* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    137    216     405
    1     0 S   NP   _N1_     1    29.10110    95.57110   -19.56634
    2     1 S   H    _HN1     2     1.02806    37.09798   159.06234
    3     1 S   H    _H1_     3     1.02751    79.64919   -60.95795
    4     1 S   H    _H2_     4     1.02972    94.69310    46.92334
    5     1 S   CT   _CA1     5     1.50260   145.85570  -175.71733
    6     5 S   HC   _HA1     6     1.09600   105.02905    43.14159
    7     5 S   CO3  _C1_     7     1.53884   112.55204   -76.18658
    8     7 S   O2Z  _O11     8     1.26348   115.05255   -34.17740
    9     7 S   O2Z  _O12     9     1.26292   114.95250   144.31006
   10     5 S   CT   _CB1    10     1.53084   107.16293   160.53524
   11    10 S   HC   HB11    11     1.09804   108.93536   -52.47114
   12    10 S   HC   HB12    12     1.09752   110.34646    63.73999
   13    10 S   CT   _CG1    13     1.52894   112.96147  -173.89257
   14    13 S   HC   HG11    14     1.09499   110.14541   -66.94737
   15    13 S   HC   HG12    15     1.09663   110.12405    51.81255
   16    13 S   C    _CD1    16     1.51931   112.59868   171.38404
   17    16 S   O    _OE1    17     1.22743   123.21564   -18.36430
   18    16 S   N    _N2_    18     1.38552   111.65486   164.17919
   19    18 S   H    _HN2    19     1.01584   118.79195    -2.84028
   20    18 S   CT1  _CA2    20     1.46184   123.79001   176.72470
   21    20 S   HC   _HA2    21     1.09723   109.57118    -9.43203
   22    20 S   C    _C2_    22     1.53539   107.90335  -124.85009
   23    22 S   O    _O2_    23     1.23028   122.33386  -145.34466
   24    20 S   CT   _CB2    32     1.53312   111.20897   113.23737
   25    24 S   HC   HB21    33     1.09291   109.22090    50.64916
   26    24 S   HC   HB22    34     1.09497   110.73937   168.86484
   27    22 S   N    _N3_    24     1.38542   113.40535    42.04783
   28    27 S   H    _HN3    25     1.01524   118.87095    -0.80040
   29    24 S   S    _SG2    35     1.82976   111.60838   -72.67318
   30    27 S   CT   _CA3    26     1.45426   123.46300   175.31512
   31    30 S   HC   HA31    27     1.09525   109.23608    24.72539
   32    30 S   HC   HA32    28     1.09498   107.13176   141.69340
   33    29 S   CT   _C9_    36     1.87892   102.10897   141.20318
   34    30 S   CO3  _C3_    29     1.52903   113.07021   -98.76849
   35    34 S   O2Z  _O31    30     1.26407   115.37963   -46.43072
   36    34 S   O2Z  _O32    31     1.26353   115.00986   134.51485
   37    33 S   CM   _C10    37     1.52497   108.52746   -66.87621
   38    33 S   CT   _C8_    52     1.55248   106.99007    59.81103
   39    38 S   HC   _H12    53     1.09983   108.58008    56.48810
   40    38 S   HC   _H13    54     1.09641   111.31559   -59.11632
   41    33 S   CT   _C18    68     1.54808   105.04773   174.93968
   42    41 S   HC   _H18    69     1.09708   111.53304   -70.18816
   43    41 S   HC   _H19    70     1.09624   111.23307   170.15018
   44    41 S   HC   _H20    71     1.09571   113.20218    50.17951
   45    37 S   CMA  _C11    38     1.35750   127.20724   -62.22463
   46    45 S   OM   _O35    39     1.25536   137.45477    -0.74230
   47    45 S   CM   _C12    40     1.44884   109.05045   176.79594
   48    47 S   HC   _H14    41     1.08242   124.83550  -174.96468
   49    47 S   CM   _C13    42     1.33940   110.48613     1.56072
   50    37 S   CT   _C14    43     1.53237   123.66602   118.38772
   51    50 S   HC   _H5_    44     1.09630   110.81953   -61.52267
   52    49 S   CT   _C17    64     1.48623   126.02014  -174.22739
   53    52 S   HC   _H15    65     1.09441   110.43041   130.20950
   54    52 S   HC   _H16    66     1.09539   111.26975    10.93339
   55    52 S   HC   _H17    67     1.09300   111.25555  -108.82499
