* LIGAND DATABASE FILE (OPLS2005)
*
001      70    73    134    209     385
    1     0 S   NP   _N1_     1    29.96735    97.93319   -17.07606
    2     1 S   H    _HN1     2     1.02786    64.08568   -81.31386
    3     1 S   H    _H1_     3     1.02947    81.54773    33.87461
    4     1 S   H    _H2_     4     1.02835    61.90476   148.46146
    5     1 S   CT   _CA1     5     1.50103   167.78150  -156.21998
    6     5 S   HC   _HA1     6     1.09584   105.18190     8.30539
    7     5 S   CO3  _C1_     7     1.53743   112.37834  -111.71961
    8     7 S   O2Z  _O11     8     1.26352   115.08600   -45.15521
    9     7 S   O2Z  _O12     9     1.26223   114.93989   134.18403
   10     5 S   CT   _CB1    10     1.53128   107.40355   126.02620
   11    10 S   HC   HB11    11     1.09816   109.16981   -51.56070
   12    10 S   HC   HB12    12     1.09795   110.53986    64.94662
   13    10 S   CT   _CG1    13     1.52944   112.64140  -172.69129
   14    13 S   HC   HG11    14     1.09435   110.42257   -65.18437
   15    13 S   HC   HG12    15     1.09667   109.98695    53.85388
   16    13 S   C    _CD1    16     1.51783   112.55154   173.91485
   17    16 S   O    _OE1    17     1.22717   123.28578    -7.10760
   18    16 S   N    _N2_    18     1.38614   111.53998   174.14097
   19    18 S   H    _HN2    19     1.01599   118.94690    -1.36315
   20    18 S   CT1  _CA2    20     1.46145   123.51483   176.04082
   21    20 S   HC   _HA2    21     1.09742   109.36591    -6.67097
   22    20 S   C    _C2_    22     1.53483   108.18908  -121.89944
   23    22 S   O    _O2_    23     1.23035   122.43119  -147.59003
   24    20 S   CT   _CB2    32     1.53193   111.66450   115.66287
   25    24 S   HC   HB21    33     1.09560   110.32578    55.08388
   26    24 S   HC   HB22    34     1.09526   110.47503   173.20531
   27    22 S   N    _N3_    24     1.38390   113.50002    39.95074
   28    27 S   H    _HN3    25     1.01629   119.49940    -3.67749
   29    24 S   S    _SG2    35     1.82646   111.59861   -68.37161
   30    27 S   CT   _CA3    26     1.45282   123.13775   176.97586
   31    30 S   HC   HA31    27     1.09552   107.55193   -63.27820
   32    30 S   HC   HA32    28     1.09558   107.91716    53.12517
   33    29 S   CT   _C13    36     1.83836    99.57952   127.85805
   34    33 S   HC   _H3_    37     1.09608   108.43726    51.67169
   35    30 S   CO3  _C3_    29     1.52935   114.14011   175.10071
   36    35 S   O2Z  _O31    30     1.26364   116.06802    -0.31216
   37    35 S   O2Z  _O32    31     1.26433   114.40727   179.72732
   38    33 S   CM   _C8_    38     1.53064   109.01720   171.59519
   39    33 S   OS   _O20    63     1.43376   109.58396   -64.71881
   40    38 S   CT   _C11    39     1.52104   114.42713   104.07630
   41    40 S   HC   _H26    40     1.09645   112.54295   172.80039
   42    38 S   CMA  _C10    64     1.36746   122.74525   -81.22858
   43    42 S   OM   _O16    65     1.26922   125.42128  -176.70331
   44    40 S   CM   _C4_    41     1.50410   114.36381   -64.74803
   45    44 S   HC   _H23    42     1.08113   123.80854   -51.93788
   46    42 S   OS   _O21    66     1.42049   111.42188     1.73506
   47    44 S   CM   _C5_    43     1.33766   111.91943   130.95365
   48    47 S   HC   _H24    44     1.08033   124.20348   177.48036
   49    46 S   CT   _C18    67     1.42719   114.25905   143.08428
   50    49 S   HC   _H34    68     1.09404   107.74760  -171.39184
   51    49 S   HC   _H35    69     1.09477   111.01680    70.68402
   52    49 S   HC   _H36    70     1.09537   111.11901   -53.23435
   53    47 S   CT   _C16    45     1.49484   111.70301    -0.39267
   54    53 S   CT   _C12    46     1.51413   117.39683  -125.93295
   55    54 S   HC   _H27    47     1.09253   113.52755    -8.34981
   56    54 S   CM   _C6_    48     1.48229   102.64728  -129.95483
   57    54 S   OS   _O19    58     1.43335   107.65778   112.85016
   58    56 S   CO4  _C7_    49     1.47677   109.28242     2.52104
