* LIGAND DATABASE FILE (OPLS2005)
*
001      76    76    138    212     412
    1     0 S   NP   _N1_     1    28.68099    95.35793   -24.36360
    2     1 S   H    _HN1     2     1.02827    28.00531   162.14325
    3     1 S   H    _H1_     3     1.02793   110.16488  -107.50494
    4     1 S   H    _H2_     4     1.02948    80.23558    -1.40137
    5     1 S   CT   _CA1     5     1.50128   129.50250   107.06816
    6     5 S   HC   _HA1     6     1.09572   105.17586    83.64255
    7     5 S   CO3  _C1_     7     1.53778   112.40897   -36.60511
    8     7 S   O2Z  _O11     8     1.26380   115.00573   -43.38217
    9     7 S   O2Z  _O12     9     1.26228   114.94586   135.61093
   10     5 S   CT   _CB1    10     1.53055   107.39971  -158.36504
   11    10 S   HC   HB11    11     1.09841   109.38817   -49.07583
   12    10 S   HC   HB12    12     1.09811   110.45611    67.52703
   13    10 S   CT   _CG1    13     1.53019   112.62791  -169.98781
   14    13 S   HC   HG11    14     1.09570   110.73934   -66.39276
   15    13 S   HC   HG12    15     1.09666   109.71130    52.86761
   16    13 S   C    _CD1    16     1.51807   111.96160   173.39354
   17    16 S   O    _OE1    17     1.22762   123.16938    12.18185
   18    16 S   N    _N2_    18     1.38637   111.86069  -167.99712
   19    18 S   H    _HN2    19     1.01598   119.06479     1.22749
   20    18 S   CT1  _CA2    20     1.46215   123.33177   177.10484
   21    20 S   HC   _HA2    21     1.09743   109.25658     7.07851
   22    20 S   C    _C2_    22     1.53691   109.08858  -108.47576
   23    22 S   O    _O2_    23     1.23094   122.17226  -150.71202
   24    20 S   CT   _CB2    32     1.53526   111.68982   128.96292
   25    24 S   HC   HB21    33     1.09504   109.23651    56.76596
   26    24 S   HC   HB22    34     1.09230   109.42923   175.43361
   27    22 S   N    _N3_    24     1.38287   113.93984    36.83091
   28    27 S   H    _HN3    25     1.01545   119.61378    -3.38541
   29    24 S   S    _SG2    35     1.83279   111.01716   -63.39360
   30    27 S   CT   _CA3    26     1.45274   123.26758   177.18819
   31    30 S   HC   HA31    27     1.09547   107.53814   -64.42619
   32    30 S   HC   HA32    28     1.09557   107.96736    52.02405
   33    29 S   CT   _C10    36     1.94030   104.21032  -167.00431
   34    30 S   CO3  _C3_    29     1.52970   114.05197   174.04264
   35    34 S   O2Z  _O31    30     1.26382   116.08709     0.79451
   36    34 S   O2Z  _O32    31     1.26426   114.41188  -179.16913
   37    33 S   CT   _C15    37     1.61753   108.12334    94.49770
   38    33 S   CM   _C9_    63     1.53920   106.43525   -24.97147
   39    38 S   HC   _H9_    64     1.08613   114.55569    97.84895
   40    37 S   CT   _C14    38     1.55956   111.24299    67.87334
   41    40 S   HC   _H12    39     1.09790   109.16539   -71.89450
   42    40 S   HC   _H13    40     1.09856   109.03410   172.99946
   43    37 S   CT   _C16    55     1.55301   113.03968  -168.80170
   44    43 S   HC   _H14    56     1.09463   112.04774    60.70679
   45    43 S   HC   _H15    57     1.08480   114.02187   -61.60939
   46    43 S   HC   _H16    58     1.09749   110.66125   179.33265
   47    37 S   CT   _C17    59     1.56138   113.66509   -50.91394
   48    47 S   HC   _H17    60     1.09374   112.26960   -58.76192
   49    47 S   HC   _H18    61     1.09770   110.65739  -177.63322
   50    47 S   HC   _H19    62     1.09368   112.80267    64.15778
   51    38 S   CM   _C8_    65     1.34637   128.54131   -80.29727
   52    51 S   HC   _H8_    66     1.08443   118.22428     0.38614
   53    40 S   CT   _C13    41     1.52469   116.01406    49.81551
   54    53 S   HC   _H3_    42     1.09668   108.60579  -170.74254
   55    51 S   CM   _C5_    67     1.46294   126.31371   179.50544
   56    53 S   CT   _C12    43     1.52088   112.35220   -51.12518
   57    56 S   HC   _H10    44     1.09885   109.32504   174.26677
