* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    135    204     388
    1     0 S   NP   _N1_     1    28.92273    96.64295   -23.35345
    2     1 S   H    _HN1     2     1.02948    69.92934     0.34035
    3     1 S   H    _H1_     3     1.02827    39.28488   160.75940
    4     1 S   H    _H2_     4     1.02801   108.23353  -103.08329
    5     1 S   CT   _CA1     5     1.50110   136.58319    99.26926
    6     5 S   HC   _HA1     6     1.09574   105.19760    95.88778
    7     5 S   CO3  _C1_     7     1.53769   112.34961   -24.37750
    8     7 S   O2Z  _O11     8     1.26366   115.04228   -46.11043
    9     7 S   O2Z  _O12     9     1.26222   114.92919   132.89617
   10     5 S   CT   _CB1    10     1.53047   107.39014  -146.17695
   11    10 S   HC   HB11    11     1.09844   109.42385   -49.54245
   12    10 S   HC   HB12    12     1.09810   110.44744    67.04421
   13    10 S   CT   _CG1    13     1.53013   112.61078  -170.44181
   14    13 S   HC   HG11    14     1.09524   110.69194   -66.69476
   15    13 S   HC   HG12    15     1.09649   109.73797    52.59396
   16    13 S   C    _CD1    16     1.51756   111.76613   173.49308
   17    16 S   O    _OE1    17     1.22773   123.03809    17.50015
   18    16 S   N    _N2_    18     1.38599   112.04616  -163.00962
   19    18 S   H    _HN2    19     1.01591   119.08827     1.93674
   20    18 S   CT1  _CA2    20     1.46279   123.27071   177.83463
   21    20 S   HC   _HA2    21     1.09725   109.32292     8.73523
   22    20 S   C    _C2_    22     1.53631   108.91143  -107.03814
   23    22 S   O    _O2_    23     1.23084   122.17861  -148.35306
   24    20 S   CT   _CB2    32     1.53307   111.43649   130.68949
   25    24 S   HC   HB21    33     1.09373   109.47391    60.07126
   26    24 S   HC   HB22    34     1.09518   110.30359   178.01545
   27    22 S   N    _N3_    24     1.38286   113.89945    39.01090
   28    27 S   H    _HN3    25     1.01539   119.64918    -2.91007
   29    24 S   S    _SG2    35     1.83107   111.31670   -62.86513
   30    27 S   CT   _CA3    26     1.45284   123.31271   177.40950
   31    30 S   HC   HA31    27     1.09546   107.49272   -65.43082
   32    30 S   HC   HA32    28     1.09555   108.02532    51.04113
   33    29 S   CT   _C15    36     1.87751   101.15732   145.29783
   34    30 S   CO3  _C3_    29     1.52991   114.01827   173.05211
   35    34 S   O2Z  _O31    30     1.26387   116.07754    -0.60587
   36    34 S   O2Z  _O32    31     1.26426   114.41771   179.44999
   37    33 S   CA   _C7_    37     1.53271   111.40932   -61.02117
   38    33 S   CT   _C14    50     1.53613   109.02035    66.04783
   39    38 S   HC   _H4_    51     1.09613   113.07889   -32.38996
   40    37 S   CA   _C6_    38     1.41275   119.77889   -52.54968
   41    40 S   HA   _H8_    39     1.08858   119.55354    -1.51233
   42    38 S   OS   _O34    52     1.43843   107.30200    85.99196
   43    40 S   CA   _C5_    40     1.40163   122.54047   177.62224
   44    42 S   CMA  _C17    53     1.41957   105.94583    26.64956
   45    44 S   OM   _O35    54     1.26319   122.02085   164.54210
   46    43 S   CA   _C10    41     1.39813   119.11233    -1.37045
   47    33 S   CM   _C16    55     1.51711   106.92416   171.11546
   48    43 S   CT   _C4_    69     1.50335   119.62686  -179.61539
   49    48 S   HC   _H5_    70     1.09455   109.99519   110.33658
   50    48 S   HC   _H6_    71     1.09488   110.51917  -128.75426