   59    58 S   O    _O17    50     1.21845   126.73772   179.87489
   60    56 S   CM   _C9_    52     1.33982   129.45106  -178.89429
   61    60 S   HC   _H25    53     1.08798   119.41346  -179.43733
   62    57 S   CO   _C15    59     1.43400   108.06712   -19.54738
   63    62 S   HC   _H30    60     1.09570   108.42621   153.59503
   64    53 S   OS   _O18    51     1.42779   110.10773   109.22200
   65    60 S   CT   _C17    54     1.49423   125.33235    -0.12820
   66    65 S   HC   _H31    55     1.09447   109.68849  -123.07167
   67    65 S   HC   _H32    56     1.09425   109.81932   118.11878
   68    65 S   HC   _H33    57     1.09346   112.99161    -2.76378
   69    40 S   CT   _C14    61     1.53569   110.34542    50.92711
   70    69 S   HC   _H29    62     1.09728   111.83718    98.85967
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   7   5   4   3
  13   5   2   1   1  14   9  16   8   8   2   9   4   4  11   4
   3   2   1   1  12  13   7  12   7   6   2   6   4   4   2   2
   3   2   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    40    62    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    44    57    62    63    69    39    42    43    46  
   38    40    62    39    42  
   36    37  
   37  
    0  
   40    41    44    45    47    53    62    69    70    39    42    43    46    49  
   42    40    53    54    57    62    63    69    70  
   41    44    45    47    48    53    54    64    57    62    63    69    70    42    43    46  
   44    45    47    53    62    69    70    42  
   43    46    49    50    51    52    44    69  
   46    49  
   45    47    48    53    54    64    62    69    70  
   47    48    53    69  
   49    50    51    52  
   48    53    54    55    56    58    64    57    62    69    70  
   53    54    64    69  
   50    51    52  
   51    52  
   52  
    0  
   54    55    56    58    59    64    60    57    62    63    69    70  
   55    56    58    59    64    60    61    65    57    62    63    69    70  
   56    58    64    60    57    62    69  
   58    59    64    60    61    65    66    67    68    57    62    69  
   62    63    69    70    58    60    64  
   59    64    60    61    65    69  
   64    60  
   61    65    66    67    68    64  
   65    66    67    68  
   63    69    70    64  
   69    70  
   69    70  
   66    67    68  
   67    68  
   68  
    0  
   70  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.316400   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.387900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.670200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   47   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.319000   1.9750   1.7500   0.005000000  -0.741685710
   54   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   57   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   58   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   60   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   64   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   320.000  1.410
   38    40   317.000  1.510
   38    42   465.000  1.376
   40    41   340.000  1.090
   40    44   317.000  1.510
   40    69   268.000  1.529
   44    45   340.000  1.080
   44    47   549.000  1.340
   47    48   340.000  1.080
   47    53   317.000  1.510
   53    54   268.000  1.529
   53    64   320.000  1.410
   53    69   268.000  1.529
   54    55   340.000  1.090
   54    56   317.000  1.510
   54    57   320.000  1.410
   56    58   320.000  1.462
   56    60   549.000  1.340
   58    59   570.000  1.229
   58    64   214.000  1.327
   60    61   340.000  1.080
   60    65   317.000  1.510
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   57    62   320.000  1.380
   62    63   340.000  1.090
   62    69   250.000  1.527
   62    39   320.000  1.380
   69    70   340.000  1.090
   42    43   745.000  1.250
   42    46   440.000  1.360
   46    49   320.000  1.410
