* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    128    204     377
    1     0 S   NP   _N1_     1    28.95672    94.97355   -19.60431
    2     1 S   H    _HN1     2     1.02781    77.34619   -72.24928
    3     1 S   H    _H1_     3     1.02961    97.63465    34.88948
    4     1 S   H    _H2_     4     1.02840    37.20862   143.12333
    5     1 S   CT   _CA1     5     1.50097   144.30296   177.14247
    6     5 S   HC   _HA1     6     1.09564   105.31556    38.04480
    7     5 S   CO3  _C1_     7     1.53886   112.24547   -82.38908
    8     7 S   O2Z  _O11     8     1.26370   115.02966   -46.15651
    9     7 S   O2Z  _O12     9     1.26231   114.93808   133.11471
   10     5 S   CT   _CB1    10     1.53101   107.45729   156.11308
   11    10 S   HC   HB11    11     1.09816   109.65064   -49.11993
   12    10 S   HC   HB12    12     1.09833   110.28436    67.49815
   13    10 S   CT   _CG1    13     1.53018   112.58038  -170.20359
   14    13 S   HC   HG11    14     1.09509   110.35300   -56.15467
   15    13 S   HC   HG12    15     1.09609   110.23360    62.89712
   16    13 S   C    _CD1    16     1.51782   111.93118  -176.91771
   17    16 S   O    _OE1    17     1.22742   123.06430   -17.59859
   18    16 S   N    _N2_    18     1.38541   111.81091   163.06048
   19    18 S   H    _HN2    19     1.01593   119.05156     1.62486
   20    18 S   CT1  _CA2    20     1.46277   123.47993  -176.49050
   21    20 S   HC   _HA2    21     1.09726   109.43151   -16.41065
   22    20 S   C    _C2_    22     1.53368   108.25278  -132.28869
   23    22 S   O    _O2_    23     1.23005   122.29599  -145.21816
   24    20 S   CT   _CB2    32     1.53551   111.00881   105.77884
   25    24 S   HC   HB21    33     1.09395   108.95619    54.39792
   26    24 S   HC   HB22    34     1.09487   110.62183   172.76134
   27    22 S   N    _N3_    24     1.38524   113.29596    42.13712
   28    27 S   H    _HN3    25     1.01532   118.92223    -0.53595
   29    24 S   S    _SG2    35     1.82941   111.37763   -68.11624
   30    27 S   CT   _CA3    26     1.45441   123.37716   175.13196
   31    30 S   HC   HA31    27     1.09529   109.15942    25.84444
   32    30 S   HC   HA32    28     1.09495   107.14059   142.83436
   33    29 S   CT   _C14    36     1.85878   101.70296   147.15244
   34    30 S   CO3  _C3_    29     1.52930   113.17320   -97.57926
   35    34 S   O2Z  _O31    30     1.26398   115.43297   -43.99754
   36    34 S   O2Z  _O32    31     1.26360   114.96658   136.95348
   37    33 S   CA   _C9_    37     1.51907   109.36968    75.83193
   38    33 S   CT   _C12    51     1.54265   107.41228  -159.49286
   39    38 S   HC   _H24    52     1.10088   109.09787    27.97891
   40    37 S   CA   _C7_    38     1.40730   121.08156   -87.10161
   41    40 S   HA   _H23    39     1.08753   120.58707    -2.45072
   42    38 S   CT   _C15    53     1.53958   104.46539   142.00646
   43    40 S   CA   _C5_    40     1.39661   121.25966   177.13864
   44    43 S   HA   _H21    41     1.08641   119.91024  -179.82868
   45    42 S   CT   _C13    54     1.53947   100.38503   -34.47035
   46    45 S   HC   _H25    55     1.09612   111.44101   150.95141
   47    42 S   CT   _C17    61     1.54420   113.25812    81.76018
   48    47 S   HC   _H29    62     1.09667   110.42422  -178.41267
   49    47 S   HC   _H30    63     1.09515   111.61918    62.50471
   50    47 S   HC   _H31    64     1.09313   112.74662   -59.24527
   51    42 S   CT   _C18    65     1.53524   112.52413  -155.70766
   52    51 S   HC   _H32    66     1.09580   110.91714   169.87226
   53    51 S   HC   _H33    67     1.09512   112.07667    49.34397
   54    51 S   HC   _H34    68     1.09537   111.24942   -70.51518
   55    43 S   CA   _C4_    42     1.39071   120.05809    -0.16669
