.15000  1.0 3.0
   56    52    53    60   0.56750  1.0 1.0
   56    52    53    60  -0.07550 -1.0 2.0
   56    52    53    60   0.20000  1.0 3.0
   42    37    40    41   7.00000 -1.0 2.0
   42    37    40    46   7.00000 -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
   33    42    37    40   1.10000 -1.0 2.0
   46    41    40    37   1.10000 -1.0 2.0
   65    73    67    68  10.50000 -1.0 2.0
END