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    39    85.00000  114.68000
   33    38    40    65.00000  117.92700
   33    38    42    70.00000  124.00000
   33    39    62    60.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  109.50000
   38    40    44    70.00000  110.12100
   38    40    69    70.00000  112.02700
   38    42    43    65.00000  137.10300
   38    42    46    80.00000  120.01400
   40    44    45    35.00000  117.00000
   40    44    47    70.00000  124.00000
   40    69    53    58.35000  112.70000
   40    69    62    75.00000  109.43000
   40    69    70    37.50000  110.70000
   44    40    41    35.00000  109.50000
   44    47    48    35.00000  120.00000
   44    47    53    70.00000  124.00000
   47    44    45    35.00000  120.00000
   47    53    54    70.00000  112.02700
   47    53    64    85.00000  110.90400
   47    53    69    70.00000  112.02700
   53    47    48    35.00000  117.00000
   53    54    55    37.50000  110.70000
   53    54    56    70.00000  112.02700
   53    54    57    50.00000  109.50000
   53    64    58    83.00000  116.90000
   53    69    62    75.00000  109.43000
   53    69    70    37.50000  110.70000
   54    56    58    65.00000  116.34900
   54    56    60    70.00000  124.00000
   54    57    62    60.00000  109.50000
   56    54    55    35.00000  109.50000
   56    58    59    80.00000  123.72100
   56    58    64    90.00000  111.29400
   56    60    61    35.00000  120.00000
   56    60    65    70.00000  124.00000
   64    53    54    50.00000  109.50000
   64    58    59    83.00000  123.40000
   60    56    58    65.00000  118.96000
   60    65    66    35.00000  109.50000
   60    65    67    35.00000  109.50000
   60    65    68    35.00000  109.50000
   65    60    61    35.00000  117.00000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   57    54    55    35.00000  109.50000
   57    54    56    85.00000  110.90400
   57    62    63    35.00000  109.50000
   57    62    69    90.00000  108.56700
   57    62    39    92.60000  111.55000
   62    69    70    45.00000  108.72000
   69    40    41    37.50000  110.70000
   69    40    44    70.00000  112.02700
   69    53    54    58.35000  112.70000
   69    53    64    50.00000  109.50000
   69    62    63    45.00000  112.01100
   39    33    34    35.00000  109.50000
   39    33    38    85.00000  110.90400
   39    62    63    35.00000  109.50000
   39    62    69    90.00000  108.56700
   42    38    40    70.00000  124.00000
   42    46    49    90.00000  111.18400
   46    42    43    65.00000  121.00000
   46    49    50    35.00000  109.50000
   46    49    51    35.00000  109.50000
   46    49    52    35.00000  109.50000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    40   0.30250  1.0 1.0
   29    33    38    40  -0.14950 -1.0 2.0
   29    33    38    40   0.36900  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    39    62   0.14700  1.0 1.0
   29    33    39    62  -1.16150 -1.0 2.0
   29    33    39    62   0.48700  1.0 3.0
   33    38    40    41   0.34800  1.0 3.0
   33    38    40    44   0.09700  1.0 1.0
   33    38    40    44   0.15600 -1.0 2.0
   33    38    40    44  -0.50800  1.0 3.0
   33    38    40    69   0.46850  1.0 1.0
   33    38    40    69   0.08550 -1.0 2.0
   33    38    40    69   0.09800  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    46   7.00000 -1.0 2.0
   34    33    38    40   0.34800  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    39    62   0.37050  1.0 3.0
   38    33    39    62  -0.77900  1.0 1.0
   38    33    39    62  -0.36900 -1.0 2.0
   38    33    39    62   0.40400  1.0 3.0
   38    40    44    45   0.00000  1.0 1.0
   38    40    44    47  -0.28300  1.0 1.0
   38    40    44    47   0.26700 -1.0 2.0
   38    40    44    47  -0.63300  1.0 3.0
   38    40    69    53   0.34400  1.0 1.0
   38    40    69    53   0.09450 -1.0 2.0
   38    40    69    53   0.11100  1.0 3.0
   38    40   -69    62   0.34400  1.0 1.0