   51    48 S   HC   _H7_    72     1.09503   111.54509    -9.62423
   52    46 S   CA   _C9_    42     1.39912   119.19942     1.02488
   53    52 S   HA   _H9_    43     1.08448   119.27729  -178.46545
   54    47 S   CT   _C18    56     1.50030   122.72942    81.35015
   55    54 S   HC   _H15    57     1.09409   110.77439   -55.72040
   56    54 S   HC   _H16    58     1.09473   112.59711  -175.10719
   57    54 S   HC   _H17    59     1.09408   110.66844    65.43269
   58    46 S   OS   _O33    64     1.37171   115.89711  -178.39868
   59    37 S   CA   _C8_    44     1.41374   122.16800   125.05329
   60    58 S   CT   _C11    65     1.42211   117.51797  -178.54142
   61    60 S   HC   _H10    66     1.09430   107.73054   178.61224
   62    60 S   HC   _H11    67     1.09499   111.20033    60.88156
   63    60 S   HC   _H12    68     1.09489   111.08935   -63.73244
   64    59 S   CT   _C12    45     1.52358   121.04310     0.09691
   65    64 S   HC   _H3_    46     1.09869   106.79262   -90.47995
   66    64 S   CT   _C13    47     1.52698   110.61730    27.41868
   67    66 S   HC   _H13    48     1.09897   110.57594    67.37325
   68    66 S   HC   _H14    49     1.09807   110.64948  -176.36315
   69    64 S   CT   _C19    60     1.53599   115.01314   150.14400
   70    69 S   HC   _H18    61     1.09575   111.43931   -53.41416
   71    69 S   HC   _H19    62     1.09587   110.85400  -173.73944
   72    69 S   HC   _H20    63     1.09456   111.70968    67.69381
  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  11   5   4   3
  20   2   1   1  18  14   7  12   4   8  10   7   2  13   6   5
   2   1   1   8   3   3   2   1   1   5   9   3   2   1   1   8
   7   6   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    47    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    59    66    38    39    42    44    47    54  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    43    52    59    64    66    67    68    38    39    42    44    45    47    54    55    56    57  
   35    36  
   36  
    0  
   40    41    43    46    52    53    59    64    65    66    38    39    42    44    47    54    69    48  
   39    42    44    45    47    54    69    40    59    64    65    66    67    68  
   42    44    47    64    66    67    68  
   41    43    46    52    59    64    47    58    48    49    50    51  
   43    46    59    48  
   44    45    47    54    64    66    67    68  
   46    52    53    59    58    60    48    49    50    51  
   45    47    54    55    56    57    66  
   47    54  
   52    53    59    64    58    60    61    62    63    48    49    50    51  
   54    55    56    57    59    66  
   49    50    51    52    58  
   50    51  
   51  
    0  
   53    59    64    65    66    69    58    60  
   59    64    58  
   55    56    57  
   56    57  
   57  
    0  
   60    61    62    63    59  
   64    65    66    67    68    69    70    71    72  
   61    62    63  
   62    63  
   63  
    0  
   65    66    67    68    69    70    71    72  
   66    67    68    69    70    71    72  
   67    68    69    70    71    72  
   68    69  
   69  
   70    71    72  
   71    72  
   72  
    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   0.282500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   42   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   45   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   46   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   59   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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    47   317.000  1.510