   56    50 S   CT   _C15    45     1.53850   111.44811    63.02241
   57    56 S   HC   _H6_    46     1.09893   110.08235    43.94889
   58    56 S   CT   _C6_    47     1.52009   113.23381   -81.94674
   59    58 S   HC   _H4_    48     1.10157   108.30228   -48.66554
   60    58 S   CT   _C7_    49     1.51973   115.27143    72.58753
   61    60 S   HC   _H10    50     1.09791   107.90862   172.17160
   62    60 S   HC   _H11    51     1.09380   111.50541    55.93993
   63    58 S   CT   _C5_    55     1.52801   102.23511  -160.23645
   64    63 S   HC   _H3_    56     1.09557   109.65301   148.87703
   65    63 S   CO4  _C16    57     1.50776   100.54241    33.95498
   66    65 S   O    _O34    58     1.22115   125.71243   163.28491
   67    63 S   CT   _C4_    60     1.52110   116.39145   -84.98487
   68    67 S   HC   _H7_    61     1.09504   112.05042    54.52465
   69    67 S   HC   _H8_    62     1.09433   111.09538   -66.78573
   70    67 S   HC   _H9_    63     1.09569   110.46703   173.81813
   71    56 S   OS   _O33    59     1.43853   112.40813   163.18077
  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
  19   2   1   1  20  15   6   5   6   2   1   1   8   4   9   3
  10  13   5   4   2   1   1  12   6  13   8   7   2   1   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    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    45    50    60    38    39    40    41    42    43    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    45    46    47    49    50    51    56    58    60    61    62    38    39    40    41    42    43    44  
   35    36  
   36  
    0  
   45    46    47    48    49    50    51    56    57    58    60    38    39    40    71    52    41    42    43    44  
   39    40    63    41    42    43    44    45    50    56    58    59    60    61    62  
   40    41    58    60    61    62  
   41    58    60    61    62  
   42    43    44    45    50    60  
   43    44  
   44  
    0  
   46    47    48    49    50    51    56    52  
   47    48    49    50  
   48    49    50    51    56    52    53    54    55  
   49    50    52  
   50    51    56    57    58    71    52    53    54    55  
   51    56    57    58    59    60    63    65    71    52    53    54    55  
   56    57    58    71    52  
   53    54    55    56  
   54    55  
   55  
    0  
   57    58    59    60    61    62    63    64    65    66    71    67  
   58    59    60    63    65    71  
   59    60    61    62    63    64    65    66    71    67    68    69    70  
   60    61    62    63    64    65    71    67  
   61    62    63    64    65    71    67  
   62    63  
   63  
   64    65    66    71    67    68    69    70  
   65    66    71    67    68    69    70  
   66    71    67    68    69    70  
   71    67  
   68    69    70    71  
   69    70  
   70  
    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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   46   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   47   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   58   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   65   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   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    38   268.000  1.529
   33    41   268.000  1.529
   37    45   465.000  1.376
   37    50   317.000  1.510
   45    46   745.000  1.250
   45    47   465.000  1.376
   47    48   340.000  1.080
   47    49   549.000  1.340
   49    50   317.000  1.510
   49    52   317.000  1.510
   50    51   340.000  1.090
   50    56   268.000  1.529
   56    57   340.000  1.090
   56    58   268.000  1.529
   56    71   320.000  1.410
   58    59   340.000  1.090
   58    60   268.000  1.529
