* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    137    216     404
    1     0 S   NP   _N1_     1    28.72543    96.22924   -23.83631
    2     1 S   H    _HN1     2     1.02948    73.22139     9.47892
    3     1 S   H    _H1_     3     1.02828    35.87763   169.62508
    4     1 S   H    _H2_     4     1.02788   108.21689   -94.83025
    5     1 S   CT   _CA1     5     1.50110   135.13677   111.80916
    6     5 S   HC   _HA1     6     1.09574   105.18945    91.29694
    7     5 S   CO3  _C1_     7     1.53777   112.45195   -28.93313
    8     7 S   O2Z  _O11     8     1.26371   115.01165   -43.12579
    9     7 S   O2Z  _O12     9     1.26238   114.93831   135.97919
   10     5 S   CT   _CB1    10     1.53073   107.41787  -150.74028
   11    10 S   HC   HB11    11     1.09835   109.34757   -49.79693
   12    10 S   HC   HB12    12     1.09812   110.46414    66.80090
   13    10 S   CT   _CG1    13     1.53001   112.61710  -170.76720
   14    13 S   HC   HG11    14     1.09579   110.65694   -66.15386
   15    13 S   HC   HG12    15     1.09671   109.76256    53.08321
   16    13 S   C    _CD1    16     1.51806   112.16022   173.53092
   17    16 S   O    _OE1    17     1.22740   123.25458     8.27600
   18    16 S   N    _N2_    18     1.38647   111.71948  -171.74936
   19    18 S   H    _HN2    19     1.01582   118.96473     1.43135
   20    18 S   CT1  _CA2    20     1.46211   123.39584   177.20061
   21    20 S   HC   _HA2    21     1.09737   109.31455     4.73106
   22    20 S   C    _C2_    22     1.53604   108.80753  -110.76009
   23    22 S   O    _O2_    23     1.23071   122.24834  -149.05323
   24    20 S   CT   _CB2    32     1.53307   111.54299   126.70282
   25    24 S   HC   HB21    33     1.09536   110.01891    56.52441
   26    24 S   HC   HB22    34     1.09521   110.19741   175.54236
   27    22 S   N    _N3_    24     1.38320   113.80014    38.47329
   28    27 S   H    _HN3    25     1.01567   119.59536    -3.35299
   29    24 S   S    _SG2    35     1.82871   111.46073   -64.87484
   30    27 S   CT   _CA3    26     1.45288   123.25398   177.11446
   31    30 S   HC   HA31    27     1.09548   107.51202   -64.63915
   32    30 S   HC   HA32    28     1.09555   107.99094    51.81157
   33    29 S   CT   _C11    36     1.84660    99.56385   178.16080
   34    33 S   HC   _H3_    37     1.09836   105.84485    35.75029
   35    30 S   CO3  _C3_    29     1.52969   114.05434   173.80492
   36    35 S   O2Z  _O31    30     1.26380   116.06460    -0.68984
   37    35 S   O2Z  _O32    31     1.26425   114.41845   179.37380
   38    33 S   CM   _C4_    38     1.49885   109.58924   -78.91790
   39    38 S   HC   _H20    39     1.08857   119.19772    18.38633
   40    38 S   CMA  _C6_    40     1.34748   122.43597  -161.02793
   41    40 S   OM   _O16    41     1.26133   128.45103   176.50486
   42    40 S   CM   _C5_    42     1.49301   118.01930    -1.82177
   43    42 S   CM   _C7_    43     1.36278   119.98098    25.47664
   44    42 S   CT   _C16    68     1.51870   117.78014  -155.49344
   45    44 S   HC   _H29    69     1.09386   111.39772   140.92205
   46    44 S   HC   _H30    70     1.09608   112.63987    25.00460
   47    44 S   HC   _H31    71     1.09473   110.82081   -96.55934
   48    43 S   CT   _C12    44     1.52324   126.22286   166.25759
   49    48 S   HC   _H26    45     1.09828   106.53939  -107.78974
   50    48 S   CT   _C14    46     1.51116   111.71177   130.69576
   51    50 S   HC   _H28    47     1.10165   109.18862   -54.42198
   52    50 S   CT   _C9_    48     1.51628   109.63712    64.88429
   53    52 S   HC   _H21    49     1.09585   110.27631   177.14460
   54    52 S   HC   _H22    50     1.09590   111.58979    58.17252