   58    56 S   HC   _H11    45     1.09790   108.69121   -72.09577
   59    53 S   OH   _O35    53     1.42057   111.28089    72.98070
   60    59 S   HO   _H20    54     0.97246   107.70593    56.94421
   61    55 S   CM   _C6_    68     1.34688   123.06668  -176.57732
   62    61 S   HC   _H7_    69     1.09027   119.38605  -177.47850
   63    55 S   CT   _C4_    73     1.50912   118.17957     4.52268
   64    63 S   HC   _H4_    74     1.09556   110.79449    58.15597
   65    63 S   HC   _H5_    75     1.09589   112.25480   177.63744
   66    63 S   HC   _H6_    76     1.09556   110.70901   -62.91533
   67    33 S   CT   _C11    46     1.60760   105.01662  -146.16907
   68    61 S   CO3  _C7_    70     1.52930   124.98292     1.59569
   69    68 S   O2Z  _O34    71     1.26327   115.61797    64.89238
   70    68 S   O2Z  _O33    72     1.26416   114.46340  -116.98082
   71    67 S   CT   _C18    47     1.54344   115.79420   163.82082
   72    71 S   HC   _H21    48     1.09279   112.40338   -54.79619
   73    71 S   HC   _H22    49     1.09801   110.12690  -171.35200
   74    71 S   HC   _H23    50     1.08586   114.52722    68.97208
   75    67 S   OH   _O36    51     1.44833   109.07645    47.30482
   76    75 S   HO   _H24    52     0.97223   108.54649  -175.74550
  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
  28   2   1   1  21  13   4  18   7   6   9   3   2   1   5   2
   1   1  10   3   9   6   9  11   5   4   2   1   8   4   4   2
   1   1   6   2   1   1   5   3   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    67    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    56    67    71    75    43    47    38    39    51  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    42    53    56    57    58    67    71    72    73    74    75    76    43    44    45    46    47    48    49    50    38    39    51    52    55  
   35    36  
   36  
    0  
   40    41    42    53    54    56    67    71    75    59    43    44    45    46    47    48    49    50    38    39    51  
   39    51    52    55    61    63    40    43    47    56    67    71    75  
   51    52    55    67  
   41    42    53    54    56    57    58    67    59    60    43    44    45    46    47    48    49    50  
   42    53    54    56    59    43    47  
   53    54    56    59    43    47  
   44    45    46    47    48    49    50    53    67  
   45    46    47  
   46    47  
   47  
   48    49    50    53    67  
   49    50  
   50  
    0  
   52    55    61    62    68    63    64    65    66    67  
   55    61    63  
   54    56    57    58    67    71    75    59    60  
   56    57    58    67    59    60  
   61    62    68    69    70    63    64    65    66  
   57    58    67    71    72    73    74    75    76    59    60  
   58    67    71    75    59  
   67    71    75    59  
   60    67  
    0  
   62    68    69    70    63    64    65    66  
   68    69    70    63  
   64    65    66    68  
   65    66  
   66  
    0  
   71    72    73    74    75    76  
   69    70  
   70  
    0  
   72    73    74    75    76  
   73    74    75  
   74    75  
   75  
   76  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5500   0.0760  -0.425300   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   68   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   76   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    67   268.000  1.529
   33    38   317.000  1.510
   37    40   268.000  1.529
   37    43   268.000  1.529
   37    47   268.000  1.529
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    53   268.000  1.529
   53    54   340.000  1.090
   53    56   268.000  1.529
   53    59   320.000  1.410
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    67   268.000  1.529
   67    71   268.000  1.529
   67    75   320.000  1.410
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   75    76   553.000  0.945
   59    60   553.000  0.945
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   340.000  1.090