   56    55 S   HA   _H20    43     1.08615   120.10775  -179.81233
   57    33 S   OS   _O18    56     1.44581   111.53994   -44.81433
   58    45 S   CT   _C16    57     1.52706   116.47820   -84.71622
   59    58 S   HC   _H26    58     1.09448   111.91073    54.86850
   60    58 S   HC   _H27    59     1.09370   111.53199   -67.25611
   61    58 S   HC   _H28    60     1.09582   110.02751   172.82378
   62    55 S   CA   _C6_    44     1.39214   119.78902     0.46604
   63    62 S   HA   _H22    45     1.08715   118.99453   179.28646
   64    37 S   CA   _C8_    46     1.40033   121.23365    90.57081
   65    64 S   CO4  _C10    47     1.46790   120.01596     4.33463
   66    65 S   O    _O16    48     1.22164   122.40104  -162.74522
   67    65 S   CO4  _C11    49     1.50297   119.19259    19.55722
   68    67 S   O    _O17    50     1.22476   117.82159   162.56391
  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  10   5   4   3
  18   2   1   1  16  20   8   9   4  18   6   3  15   7  10   3
   2   1   6   2   1   1   5   3   6   3   2   1   1   5   2   4
   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    57    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    64    67    38    39    42    45    57  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    43    62    64    65    67    68    38    39    42    45    46    57    58    47    51  
   35    36  
   36  
    0  
   40    41    43    44    55    62    63    64    65    66    67    38    39    42    45    57  
   39    42    45    46    57    58    47    48    49    50    51    52    53    54    40    64    65    66    67    68  
   42    45    57    47    51    65    67    68  
   41    43    44    55    56    62    64    65    57  
   43    44    55    64  
   45    46    57    58    59    60    61    47    48    49    50    51    52    53    54    65    67    68  
   44    55    56    62    63    64  
   55    56    62  
   46    57    58    59    60    61    47    48    49    50    51    52    53    54    67  
   57    58    59    60    61    47    51  
   48    49    50    51    52    53    54    57    58    67  
   49    50    51  
   50    51  
   51  
   52    53    54    57    58    67  
   53    54  
   54  
    0  
   56    62    63    64    65  
   62    63    64  
   58    59    60    61    64    67  
   59    60    61  
   60    61  
   61  
    0  
   63    64    65    66    67  
   64    65  
   65    66    67    68  
   66    67    68  
   67    68  
   68  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.316400   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.390700   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  -0.041800   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   43   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   44   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   45   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.030000   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   65   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   67   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   68   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
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    57   320.000  1.410
   37    40   469.000  1.400
   37    64   469.000  1.400
   40    41   367.000  1.080
   40    43   469.000  1.400
   43    44   367.000  1.080
   43    55   469.000  1.400
   55    56   367.000  1.080
   55    62   469.000  1.400
   62    63   367.000  1.080
   62    64   469.000  1.400
   64    65   310.000  1.470
   65    66   570.000  1.229
   65    67   250.000  1.523
   67    68   570.000  1.229
   67    38   317.000  1.522
   38    39   340.000  1.090
   38    42   268.000  1.529
   42    45   268.000  1.529