   55    50 S   CT   _C13    59     1.52062   102.29400  -167.49967
   56    55 S   HC   _H27    60     1.09544   109.64984   147.81175
   57    52 S   CT   _C10    51     1.53065   108.43068   -62.75305
   58    57 S   HC   _H23    52     1.09706   108.32650   176.99450
   59    57 S   HC   _H24    53     1.09898   106.92242   -69.27156
   60    55 S   CO4  _C8_    61     1.51318   100.34482    32.96319
   61    60 S   O    _O17    62     1.22151   125.51144   163.82221
   62    55 S   CT   _C17    64     1.52014   116.36327   -86.16484
   63    62 S   HC   _H32    65     1.09506   112.07769    55.85148
   64    62 S   HC   _H33    66     1.09440   111.01865   -65.47598
   65    62 S   HC   _H34    67     1.09564   110.43004   175.09052
   66    33 S   CT   _C15    54     1.57514   114.04859   155.03185
   67    48 S   OS   _O18    63     1.42559   118.66005    10.64067
   68    66 S   CT   _C18    55     1.55004   112.61699    50.13656
   69    68 S   HC   _H35    56     1.09475   112.07561   -64.46105
   70    68 S   HC   _H36    57     1.09514   111.95006   176.54549
   71    68 S   HC   _H37    58     1.09576   111.67670    56.43358
  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   9   5   4   3
  17   7   2   1   1   9   4   9   3  12  20   5   2   1   1  15
   7  17   9  12   6   5   9   7   7   3   2   6   2   4   2   1
   1   5   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    66    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    57    66    68  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    48    52    57    58    59    66    68    69    70    71  
   38    39    40    43    57    66    68  
   36    37  
   37  
    0  
   39    40    41    42    43    57    66    68    44  
   40    41    42    66  
   41    42    43    48    66    44    45    46    47  
   42    43    44  
   43    48    49    50    57    66    68    67    44    45    46    47  
   48    49    50    51    52    57    58    59    66    68    69    70    71    55    60    67    44    45    46    47  
   45    46    47    48    66  
   46    47  
   47  
    0  
   49    50    51    52    53    54    57    66    68    55    56    60    61    67    62  
   50    51    52    66    55    60    67  
   51    52    53    54    57    58    59    66    55    56    60    61    67    62    63    64    65  
   52    53    54    57    55    56    60    67    62  
   53    54    57    58    59    66    68    55    56    60    67    62  
   54    57    58    59    66    55  
   57    58    59    66    55  
   56    60    61    67    62    63    64    65    57  
   60    61    67    62    63    64    65  
   58    59    66    68    69    70    71  
   59    66    68  
   66    68  
   61    67    62    63    64    65  
   67    62  
   63    64    65    67  
   64    65  
   65  
    0  
   68    69    70    71    67  
    0  
   69    70    71  
   70    71  
   71  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   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  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   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  -0.120000   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   67   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   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    66   268.000  1.529
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   465.000  1.376
   42    43   549.000  1.340
   42    44   317.000  1.510
   43    48   317.000  1.510
   43    66   317.000  1.510
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    67   320.000  1.410
   50    51   340.000  1.090
   50    52   268.000  1.529
   50    55   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    66   268.000  1.529