   38    39   340.000  1.080
   38    51   549.000  1.340
   51    52   340.000  1.080
   51    55   380.000  1.444
   55    61   549.000  1.340
   55    63   317.000  1.510
   61    62   340.000  1.080
   61    68   230.000  1.545
   68    69   656.000  1.250
   68    70   656.000  1.250
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   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  111.63000
   29    33    67    75.00000  111.63000
   29    33    38    75.00000  112.20000
   33    37    40    58.35000  112.70000
   33    37    43    58.35000  112.70000
   33    37    47    58.35000  112.70000
   33    67    56    58.35000  112.70000
   33    67    71    58.35000  112.70000
   33    67    75    50.00000  109.50000
   33    38    39    35.00000  117.00000
   33    38    51    70.00000  124.00000
   37    40    41    37.50000  110.70000
   37    40    42    37.50000  110.70000
   37    40    53    58.35000  112.70000
   37    43    44    37.50000  110.70000
   37    43    45    37.50000  110.70000
   37    43    46    37.50000  110.70000
   37    47    48    37.50000  110.70000
   37    47    49    37.50000  110.70000
   37    47    50    37.50000  110.70000
   40    53    54    37.50000  110.70000
   40    53    56    58.35000  112.70000
   40    53    59    50.00000  109.50000
   42    40    41    33.00000  107.80000
   53    40    41    37.50000  110.70000
   53    40    42    37.50000  110.70000
   53    56    57    37.50000  110.70000
   53    56    58    37.50000  110.70000
   53    56    67    58.35000  112.70000
   53    59    60    55.00000  108.50000
   56    53    54    37.50000  110.70000
   56    67    71    58.35000  112.70000
   56    67    75    50.00000  109.50000
   58    56    57    33.00000  107.80000
   67    33    37    58.35000  112.70000
   67    56    57    37.50000  110.70000
   67    56    58    37.50000  110.70000
   67    71    72    37.50000  110.70000
   67    71    73    37.50000  110.70000
   67    71    74    37.50000  110.70000
   67    75    76    55.00000  108.50000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   75    67    71    50.00000  109.50000
   59    53    54    35.00000  109.50000
   59    53    56    50.00000  109.50000
   43    37    40    58.35000  112.70000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   47    37    40    58.35000  112.70000
   47    37    43    58.35000  112.70000
   49    47    48    33.00000  107.80000
   50    47    48    33.00000  107.80000
   50    47    49    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    67    70.00000  112.02700
   38    51    52    35.00000  120.00000
   38    51    55    70.00000  123.01800
   51    38    39    35.00000  120.00000
   51    55    61    70.00000  123.01800
   51    55    63    70.00000  124.00000
   55    51    52    35.00000  120.00000
   55    61    62    35.00000  120.00000
   55    61    68    55.00000  124.75400
   55    63    64    35.00000  109.50000
   55    63    65    35.00000  109.50000
   55    63    66    35.00000  109.50000
   61    68    69    85.00000  113.83300
   61    68    70    85.00000  113.83300
   68    61    62    40.00000  118.53000
   70    68    69    80.00000  126.00000
   63    55    61    70.00000  124.00000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    67   0.01700  1.0 1.0
   24    29    33    67  -0.23550 -1.0 2.0
   24    29    33    67   0.21350  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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    40   0.44750  1.0 1.0
   29    33    37    40  -0.17800 -1.0 2.0
   29    33    37    40   0.20200  1.0 3.0
   29    33    37    43   0.44750  1.0 1.0
   29    33    37    43  -0.17800 -1.0 2.0
   29    33    37    43   0.20200  1.0 3.0
   29    33    37    47   0.44750  1.0 1.0
   29    33    37    47  -0.17800 -1.0 2.0
   29    33    37    47   0.20200  1.0 3.0
   29    33    67    56   0.44750  1.0 1.0
   29    33    67    56  -0.17800 -1.0 2.0