   58    63   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    38   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   63    64   340.000  1.090
   63    65   317.000  1.522
   63    67   268.000  1.529
   65    66   570.000  1.229
   65    71   214.000  1.327
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   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    38    75.00000  111.63000
   29    33    41    75.00000  111.63000
   33    37    45    70.00000  124.00000
   33    37    50    65.00000  117.92700
   33    38    60    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    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
   37    45    46    65.00000  137.10300
   37    45    47    70.00000  123.01800
   37    50    49    70.00000  110.12100
   37    50    51    35.00000  109.50000
   37    50    56    70.00000  112.02700
   45    47    48    40.00000  120.50800
   45    47    49    70.00000  117.34000
   47    45    46    65.00000  137.10300
   47    49    50    70.00000  124.00000
   47    49    52    70.00000  124.00000
   49    47    48    35.00000  120.00000
   49    50    51    35.00000  109.50000
   49    50    56    70.00000  112.02700
   49    52    53    35.00000  109.50000
   49    52    54    35.00000  109.50000
   49    52    55    35.00000  109.50000
   50    37    45    70.00000  124.00000
   50    56    57    37.50000  110.70000
   50    56    58    58.35000  112.70000
   50    56    71    50.00000  109.50000
   56    50    51    37.50000  110.70000
   56    58    59    37.50000  110.70000
   56    58    60    58.35000  112.70000
   56    58    63    58.35000  112.70000
   56    71    65    83.00000  116.90000
   58    56    57    37.50000  110.70000
   58    60    61    37.50000  110.70000
   58    60    62    37.50000  110.70000
   58    60    38    58.35000  112.70000
   58    63    64    37.50000  110.70000
   58    63    65    63.00000  111.10000
   58    63    67    58.35000  112.70000
   60    58    59    37.50000  110.70000
   60    38    39    37.50000  110.70000
   60    38    40    37.50000  110.70000
   62    60    61    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    60    61    37.50000  110.70000
   38    60    62    37.50000  110.70000
   40    38    39    33.00000  107.80000
   63    58    59    37.50000  110.70000
   63    58    60    58.35000  112.70000
   63    65    66    80.00000  120.40000
   63    65    71    81.00000  111.40000
   63    67    68    37.50000  110.70000
   63    67    69    37.50000  110.70000
   63    67    70    37.50000  110.70000
   65    63    64    35.00000  109.50000
   71    56    57    35.00000  109.50000
   71    56    58    50.00000  109.50000
   71    65    66    83.00000  123.40000
   67    63    64    37.50000  110.70000
   67    63    65    63.00000  111.10000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   52    49    50    65.00000  117.92700
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
   41    33    37    70.00000  112.02700
   41    33    38    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
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    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
   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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    45   0.42700  1.0 1.0
   29    33    37    45  -0.70350 -1.0 2.0
   29    33    37    45  -0.43150  1.0 3.0
   29    33    37    50   0.30250  1.0 1.0
   29    33    37    50  -0.14950 -1.0 2.0
   29    33    37    50   0.36900  1.0 3.0
   29    33    38    60   0.44750  1.0 1.0
   29    33    38    60  -0.17800 -1.0 2.0
   29    33    38    60   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    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
   33    37    45    46   7.00000 -1.0 2.0