   38    40   -69    62   0.09450 -1.0 2.0
   38    40   -69    62   0.11100  1.0 3.0
   38    40    69    70   0.15000  1.0 3.0
   38    42    46    49  -2.26850  1.0 1.0
   38    42    46    49   3.39050 -1.0 2.0
   40    38    42    43   7.00000 -1.0 2.0
   40    38    42    46   7.00000 -1.0 2.0
   40    44    47    48   7.00000 -1.0 2.0
   40    44   -47    53   7.00000 -1.0 2.0
   41    40    44    45   0.33100  1.0 3.0
   41    40    44    47   0.00000  1.0 1.0
   41    40    69    53   0.15000  1.0 3.0
   41    40    69    62   0.15000  1.0 3.0
   41    40    69    70   0.15000  1.0 3.0
   44    40   -69    53   0.34400  1.0 1.0
   44    40   -69    53   0.09450 -1.0 2.0
   44    40   -69    53   0.11100  1.0 3.0
   44    40    69    62   0.34400  1.0 1.0
   44    40    69    62   0.09450 -1.0 2.0
   44    40    69    62   0.11100  1.0 3.0
   44    40    69    70   0.15000  1.0 3.0
   44    47    53    54   0.09850  1.0 1.0
   44    47    53    54   0.15250 -1.0 2.0
   44    47    53    54  -0.50650  1.0 3.0
   44    47    53    64   0.39000  1.0 1.0
   44    47    53    64  -0.05800 -1.0 2.0
   44    47    53    64  -0.55150  1.0 3.0
   44    47   -53    69   0.09850  1.0 1.0
   44    47   -53    69   0.15250 -1.0 2.0
   44    47   -53    69  -0.50650  1.0 3.0
   45    44    47    48   7.00000 -1.0 2.0
   45    44    47    53   7.00000 -1.0 2.0
   47    53    54    55   0.15000  1.0 3.0
   47    53    54    56   0.31000  1.0 1.0
   47    53    54    56   0.14700 -1.0 2.0
   47    53    54    56   0.07550  1.0 3.0
   47    53    54    57   0.61850  1.0 1.0
   47    53    54    57  -0.22750 -1.0 2.0
   47    53    54    57   0.15300  1.0 3.0
   47    53    64    58  -0.82050  1.0 1.0
   47    53    64    58   0.00600 -1.0 2.0
   47    53    64    58   0.04400  1.0 3.0
   47    53   -69    40   0.34400  1.0 1.0
   47    53   -69    40   0.09450 -1.0 2.0
   47    53   -69    40   0.11100  1.0 3.0
   47    53    69    62   0.34400  1.0 1.0
   47    53    69    62   0.09450 -1.0 2.0
   47    53    69    62   0.11100  1.0 3.0
   47    53    69    70   0.15000  1.0 3.0
   48    47    53    54   0.00000  1.0 1.0
   48    47    53    64   0.00000  1.0 1.0
   48    47    53    69   0.00000  1.0 1.0
   53    54   -56    58   0.09700  1.0 1.0
   53    54   -56    58   0.15600 -1.0 2.0
   53    54   -56    58  -0.50800  1.0 3.0
   53    54    56    60   0.09850  1.0 1.0
   53    54    56    60   0.15250 -1.0 2.0
   53    54    56    60  -0.50650  1.0 3.0
   53    54   -57    62   0.06250  1.0 1.0
   53    54   -57    62  -0.01100 -1.0 2.0
   53    54   -57    62   0.28050  1.0 3.0
   54    53   -64    58  -0.25900  1.0 1.0
   54    53   -64    58  -0.47000 -1.0 2.0
   54    53   -64    58   0.11750  1.0 3.0
   54    53    69    40   0.56750  1.0 1.0
   54    53    69    40  -0.07550 -1.0 2.0
   54    53    69    40   0.20000  1.0 3.0
   54    53   -69    62   3.97050  1.0 1.0
   54    53    69    70   0.15000  1.0 3.0
   54    56    58    59  -0.64400  1.0 1.0
   54    56    58    59   0.26850 -1.0 2.0
   54    56   -58    64  -0.15000  1.0 1.0
   54    56   -58    64   0.89550 -1.0 2.0
   54    56   -58    64  -0.06900  1.0 3.0
   54    56    60    61   7.00000 -1.0 2.0
   54    56    60    65   7.00000 -1.0 2.0
   54    57    62    63   0.37050  1.0 3.0
   54    57   -62    69   0.06250  1.0 1.0
   54    57   -62    69  -0.01100 -1.0 2.0
   54    57   -62    69   0.28050  1.0 3.0
   54    57    62    39  -0.53350  1.0 1.0
   54    57    62    39  -0.78350 -1.0 2.0
   54    57    62    39   0.33750  1.0 3.0
   55    54    56    58   0.15000  1.0 3.0
   55    54    56    60   0.00000  1.0 1.0
   55    54    57    62   0.37050  1.0 3.0
   56    54    57    62  -0.77900  1.0 1.0
   56    54    57    62  -0.36900 -1.0 2.0
   56    54    57    62   0.40400  1.0 3.0
   56    58   -64    53   2.00000 -1.0 2.0
   56    60    65    66   0.00000  1.0 1.0
   56    60    65    67   0.00000  1.0 1.0
   56    60    65    68   0.00000  1.0 1.0