   29    33    67    56   0.20200  1.0 3.0
   29    33    67    71   0.44750  1.0 1.0
   29    33    67    71  -0.17800 -1.0 2.0
   29    33    67    71   0.20200  1.0 3.0
   29    33    67    75   0.56750  1.0 1.0
   29    33    67    75  -0.07550 -1.0 2.0
   29    33    67    75   0.20000  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    51   0.42700  1.0 1.0
   29    33    38    51  -0.70350 -1.0 2.0
   29    33    38    51  -0.43150  1.0 3.0
   33    37    40    41   0.15000  1.0 3.0
   33    37    40    42   0.15000  1.0 3.0
   33    37    40    53   0.56750  1.0 1.0
   33    37    40    53  -0.07550 -1.0 2.0
   33    37    40    53   0.20000  1.0 3.0
   33    37    43    44   0.15000  1.0 3.0
   33    37    43    45   0.15000  1.0 3.0
   33    37    43    46   0.15000  1.0 3.0
   33    37    47    48   0.15000  1.0 3.0
   33    37    47    49   0.15000  1.0 3.0
   33    37    47    50   0.15000  1.0 3.0
   33    67    71    72   0.15000  1.0 3.0
   33    67    71    73   0.15000  1.0 3.0
   33    67    71    74   0.15000  1.0 3.0
   33    67    75    76  -0.11600  1.0 1.0
   33    67    75    76  -0.09450 -1.0 2.0
   33    67    75    76   0.21250  1.0 3.0
   33    38    51    52   7.00000 -1.0 2.0
   33    38    51    55   7.00000 -1.0 2.0
   37    33    67    56   0.56750  1.0 1.0
   37    33    67    56  -0.07550 -1.0 2.0
   37    33    67    56   0.20000  1.0 3.0
   37    33    67    71   0.56750  1.0 1.0
   37    33    67    71  -0.07550 -1.0 2.0
   37    33    67    71   0.20000  1.0 3.0
   37    33    67    75   0.86500  1.0 1.0
   37    33    67    75  -0.17500 -1.0 2.0
   37    33    67    75   0.20800  1.0 3.0
   37    33    38    39   0.00000  1.0 1.0
   37    33    38    51   0.09850  1.0 1.0
   37    33    38    51   0.15250 -1.0 2.0
   37    33    38    51  -0.50650  1.0 3.0
   37    40    53    54   0.15000  1.0 3.0
   37    40   -53    56   0.56750  1.0 1.0
   37    40   -53    56  -0.07550 -1.0 2.0
   37    40   -53    56   0.20000  1.0 3.0
   37    40    53    59   0.86500  1.0 1.0
   37    40    53    59  -0.17500 -1.0 2.0
   37    40    53    59   0.20800  1.0 3.0
   40    37    43    44   0.15000  1.0 3.0
   40    37    43    45   0.15000  1.0 3.0
   40    37    43    46   0.15000  1.0 3.0
   40    37    47    48   0.15000  1.0 3.0
   40    37    47    49   0.15000  1.0 3.0
   40    37    47    50   0.15000  1.0 3.0
   40    53    56    57   0.15000  1.0 3.0
   40    53    56    58   0.15000  1.0 3.0
   40    53    56    67   0.56750  1.0 1.0
   40    53    56    67  -0.07550 -1.0 2.0
   40    53    56    67   0.20000  1.0 3.0
   40    53    59    60  -0.11600  1.0 1.0
   40    53    59    60  -0.09450 -1.0 2.0
   40    53    59    60   0.21250  1.0 3.0
   41    40    53    54   0.15000  1.0 3.0
   41    40    53    56   0.15000  1.0 3.0
   41    40    53    59   0.23400  1.0 3.0
   42    40    53    54   0.15000  1.0 3.0
   42    40    53    56   0.15000  1.0 3.0
   42    40    53    59   0.23400  1.0 3.0
   53    56   -67    33   0.56750  1.0 1.0
   53    56   -67    33  -0.07550 -1.0 2.0
   53    56   -67    33   0.20000  1.0 3.0
   53    56    67    71   0.56750  1.0 1.0
   53    56    67    71  -0.07550 -1.0 2.0
   53    56    67    71   0.20000  1.0 3.0
   53    56    67    75   0.86500  1.0 1.0
   53    56    67    75  -0.17500 -1.0 2.0
   53    56    67    75   0.20800  1.0 3.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   54    53    56    67   0.15000  1.0 3.0
   54    53    59    60   0.19450  1.0 3.0
   56    53    59    60  -0.11600  1.0 1.0
   56    53    59    60  -0.09450 -1.0 2.0
   56    53    59    60   0.21250  1.0 3.0
   56    67    71    72   0.15000  1.0 3.0
   56    67    71    73   0.15000  1.0 3.0
   56    67    71    74   0.15000  1.0 3.0
   56    67    75    76  -0.11600  1.0 1.0
   56    67    75    76  -0.09450 -1.0 2.0
   56    67    75    76   0.21250  1.0 3.0
   57    56    67    33   0.15000  1.0 3.0
   57    56    67    71   0.15000  1.0 3.0