   66    68   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   55    56   340.000  1.090
   55    60   317.000  1.522
   55    62   268.000  1.529
   60    61   570.000  1.229
   60    67   214.000  1.327
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   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    66    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    66    43    70.00000  112.02700
   33    66    57    58.35000  112.70000
   33    66    68    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    70.00000  123.01800
   40    38    39    40.00000  120.50800
   40    42    43    70.00000  117.34000
   40    42    44    70.00000  124.00000
   42    40    41    65.00000  137.10300
   42    43    48    70.00000  124.00000
   42    43    66    70.00000  124.00000
   42    44    45    35.00000  109.50000
   42    44    46    35.00000  109.50000
   42    44    47    35.00000  109.50000
   43    48    49    35.00000  109.50000
   43    48    50    70.00000  112.02700
   43    48    67    85.00000  110.90400
   43    66    57    70.00000  112.02700
   43    66    68    70.00000  112.02700
   48    50    51    37.50000  110.70000
   48    50    52    58.35000  112.70000
   48    50    55    58.35000  112.70000
   48    67    60    83.00000  116.90000
   50    48    49    37.50000  110.70000
   50    52    53    37.50000  110.70000
   50    52    54    37.50000  110.70000
   50    52    57    58.35000  112.70000
   50    55    56    37.50000  110.70000
   50    55    60    63.00000  111.10000
   50    55    62    58.35000  112.70000
   52    50    51    37.50000  110.70000
   52    57    58    37.50000  110.70000
   52    57    59    37.50000  110.70000
   52    57    66    58.35000  112.70000
   54    52    53    33.00000  107.80000
   57    52    53    37.50000  110.70000
   57    52    54    37.50000  110.70000
   57    66    68    58.35000  112.70000
   59    57    58    33.00000  107.80000
   66    33    34    37.50000  110.70000
   66    33    38    70.00000  112.02700
   66    43    48    65.00000  117.92700
   66    57    58    37.50000  110.70000
   66    57    59    37.50000  110.70000
   66    68    69    37.50000  110.70000
   66    68    70    37.50000  110.70000
   66    68    71    37.50000  110.70000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   55    50    51    37.50000  110.70000
   55    50    52    58.35000  112.70000
   55    60    61    80.00000  120.40000
   55    60    67    81.00000  111.40000
   55    62    63    37.50000  110.70000
   55    62    64    37.50000  110.70000
   55    62    65    37.50000  110.70000
   60    55    56    35.00000  109.50000
   67    48    49    35.00000  109.50000
   67    48    50    50.00000  109.50000
   67    60    61    83.00000  123.40000
   62    55    56    37.50000  110.70000
   62    55    60    63.00000  111.10000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   44    42    43    70.00000  124.00000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    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    66   0.01700  1.0 1.0
   24    29    33    66  -0.23550 -1.0 2.0
   24    29    33    66   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    38    39   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    66    43   0.56750  1.0 1.0
   29    33    66    43  -0.07550 -1.0 2.0
   29    33    66    43   0.20000  1.0 3.0
   29    33    66    57   0.44750  1.0 1.0
   29    33    66    57  -0.17800 -1.0 2.0
   29    33    66    57   0.20200  1.0 3.0
   29    33    66    68   0.44750  1.0 1.0
   29    33    66    68  -0.17800 -1.0 2.0
   29    33    66    68   0.20200  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   33    66    68    69   0.15000  1.0 3.0