   37    40   469.000  1.400
   37    59   469.000  1.400
   40    41   367.000  1.080
   40    43   469.000  1.400
   43    46   469.000  1.400
   43    48   317.000  1.510
   46    52   469.000  1.400
   46    58   450.000  1.364
   52    53   367.000  1.080
   52    59   469.000  1.400
   59    64   317.000  1.510
   64    65   340.000  1.090
   64    66   268.000  1.529
   64    69   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    38   268.000  1.529
   38    39   340.000  1.090
   38    42   320.000  1.410
   42    44   440.000  1.360
   44    45   745.000  1.250
   44    47   465.000  1.376
   47    54   317.000  1.510
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   58    60   320.000  1.410
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   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    80.00000  109.48900
   29    33    38    75.00000  111.63000
   29    33    47    75.00000  112.20000
   33    37    40    70.00000  120.00000
   33    37    59    70.00000  120.00000
   33    38    66    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    42    50.00000  109.50000
   33    47    44    70.00000  124.00000
   33    47    54    65.00000  117.92700
   37    40    41    35.00000  120.00000
   37    40    43    63.00000  120.00000
   37    59    52    63.00000  120.00000
   37    59    64    70.00000  120.00000
   40    43    46    63.00000  120.00000
   40    43    48    70.00000  120.00000
   43    40    41    35.00000  120.00000
   43    46    52    63.00000  120.00000
   43    46    58    70.00000  120.00000
   43    48    49    35.00000  109.50000
   43    48    50    35.00000  109.50000
   43    48    51    35.00000  109.50000
   46    52    53    35.00000  120.00000
   46    52    59    63.00000  120.00000
   46    58    60    75.00000  111.00000
   52    59    64    70.00000  120.00000
   59    37    40    63.00000  120.00000
   59    52    53    35.00000  120.00000
   59    64    65    35.00000  109.50000
   59    64    66    70.00000  112.17500
   59    64    69    70.00000  112.17500
   64    66    67    37.50000  110.70000
   64    66    68    37.50000  110.70000
   64    66    38    58.35000  112.70000
   64    69    70    37.50000  110.70000
   64    69    71    37.50000  110.70000
   64    69    72    37.50000  110.70000
   66    64    65    37.50000  110.70000
   66    38    39    37.50000  110.70000
   66    38    42    50.00000  109.50000
   68    66    67    33.00000  107.80000
   38    33    37    70.00000  112.17500
   38    66    67    37.50000  110.70000
   38    66    68    37.50000  110.70000
   38    42    44    90.00000  111.18400
   42    38    39    35.00000  109.50000
   42    44    45    65.00000  121.00000
   42    44    47    80.00000  120.01400
   44    47    54    70.00000  124.00000
   47    33    37    70.00000  112.99600
   47    33    38    70.00000  112.02700
   47    44    45    65.00000  137.10300
   47    54    55    35.00000  109.50000
   47    54    56    35.00000  109.50000
   47    54    57    35.00000  109.50000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   69    64    65    37.50000  110.70000
   69    64    66    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   58    46    52    70.00000  120.00000
   58    60    61    35.00000  109.50000
   58    60    62    35.00000  109.50000