   42    47   268.000  1.529
   42    51   268.000  1.529
   45    46   340.000  1.090
   45    57   320.000  1.410
   45    58   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   340.000  1.090
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   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    57    85.00000  114.68000
   33    37    40    70.00000  120.00000
   33    37    64    70.00000  120.00000
   33    38    67    63.00000  111.10000
   33    38    39    37.50000  110.70000
   33    38    42    58.35000  112.70000
   33    57    45    60.00000  109.50000
   37    40    41    35.00000  120.00000
   37    40    43    63.00000  120.00000
   37    64    62    63.00000  120.00000
   37    64    65    60.00000  119.52600
   40    43    44    35.00000  120.00000
   40    43    55    63.00000  120.00000
   43    40    41    35.00000  120.00000
   43    55    56    35.00000  120.00000
   43    55    62    63.00000  120.00000
   55    43    44    35.00000  120.00000
   55    62    63    35.00000  120.00000
   55    62    64    63.00000  120.00000
   62    55    56    35.00000  120.00000
   62    64    65    60.00000  119.52600
   64    37    40    63.00000  120.00000
   64    62    63    35.00000  120.00000
   64    65    66    75.00000  123.78400
   64    65    67    60.00000  117.28700
   65    67    68    80.00000  119.30300
   65    67    38    65.00000  115.45000
   67    65    66    80.00000  119.30300
   67    38    39    35.00000  109.50000
   67    38    42    63.00000  111.10000
   38    33    37    70.00000  112.17500
   38    67    68    80.00000  120.40000
   38    42    45    58.35000  112.70000
   38    42    47    58.35000  112.70000
   38    42    51    58.35000  112.70000
   42    38    39    37.50000  110.70000
   42    45    46    37.50000  110.70000
   42    45    57    50.00000  109.50000
   42    45    58    58.35000  112.70000
   42    47    48    37.50000  110.70000
   42    47    49    37.50000  110.70000
   42    47    50    37.50000  110.70000
   42    51    52    37.50000  110.70000
   42    51    53    37.50000  110.70000
   42    51    54    37.50000  110.70000
   45    58    59    37.50000  110.70000
   45    58    60    37.50000  110.70000
   45    58    61    37.50000  110.70000
   57    33    37    85.00000  111.85700
   57    33    38    50.00000  109.50000
   57    45    46    35.00000  109.50000
   58    45    46    37.50000  110.70000
   58    45    57    50.00000  109.50000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   47    42    45    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
   51    42    45    58.35000  112.70000
   51    42    47    58.35000  112.70000
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    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    57   0.13850  1.0 1.0
   24    29    33    57  -1.34450 -1.0 2.0
   24    29    33    57   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    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    64  -0.16000  1.0 1.0
   29    33    37    64  -0.03200 -1.0 2.0
   29    33    37    64   0.04500  1.0 3.0
   29    33    38    67   0.56750  1.0 1.0
   29    33    38    67  -0.07550 -1.0 2.0
   29    33    38    67   0.20000  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    42   0.44750  1.0 1.0
   29    33    38    42  -0.17800 -1.0 2.0
   29    33    38    42   0.20200  1.0 3.0
   29    33    57    45   0.14700  1.0 1.0
   29    33    57    45  -1.16150 -1.0 2.0
   29    33    57    45   0.48700  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    64    62   3.62500 -1.0 2.0
   33    37    64    65   3.62500 -1.0 2.0
   33    38   -42    45   0.56750  1.0 1.0
   33    38   -42    45  -0.07550 -1.0 2.0
   33    38   -42    45   0.20000  1.0 3.0