   33    66    68    70   0.15000  1.0 3.0
   33    66    68    71   0.15000  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    66    43   0.15000  1.0 3.0
   34    33    66    57   0.15000  1.0 3.0
   34    33    66    68   0.15000  1.0 3.0
   38    33    66    43   0.31000  1.0 1.0
   38    33    66    43   0.14700 -1.0 2.0
   38    33    66    43   0.07550  1.0 3.0
   38    33    66    57   0.34400  1.0 1.0
   38    33    66    57   0.09450 -1.0 2.0
   38    33    66    57   0.11100  1.0 3.0
   38    33    66    68   0.34400  1.0 1.0
   38    33    66    68   0.09450 -1.0 2.0
   38    33    66    68   0.11100  1.0 3.0
   38    40   -42    43   7.00000 -1.0 2.0
   38    40    42    44   7.00000 -1.0 2.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    43    48   7.00000 -1.0 2.0
   40    42    43    66   7.00000 -1.0 2.0
   40    42    44    45   0.00000  1.0 1.0
   40    42    44    46   0.00000  1.0 1.0
   40    42    44    47   0.00000  1.0 1.0
   41    40    42    43   7.00000 -1.0 2.0
   41    40    42    44   7.00000 -1.0 2.0
   42    43    48    49   0.00000  1.0 1.0
   42    43    48    50   0.09850  1.0 1.0
   42    43    48    50   0.15250 -1.0 2.0
   42    43    48    50  -0.50650  1.0 3.0
   42    43    48    67   0.39000  1.0 1.0
   42    43    48    67  -0.05800 -1.0 2.0
   42    43    48    67  -0.55150  1.0 3.0
   42    43   -66    33   0.09850  1.0 1.0
   42    43   -66    33   0.15250 -1.0 2.0
   42    43   -66    33  -0.50650  1.0 3.0
   42    43    66    57   0.09850  1.0 1.0
   42    43    66    57   0.15250 -1.0 2.0
   42    43    66    57  -0.50650  1.0 3.0
   42    43    66    68   0.09850  1.0 1.0
   42    43    66    68   0.15250 -1.0 2.0
   42    43    66    68  -0.50650  1.0 3.0
   43    42    44    45   0.00000  1.0 1.0
   43    42    44    46   0.00000  1.0 1.0
   43    42    44    47   0.00000  1.0 1.0
   43    48    50    51   0.15000  1.0 3.0
   43    48    50    52   0.34400  1.0 1.0
   43    48    50    52   0.09450 -1.0 2.0
   43    48    50    52   0.11100  1.0 3.0
   43    48    50    55   0.34400  1.0 1.0
   43    48    50    55   0.09450 -1.0 2.0
   43    48    50    55   0.11100  1.0 3.0
   43    48    67    60  -0.82050  1.0 1.0
   43    48    67    60   0.00600 -1.0 2.0
   43    48    67    60   0.04400  1.0 3.0
   43    66    68    69   0.15000  1.0 3.0
   43    66    68    70   0.15000  1.0 3.0
   43    66    68    71   0.15000  1.0 3.0
   48    43    66    33   0.46850  1.0 1.0
   48    43    66    33   0.08550 -1.0 2.0
   48    43    66    33   0.09800  1.0 3.0
   48    43    66    57   0.46850  1.0 1.0
   48    43    66    57   0.08550 -1.0 2.0
   48    43    66    57   0.09800  1.0 3.0
   48    43    66    68   0.46850  1.0 1.0
   48    43    66    68   0.08550 -1.0 2.0
   48    43    66    68   0.09800  1.0 3.0
   48    50    52    53   0.15000  1.0 3.0
   48    50    52    54   0.15000  1.0 3.0
   48    50   -52    57   0.56750  1.0 1.0
   48    50   -52    57  -0.07550 -1.0 2.0
   48    50   -52    57   0.20000  1.0 3.0
   48    50    55    56   0.15000  1.0 3.0
   48    50   -55    60  -0.95700  1.0 1.0
   48    50   -55    60  -0.18200 -1.0 2.0
   48    50   -55    60   0.29450  1.0 3.0
   48    50    55    62   0.56750  1.0 1.0
   48    50    55    62  -0.07550 -1.0 2.0
   48    50    55    62   0.20000  1.0 3.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    52   0.15000  1.0 3.0
   49    48    50    55   0.15000  1.0 3.0
   49    48    67    60   0.08050  1.0 3.0
   50    48   -67    60  -0.25900  1.0 1.0
   50    48   -67    60  -0.47000 -1.0 2.0
   50    48   -67    60   0.11750  1.0 3.0
   50    52    57    58   0.15000  1.0 3.0
   50    52    57    59   0.15000  1.0 3.0
   50    52    57    66   0.56750  1.0 1.0