   58    60    63    35.00000  109.50000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   48    43    46    70.00000  120.00000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    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  -0.23050  1.0 1.0
   24    29    33    37   0.06200 -1.0 2.0
   24    29    33    37   0.47200  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    47  -0.62250  1.0 1.0
   24    29    33    47  -0.38450 -1.0 2.0
   24    29    33    47   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  -0.16000  1.0 1.0
   29    33    37    40  -0.03200 -1.0 2.0
   29    33    37    40   0.04500  1.0 3.0
   29    33    37    59  -0.16000  1.0 1.0
   29    33    37    59  -0.03200 -1.0 2.0
   29    33    37    59   0.04500  1.0 3.0
   29    33    38    66   0.44750  1.0 1.0
   29    33    38    66  -0.17800 -1.0 2.0
   29    33    38    66   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    47    44   0.42700  1.0 1.0
   29    33    47    44  -0.70350 -1.0 2.0
   29    33    47    44  -0.43150  1.0 3.0
   29    33    47    54   0.30250  1.0 1.0
   29    33    47    54  -0.14950 -1.0 2.0
   29    33    47    54   0.36900  1.0 3.0
   33    37    40    41   3.62500 -1.0 2.0
   33    37    40    43   3.62500 -1.0 2.0
   33    37    59    52   3.62500 -1.0 2.0
   33    37    59    64   3.62500 -1.0 2.0
   33    38   -42    44  -0.46850  1.0 1.0
   33    38   -42    44   0.09300 -1.0 2.0
   33    38   -42    44  -0.12850  1.0 3.0
   33    47    54    55   0.34800  1.0 3.0
   33    47    54    56   0.34800  1.0 3.0
   33    47    54    57   0.34800  1.0 3.0
   37    33    38    66  -0.03700  1.0 1.0
   37    33    38    66   0.37200 -1.0 2.0
   37    33    38    66  -0.47300  1.0 3.0
   37    33    38    39   0.43200  1.0 3.0
   37    33    38    42  -0.64350  1.0 1.0
   37    33    38    42  -0.04200 -1.0 2.0
   37    33    38    42   0.19800  1.0 3.0
   37    33    47    44   1.44450  1.0 1.0
   37    33    47    44   0.06600 -1.0 2.0
   37    33    47    44   0.29250  1.0 3.0
   37    33    47    54   0.09700  1.0 1.0
   37    33    47    54   0.15600 -1.0 2.0
   37    33    47    54  -0.50800  1.0 3.0
   37    40    43    46   3.62500 -1.0 2.0
   37    40    43    48   3.62500 -1.0 2.0
   37    59    64    65   0.00000  1.0 1.0
   37    59   -64    66   0.04150 -1.0 2.0
   37    59    64    69   0.04150 -1.0 2.0
   40    37    59    52   3.62500 -1.0 2.0
   40    37    59    64   3.62500 -1.0 2.0
   40    43   -46    52   3.62500 -1.0 2.0
   40    43    46    58   3.62500 -1.0 2.0
   40    43    48    49   0.00000  1.0 1.0
   40    43    48    50   0.00000  1.0 1.0
   40    43    48    51   0.00000  1.0 1.0
   41    40    43    46   3.62500 -1.0 2.0
   41    40    43    48   3.62500 -1.0 2.0
   43    46    52    53   3.62500 -1.0 2.0
   43    46    52    59   3.62500 -1.0 2.0
   43    46    58    60   1.63200 -1.0 2.0
   46    43    48    49   0.00000  1.0 1.0
   46    43    48    50   0.00000  1.0 1.0
   46    43    48    51   0.00000  1.0 1.0
   46    52   -59    37   3.62500 -1.0 2.0
   46    52    59    64   3.62500 -1.0 2.0
   46    58    60    61   0.08050  1.0 3.0
   46    58    60    62   0.08050  1.0 3.0
   46    58    60    63   0.08050  1.0 3.0
   52    46    58    60   1.63200 -1.0 2.0
   52    59    64    65   0.00000  1.0 1.0
   52    59    64    66   0.04150 -1.0 2.0
   52    59    64    69   0.04150 -1.0 2.0
   53    52    59    37   3.62500 -1.0 2.0
   53    52    59    64   3.62500 -1.0 2.0