   33    37    45    47   7.00000 -1.0 2.0
   33    37    50    49   0.09700  1.0 1.0
   33    37    50    49   0.15600 -1.0 2.0
   33    37    50    49  -0.50800  1.0 3.0
   33    37    50    51   0.34800  1.0 3.0
   33    37    50    56   0.46850  1.0 1.0
   33    37    50    56   0.08550 -1.0 2.0
   33    37    50    56   0.09800  1.0 3.0
   37    33    38    60   0.34400  1.0 1.0
   37    33    38    60   0.09450 -1.0 2.0
   37    33    38    60   0.11100  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  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    45    47    48   7.00000 -1.0 2.0
   37    45   -47    49   7.00000 -1.0 2.0
   37    50    56    57   0.15000  1.0 3.0
   37    50    56    58   0.34400  1.0 1.0
   37    50    56    58   0.09450 -1.0 2.0
   37    50    56    58   0.11100  1.0 3.0
   37    50    56    71   0.61850  1.0 1.0
   37    50    56    71  -0.22750 -1.0 2.0
   37    50    56    71   0.15300  1.0 3.0
   45    37   -50    49  -0.28300  1.0 1.0
   45    37   -50    49   0.26700 -1.0 2.0
   45    37   -50    49  -0.63300  1.0 3.0
   45    37    50    51   0.00000  1.0 1.0
   45    37    50    56   0.09850  1.0 1.0
   45    37    50    56   0.15250 -1.0 2.0
   45    37    50    56  -0.50650  1.0 3.0
   45    47   -49    50   7.00000 -1.0 2.0
   45    47    49    52   7.00000 -1.0 2.0
   46    45    47    48   7.00000 -1.0 2.0
   46    45    47    49   7.00000 -1.0 2.0
   47    49   -50    37  -0.28300  1.0 1.0
   47    49   -50    37   0.26700 -1.0 2.0
   47    49   -50    37  -0.63300  1.0 3.0
   47    49    50    51   0.00000  1.0 1.0
   47    49    50    56   0.09850  1.0 1.0
   47    49    50    56   0.15250 -1.0 2.0
   47    49    50    56  -0.50650  1.0 3.0
   47    49    52    53   0.00000  1.0 1.0
   47    49    52    54   0.00000  1.0 1.0
   47    49    52    55   0.00000  1.0 1.0
   48    47    49    50   7.00000 -1.0 2.0
   48    47    49    52   7.00000 -1.0 2.0
   49    50    56    57   0.15000  1.0 3.0
   49    50    56    58   0.34400  1.0 1.0
   49    50    56    58   0.09450 -1.0 2.0
   49    50    56    58   0.11100  1.0 3.0
   49    50    56    71   0.61850  1.0 1.0
   49    50    56    71  -0.22750 -1.0 2.0
   49    50    56    71   0.15300  1.0 3.0
   50    37    45    46   7.00000 -1.0 2.0
   50    37   -45    47   7.00000 -1.0 2.0
   50    49    52    53   0.34800  1.0 3.0
   50    49    52    54   0.34800  1.0 3.0
   50    49    52    55   0.34800  1.0 3.0
   50    56    58    59   0.15000  1.0 3.0
   50    56    58    60   0.56750  1.0 1.0
   50    56    58    60  -0.07550 -1.0 2.0
   50    56    58    60   0.20000  1.0 3.0
   50    56    58    63   0.56750  1.0 1.0
   50    56    58    63  -0.07550 -1.0 2.0
   50    56    58    63   0.20000  1.0 3.0
   50    56    71    65  -0.25900  1.0 1.0
   50    56    71    65  -0.47000 -1.0 2.0
   50    56    71    65   0.11750  1.0 3.0
   51    50    56    57   0.15000  1.0 3.0
   51    50    56    58   0.15000  1.0 3.0
   51    50    56    71   0.23400  1.0 3.0
   56    58    60    61   0.15000  1.0 3.0
   56    58    60    62   0.15000  1.0 3.0
   56    58    60    38   0.56750  1.0 1.0
   56    58    60    38  -0.07550 -1.0 2.0
   56    58    60    38   0.20000  1.0 3.0
   56    58    63    64   0.15000  1.0 3.0
   56    58   -63    65  -0.95700  1.0 1.0
   56    58   -63    65  -0.18200 -1.0 2.0
   56    58   -63    65   0.29450  1.0 3.0
   56    58    63    67   0.56750  1.0 1.0
   56    58    63    67  -0.07550 -1.0 2.0
   56    58    63    67   0.20000  1.0 3.0
   57    56    58    59   0.15000  1.0 3.0
   57    56    58    60   0.15000  1.0 3.0
   57    56    58    63   0.15000  1.0 3.0
   57    56    71    65   0.08050  1.0 3.0
   58    56   -71    65  -0.25900  1.0 1.0
   58    56   -71    65  -0.47000 -1.0 2.0