   50    52    57    66  -0.07550 -1.0 2.0
   50    52    57    66   0.20000  1.0 3.0
   50    55    60    61   0.30150 -1.0 2.0
   50    55   -60    67   0.36750  1.0 3.0
   50    55    62    63   0.15000  1.0 3.0
   50    55    62    64   0.15000  1.0 3.0
   50    55    62    65   0.15000  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    54   0.15000  1.0 3.0
   51    50    52    57   0.15000  1.0 3.0
   51    50    55    56   0.15000  1.0 3.0
   51    50    55    60  -0.11250  1.0 3.0
   51    50    55    62   0.15000  1.0 3.0
   52    50    55    56   0.15000  1.0 3.0
   52    50    55    60  -0.95700  1.0 1.0
   52    50    55    60  -0.18200 -1.0 2.0
   52    50    55    60   0.29450  1.0 3.0
   52    50    55    62   0.56750  1.0 1.0
   52    50    55    62  -0.07550 -1.0 2.0
   52    50    55    62   0.20000  1.0 3.0
   52    57    66    33   0.56750  1.0 1.0
   52    57    66    33  -0.07550 -1.0 2.0
   52    57    66    33   0.20000  1.0 3.0
   52    57   -66    43   0.34400  1.0 1.0
   52    57   -66    43   0.09450 -1.0 2.0
   52    57   -66    43   0.11100  1.0 3.0
   52    57    66    68   0.56750  1.0 1.0
   52    57    66    68  -0.07550 -1.0 2.0
   52    57    66    68   0.20000  1.0 3.0
   53    52    57    58   0.15000  1.0 3.0
   53    52    57    59   0.15000  1.0 3.0
   53    52    57    66   0.15000  1.0 3.0
   54    52    57    58   0.15000  1.0 3.0
   54    52    57    59   0.15000  1.0 3.0
   54    52    57    66   0.15000  1.0 3.0
   57    66    68    69   0.15000  1.0 3.0
   57    66    68    70   0.15000  1.0 3.0
   57    66    68    71   0.15000  1.0 3.0
   58    57    66    33   0.15000  1.0 3.0
   58    57    66    43   0.15000  1.0 3.0
   58    57    66    68   0.15000  1.0 3.0
   59    57    66    33   0.15000  1.0 3.0
   59    57    66    43   0.15000  1.0 3.0
   59    57    66    68   0.15000  1.0 3.0
   66    33    38    39   0.00000  1.0 1.0
   66    33   -38    40   0.09850  1.0 1.0
   66    33   -38    40   0.15250 -1.0 2.0
   66    33   -38    40  -0.50650  1.0 3.0
   66    43    48    49   0.34800  1.0 3.0
   66    43   -48    50   0.46850  1.0 1.0
   66    43   -48    50   0.08550 -1.0 2.0
   66    43   -48    50   0.09800  1.0 3.0
   66    43    48    67   0.09700  1.0 1.0
   66    43    48    67   0.15600 -1.0 2.0
   66    43    48    67  -0.50800  1.0 3.0
   55    50    52    53   0.15000  1.0 3.0
   55    50    52    54   0.15000  1.0 3.0
   55    50    52    57   0.56750  1.0 1.0
   55    50    52    57  -0.07550 -1.0 2.0
   55    50    52    57   0.20000  1.0 3.0
   55    60   -67    48   1.63150  1.0 1.0
   55    60   -67    48   2.92000 -1.0 2.0
   56    55    60    61   0.00000  1.0 1.0
   56    55    60    67   0.00000  1.0 1.0
   56    55    62    63   0.15000  1.0 3.0
   56    55    62    64   0.15000  1.0 3.0
   56    55    62    65   0.15000  1.0 3.0
   60    55    62    63  -0.11250  1.0 3.0
   60    55    62    64  -0.11250  1.0 3.0
   60    55    62    65  -0.11250  1.0 3.0
   61    60    67    48   3.00000 -1.0 2.0
   67    48    50    51   0.23400  1.0 3.0
   67    48    50    52   0.62750  1.0 1.0
   67    48    50    52  -0.30950 -1.0 2.0
   67    48    50    52   0.27300  1.0 3.0
   67    48   -50    55   0.62750  1.0 1.0
   67    48   -50    55  -0.30950 -1.0 2.0
   67    48   -50    55   0.27300  1.0 3.0
   62    55    60    61   0.30150 -1.0 2.0
   62    55    60    67   0.36750  1.0 3.0
   44    42    43    48   7.00000 -1.0 2.0
   44    42    43    66   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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   40    44    42    43   1.10000 -1.0 2.0
   48    66    43    42   1.10000 -1.0 2.0
   55    67    60    61  10.50000 -1.0 2.0
END