   59    37    40    41   3.62500 -1.0 2.0
   59    37   -40    43   3.62500 -1.0 2.0
   59    64    66    67   0.43200  1.0 3.0
   59    64    66    68   0.43200  1.0 3.0
   59    64    66    38  -0.03700  1.0 1.0
   59    64    66    38   0.37200 -1.0 2.0
   59    64    66    38  -0.47300  1.0 3.0
   59    64    69    70   0.43200  1.0 3.0
   59    64    69    71   0.43200  1.0 3.0
   59    64    69    72   0.43200  1.0 3.0
   64    66   -38    33   0.56750  1.0 1.0
   64    66   -38    33  -0.07550 -1.0 2.0
   64    66   -38    33   0.20000  1.0 3.0
   64    66    38    39   0.15000  1.0 3.0
   64    66    38    42   0.62750  1.0 1.0
   64    66    38    42  -0.30950 -1.0 2.0
   64    66    38    42   0.27300  1.0 3.0
   65    64    66    67   0.15000  1.0 3.0
   65    64    66    68   0.15000  1.0 3.0
   65    64    66    38   0.15000  1.0 3.0
   65    64    69    70   0.15000  1.0 3.0
   65    64    69    71   0.15000  1.0 3.0
   65    64    69    72   0.15000  1.0 3.0
   66    64    69    70   0.15000  1.0 3.0
   66    64    69    71   0.15000  1.0 3.0
   66    64    69    72   0.15000  1.0 3.0
   66    38    42    44  -0.46850  1.0 1.0
   66    38    42    44   0.09300 -1.0 2.0
   66    38    42    44  -0.12850  1.0 3.0
   67    66    38    33   0.15000  1.0 3.0
   67    66    38    39   0.15000  1.0 3.0
   67    66    38    42   0.23400  1.0 3.0
   68    66    38    33   0.15000  1.0 3.0
   68    66    38    39   0.15000  1.0 3.0
   68    66    38    42   0.23400  1.0 3.0
   38    33    37    40   0.04150 -1.0 2.0
   38    33   -37    59   0.04150 -1.0 2.0
   38    33   -47    44   0.09850  1.0 1.0
   38    33   -47    44   0.15250 -1.0 2.0
   38    33   -47    44  -0.50650  1.0 3.0
   38    33    47    54   0.46850  1.0 1.0
   38    33    47    54   0.08550 -1.0 2.0
   38    33    47    54   0.09800  1.0 3.0
   38    42    44    45   2.00000 -1.0 2.0
   38    42   -44    47  -2.26850  1.0 1.0
   38    42   -44    47   3.39050 -1.0 2.0
   39    38    42    44   0.08050  1.0 3.0
   42    44   -47    33   7.00000 -1.0 2.0
   42    44    47    54   7.00000 -1.0 2.0
   44    47    54    55   0.00000  1.0 1.0
   44    47    54    56   0.00000  1.0 1.0
   44    47    54    57   0.00000  1.0 1.0
   45    44    47    33   7.00000 -1.0 2.0
   45    44    47    54   7.00000 -1.0 2.0
   47    33    37    40   0.18050 -1.0 2.0
   47    33    37    59   0.18050 -1.0 2.0
   47    33    38    66   0.34400  1.0 1.0
   47    33    38    66   0.09450 -1.0 2.0
   47    33    38    66   0.11100  1.0 3.0
   47    33    38    39   0.15000  1.0 3.0
   47    33   -38    42   0.61850  1.0 1.0
   47    33   -38    42  -0.22750 -1.0 2.0
   47    33   -38    42   0.15300  1.0 3.0
   69    64    66    67   0.15000  1.0 3.0
   69    64    66    68   0.15000  1.0 3.0
   69    64    66    38   0.56750  1.0 1.0
   69    64    66    38  -0.07550 -1.0 2.0
   69    64    66    38   0.20000  1.0 3.0
   58    46    52    53   3.62500 -1.0 2.0
   58    46    52    59   3.62500 -1.0 2.0
   48    43    46    52   3.62500 -1.0 2.0
   48    43    46    58   3.62500 -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
   40    59    37    33   4.00000 -1.0 2.0
   43    41    40    37   1.10000 -1.0 2.0
   46    48    43    40   4.00000 -1.0 2.0
   52    58    46    43   4.00000 -1.0 2.0
   59    53    52    46   1.10000 -1.0 2.0
   52    64    59    37   4.00000 -1.0 2.0
   42    45    44    47   1.10000 -1.0 2.0
   33    54    47    44   1.10000 -1.0 2.0
END