   57    56    67    75   0.23400  1.0 3.0
   58    56    67    33   0.15000  1.0 3.0
   58    56    67    71   0.15000  1.0 3.0
   58    56    67    75   0.23400  1.0 3.0
   67    33   -37    40   0.56750  1.0 1.0
   67    33   -37    40  -0.07550 -1.0 2.0
   67    33   -37    40   0.20000  1.0 3.0
   67    33    37    43   0.56750  1.0 1.0
   67    33    37    43  -0.07550 -1.0 2.0
   67    33    37    43   0.20000  1.0 3.0
   67    33    37    47   0.56750  1.0 1.0
   67    33    37    47  -0.07550 -1.0 2.0
   67    33    37    47   0.20000  1.0 3.0
   67    33    38    39   0.00000  1.0 1.0
   67    33    38    51   0.09850  1.0 1.0
   67    33    38    51   0.15250 -1.0 2.0
   67    33    38    51  -0.50650  1.0 3.0
   71    67    75    76  -0.11600  1.0 1.0
   71    67    75    76  -0.09450 -1.0 2.0
   71    67    75    76   0.21250  1.0 3.0
   75    67    71    72   0.23400  1.0 3.0
   75    67    71    73   0.23400  1.0 3.0
   75    67    71    74   0.23400  1.0 3.0
   59    53    56    57   0.23400  1.0 3.0
   59    53    56    58   0.23400  1.0 3.0
   59    53    56    67   0.86500  1.0 1.0
   59    53    56    67  -0.17500 -1.0 2.0
   59    53    56    67   0.20800  1.0 3.0
   43    37    40    41   0.15000  1.0 3.0
   43    37    40    42   0.15000  1.0 3.0
   43    37    40    53   0.56750  1.0 1.0
   43    37    40    53  -0.07550 -1.0 2.0
   43    37    40    53   0.20000  1.0 3.0
   43    37    47    48   0.15000  1.0 3.0
   43    37    47    49   0.15000  1.0 3.0
   43    37    47    50   0.15000  1.0 3.0
   47    37    40    41   0.15000  1.0 3.0
   47    37    40    42   0.15000  1.0 3.0
   47    37    40    53   0.56750  1.0 1.0
   47    37    40    53  -0.07550 -1.0 2.0
   47    37    40    53   0.20000  1.0 3.0
   47    37    43    44   0.15000  1.0 3.0
   47    37    43    45   0.15000  1.0 3.0
   47    37    43    46   0.15000  1.0 3.0
   38    33    37    40   0.34400  1.0 1.0
   38    33    37    40   0.09450 -1.0 2.0
   38    33    37    40   0.11100  1.0 3.0
   38    33    37    43   0.34400  1.0 1.0
   38    33    37    43   0.09450 -1.0 2.0
   38    33    37    43   0.11100  1.0 3.0
   38    33    37    47   0.34400  1.0 1.0
   38    33    37    47   0.09450 -1.0 2.0
   38    33    37    47   0.11100  1.0 3.0
   38    33    67    56   0.34400  1.0 1.0
   38    33    67    56   0.09450 -1.0 2.0
   38    33    67    56   0.11100  1.0 3.0
   38    33    67    71   0.34400  1.0 1.0
   38    33    67    71   0.09450 -1.0 2.0
   38    33    67    71   0.11100  1.0 3.0
   38    33    67    75   1.05650  1.0 1.0
   38    33    67    75   0.15600 -1.0 2.0
   38    33    67    75   0.53150  1.0 3.0
   38    51    55    61   0.28850  1.0 1.0
   38    51    55    61   2.61350 -1.0 2.0
   38    51    55    61   0.78400  1.0 3.0
   38    51    55    63  -0.18600  1.0 3.0
   39    38    51    52   7.00000 -1.0 2.0
   39    38    51    55   7.00000 -1.0 2.0
   51    55    61    62   7.00000 -1.0 2.0
   51    55    61    68   7.00000 -1.0 2.0
   51    55    63    64   0.00000  1.0 1.0
   51    55    63    65   0.00000  1.0 1.0
   51    55    63    66   0.00000  1.0 1.0
   52    51    55    61  -0.18600  1.0 3.0
   52    51    55    63   0.00000  1.0 1.0
   55    61    68    69  -0.04000 -1.0 2.0
   55    61    68    69  -0.29050  1.0 3.0
   55    61    68    70  -0.04000 -1.0 2.0
   55    61    68    70  -0.29050  1.0 3.0
   61    55    63    64   0.00000  1.0 1.0
   61    55    63    65   0.00000  1.0 1.0
   61    55    63    66   0.00000  1.0 1.0
   62    61    68    69   0.00000  1.0 1.0
   62    61    68    70   0.00000  1.0 1.0
   63    55    61    62   7.00000 -1.0 2.0
   63    55    61    68   7.00000 -1.0 2.0
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    39    38    51  15.00000 -1.0 2.0
   55    52    51    38  15.00000 -1.0 2.0
   51    63    55    61  15.00000 -1.0 2.0
   68    62    61    55  15.00000 -1.0 2.0
   69    61    68    70  10.50000 -1.0 2.0
END