   58    56   -71    65   0.11750  1.0 3.0
   58    60    38    33   0.56750  1.0 1.0
   58    60    38    33  -0.07550 -1.0 2.0
   58    60    38    33   0.20000  1.0 3.0
   58    60    38    39   0.15000  1.0 3.0
   58    60    38    40   0.15000  1.0 3.0
   58    63    65    66   0.30150 -1.0 2.0
   58    63   -65    71   0.36750  1.0 3.0
   58    63    67    68   0.15000  1.0 3.0
   58    63    67    69   0.15000  1.0 3.0
   58    63    67    70   0.15000  1.0 3.0
   59    58    60    61   0.15000  1.0 3.0
   59    58    60    62   0.15000  1.0 3.0
   59    58    60    38   0.15000  1.0 3.0
   59    58    63    64   0.15000  1.0 3.0
   59    58    63    65  -0.11250  1.0 3.0
   59    58    63    67   0.15000  1.0 3.0
   60    58    63    64   0.15000  1.0 3.0
   60    58    63    65  -0.95700  1.0 1.0
   60    58    63    65  -0.18200 -1.0 2.0
   60    58    63    65   0.29450  1.0 3.0
   60    58    63    67   0.56750  1.0 1.0
   60    58    63    67  -0.07550 -1.0 2.0
   60    58    63    67   0.20000  1.0 3.0
   61    60    38    33   0.15000  1.0 3.0
   61    60    38    39   0.15000  1.0 3.0
   61    60    38    40   0.15000  1.0 3.0
   62    60    38    33   0.15000  1.0 3.0
   62    60    38    39   0.15000  1.0 3.0
   62    60    38    40   0.15000  1.0 3.0
   38    33    37    45   0.09850  1.0 1.0
   38    33    37    45   0.15250 -1.0 2.0
   38    33    37    45  -0.50650  1.0 3.0
   38    33    37    50   0.46850  1.0 1.0
   38    33    37    50   0.08550 -1.0 2.0
   38    33    37    50   0.09800  1.0 3.0
   38    33    41    42   0.15000  1.0 3.0
   38    33    41    43   0.15000  1.0 3.0
   38    33    41    44   0.15000  1.0 3.0
   63    58    60    61   0.15000  1.0 3.0
   63    58    60    62   0.15000  1.0 3.0
   63    58    60    38   0.56750  1.0 1.0
   63    58    60    38  -0.07550 -1.0 2.0
   63    58    60    38   0.20000  1.0 3.0
   63    65   -71    56   1.63150  1.0 1.0
   63    65   -71    56   2.92000 -1.0 2.0
   64    63    65    66   0.00000  1.0 1.0
   64    63    65    71   0.00000  1.0 1.0
   64    63    67    68   0.15000  1.0 3.0
   64    63    67    69   0.15000  1.0 3.0
   64    63    67    70   0.15000  1.0 3.0
   65    63    67    68  -0.11250  1.0 3.0
   65    63    67    69  -0.11250  1.0 3.0
   65    63    67    70  -0.11250  1.0 3.0
   66    65    71    56   3.00000 -1.0 2.0
   71    56    58    59   0.23400  1.0 3.0
   71    56    58    60   0.62750  1.0 1.0
   71    56    58    60  -0.30950 -1.0 2.0
   71    56    58    60   0.27300  1.0 3.0
   71    56   -58    63   0.62750  1.0 1.0
   71    56   -58    63  -0.30950 -1.0 2.0
   71    56   -58    63   0.27300  1.0 3.0
   67    63    65    66   0.30150 -1.0 2.0
   67    63    65    71   0.36750  1.0 3.0
   52    49    50    37   0.09700  1.0 1.0
   52    49    50    37   0.15600 -1.0 2.0
   52    49    50    37  -0.50800  1.0 3.0
   52    49    50    51   0.34800  1.0 3.0
   52    49    50    56   0.46850  1.0 1.0
   52    49    50    56   0.08550 -1.0 2.0
   52    49    50    56   0.09800  1.0 3.0
   41    33    37    45   0.09850  1.0 1.0
   41    33    37    45   0.15250 -1.0 2.0
   41    33    37    45  -0.50650  1.0 3.0
   41    33    37    50   0.46850  1.0 1.0
   41    33    37    50   0.08550 -1.0 2.0
   41    33    37    50   0.09800  1.0 3.0
   41    33    38    60   0.56750  1.0 1.0
   41    33    38    60  -0.07550 -1.0 2.0
   41    33    38    60   0.20000  1.0 3.0
   41    33    38    39   0.15000  1.0 3.0
   41    33    38    40   0.15000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    50    37    45   1.10000 -1.0 2.0
   47    46    45    37   1.10000 -1.0 2.0
   45    48    47    49   1.10000 -1.0 2.0
   50    52    49    47   1.10000 -1.0 2.0
   63    71    65    66  10.50000 -1.0 2.0
END