   58    56    60    61   7.00000 -1.0 2.0
   58    56    60    65   7.00000 -1.0 2.0
   59    58    64    53   3.00000 -1.0 2.0
   64    53    54    55   0.23400  1.0 3.0
   64    53   -54    56   0.61850  1.0 1.0
   64    53   -54    56  -0.22750 -1.0 2.0
   64    53   -54    56   0.15300  1.0 3.0
   64    53    54    57   1.11900  1.0 1.0
   64    53    54    57  -1.16350 -1.0 2.0
   64    53    54    57  -0.34150  1.0 3.0
   64    53    69    40   0.62750  1.0 1.0
   64    53    69    40  -0.30950 -1.0 2.0
   64    53    69    40   0.27300  1.0 3.0
   64    53    69    62   0.62750  1.0 1.0
   64    53    69    62  -0.30950 -1.0 2.0
   64    53    69    62   0.27300  1.0 3.0
   64    53    69    70   0.23400  1.0 3.0
   60    56    58    59   1.00000 -1.0 2.0
   60    56    58    64  -0.56150  1.0 1.0
   60    56    58    64   2.19150 -1.0 2.0
   61    60    65    66   0.33100  1.0 3.0
   61    60    65    67   0.33100  1.0 3.0
   61    60    65    68   0.33100  1.0 3.0
   57    54    56    58   0.09700  1.0 1.0
   57    54    56    58   0.15600 -1.0 2.0
   57    54    56    58  -0.50800  1.0 3.0
   57    54    56    60   0.39000  1.0 1.0
   57    54    56    60  -0.05800 -1.0 2.0
   57    54    56    60  -0.55150  1.0 3.0
   57    62    69    40   0.62750  1.0 1.0
   57    62    69    40  -0.30950 -1.0 2.0
   57    62    69    40   0.27300  1.0 3.0
   57    62   -69    53   0.62750  1.0 1.0
   57    62   -69    53  -0.30950 -1.0 2.0
   57    62   -69    53   0.27300  1.0 3.0
   57    62    69    70   0.23400  1.0 3.0
   57    62    39    33  -0.53350  1.0 1.0
   57    62    39    33  -0.78350 -1.0 2.0
   57    62    39    33   0.33750  1.0 3.0
   63    62    69    40   0.15000  1.0 3.0
   63    62    69    53   0.15000  1.0 3.0
   63    62    69    70   0.15000  1.0 3.0
   63    62    39    33   0.37050  1.0 3.0
   69    40    44    45   0.00000  1.0 1.0
   69    40   -44    47   0.09850  1.0 1.0
   69    40   -44    47   0.15250 -1.0 2.0
   69    40   -44    47  -0.50650  1.0 3.0
   69    53    54    55   0.15000  1.0 3.0
   69    53    54    56   0.34400  1.0 1.0
   69    53    54    56   0.09450 -1.0 2.0
   69    53    54    56   0.11100  1.0 3.0
   69    53   -54    57   0.62750  1.0 1.0
   69    53   -54    57  -0.30950 -1.0 2.0
   69    53   -54    57   0.27300  1.0 3.0
   69    53    64    58  -0.25900  1.0 1.0
   69    53    64    58  -0.47000 -1.0 2.0
   69    53    64    58   0.11750  1.0 3.0
   69    62   -39    33   0.06250  1.0 1.0
   69    62   -39    33  -0.01100 -1.0 2.0
   69    62   -39    33   0.28050  1.0 3.0
   39    33    38    40   0.09700  1.0 1.0
   39    33    38    40   0.15600 -1.0 2.0
   39    33    38    40  -0.50800  1.0 3.0
   39    33    38    42   0.39000  1.0 1.0
   39    33    38    42  -0.05800 -1.0 2.0
   39    33    38    42  -0.55150  1.0 3.0
   39    62   -69    40   0.62750  1.0 1.0
   39    62   -69    40  -0.30950 -1.0 2.0
   39    62   -69    40   0.27300  1.0 3.0
   39    62    69    53   0.62750  1.0 1.0
   39    62    69    53  -0.30950 -1.0 2.0
   39    62    69    53   0.27300  1.0 3.0
   39    62    69    70   0.23400  1.0 3.0
   42    38    40    41   0.00000  1.0 1.0
   42    38    40    44  -0.28300  1.0 1.0
   42    38    40    44   0.26700 -1.0 2.0
   42    38    40    44  -0.63300  1.0 3.0
   42    38    40    69   0.09850  1.0 1.0
   42    38    40    69   0.15250 -1.0 2.0
   42    38    40    69  -0.50650  1.0 3.0
   42    46    49    50   0.08050  1.0 3.0
   42    46    49    51   0.08050  1.0 3.0
   42    46    49    52   0.08050  1.0 3.0
   43    42    46    49   2.00000 -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
   37    30    35    36  10.50000 -1.0 2.0
   33    40    38    42   1.10000 -1.0 2.0
   40    45    44    47   1.10000 -1.0 2.0
   53    48    47    44   1.10000 -1.0 2.0
   54    58    56    60   1.10000 -1.0 2.0
   56    64    58    59  10.50000 -1.0 2.0
   65    61    60    56   1.10000 -1.0 2.0
   43    46    42    38   1.10000 -1.0 2.0
END