   33    38    42    47   0.56750  1.0 1.0
   33    38    42    47  -0.07550 -1.0 2.0
   33    38    42    47   0.20000  1.0 3.0
   33    38    42    51   0.56750  1.0 1.0
   33    38    42    51  -0.07550 -1.0 2.0
   33    38    42    51   0.20000  1.0 3.0
   37    33    38    67   0.56750  1.0 1.0
   37    33    38    67  -0.07550 -1.0 2.0
   37    33    38    67   0.20000  1.0 3.0
   37    33    38    39   0.43200  1.0 3.0
   37    33    38    42  -0.03700  1.0 1.0
   37    33    38    42   0.37200 -1.0 2.0
   37    33    38    42  -0.47300  1.0 3.0
   37    33    57    45   0.37500  1.0 3.0
   37    40    43    44   3.62500 -1.0 2.0
   37    40    43    55   3.62500 -1.0 2.0
   37    64    65    66   1.05000 -1.0 2.0
   37    64   -65    67   0.56600 -1.0 2.0
   40    37    64    62   3.62500 -1.0 2.0
   40    37    64    65   3.62500 -1.0 2.0
   40    43    55    56   3.62500 -1.0 2.0
   40    43   -55    62   3.62500 -1.0 2.0
   41    40    43    44   3.62500 -1.0 2.0
   41    40    43    55   3.62500 -1.0 2.0
   43    55    62    63   3.62500 -1.0 2.0
   43    55    62    64   3.62500 -1.0 2.0
   44    43    55    56   3.62500 -1.0 2.0
   44    43    55    62   3.62500 -1.0 2.0
   55    62   -64    37   3.62500 -1.0 2.0
   55    62    64    65   3.62500 -1.0 2.0
   56    55    62    63   3.62500 -1.0 2.0
   56    55    62    64   3.62500 -1.0 2.0
   62    64    65    66   1.05000 -1.0 2.0
   62    64    65    67   0.56600 -1.0 2.0
   63    62    64    37   3.62500 -1.0 2.0
   63    62    64    65   3.62500 -1.0 2.0
   64    37    40    41   3.62500 -1.0 2.0
   64    37   -40    43   3.62500 -1.0 2.0
   64    65    67    68   0.03000  1.0 1.0
   64    65    67    68   0.58800 -1.0 2.0
   64    65    67    68   0.15550  1.0 3.0
   64    65    67    38   0.43900  1.0 1.0
   64    65    67    38  -0.18150 -1.0 2.0
   64    65    67    38  -0.03650  1.0 3.0
   65    67   -38    33   0.65300  1.0 1.0
   65    67   -38    33  -0.03850 -1.0 2.0
   65    67   -38    33   0.33900  1.0 3.0
   65    67    38    39   0.00000  1.0 1.0
   65    67    38    42   0.65300  1.0 1.0
   65    67    38    42  -0.03850 -1.0 2.0
   65    67    38    42   0.33900  1.0 3.0
   66    65    67    68   0.06100 -1.0 2.0
   66    65    67    38   0.49600 -1.0 2.0
   67    38    42    45  -0.95700  1.0 1.0
   67    38    42    45  -0.18200 -1.0 2.0
   67    38    42    45   0.29450  1.0 3.0
   67    38    42    47  -0.95700  1.0 1.0
   67    38    42    47  -0.18200 -1.0 2.0
   67    38    42    47   0.29450  1.0 3.0
   67    38    42    51  -0.95700  1.0 1.0
   67    38    42    51  -0.18200 -1.0 2.0
   67    38    42    51   0.29450  1.0 3.0
   68    67    38    33   0.30150 -1.0 2.0
   68    67    38    39   0.00000  1.0 1.0
   68    67    38    42   0.30150 -1.0 2.0
   38    33    37    40   0.04150 -1.0 2.0
   38    33   -37    64   0.04150 -1.0 2.0
   38    33   -57    45   0.06250  1.0 1.0
   38    33   -57    45  -0.01100 -1.0 2.0
   38    33   -57    45   0.28050  1.0 3.0
   38    42    45    46   0.15000  1.0 3.0
   38    42   -45    57   0.62750  1.0 1.0
   38    42   -45    57  -0.30950 -1.0 2.0
   38    42   -45    57   0.27300  1.0 3.0
   38    42    45    58   0.56750  1.0 1.0
   38    42    45    58  -0.07550 -1.0 2.0
   38    42    45    58   0.20000  1.0 3.0
   38    42    47    48   0.15000  1.0 3.0
   38    42    47    49   0.15000  1.0 3.0
   38    42    47    50   0.15000  1.0 3.0
   38    42    51    52   0.15000  1.0 3.0
   38    42    51    53   0.15000  1.0 3.0
   38    42    51    54   0.15000  1.0 3.0
   39    38    42    45   0.15000  1.0 3.0
   39    38    42    47   0.15000  1.0 3.0
   39    38    42    51   0.15000  1.0 3.0
   42    45   -57    33   0.06250  1.0 1.0
   42    45   -57    33  -0.01100 -1.0 2.0
   42    45   -57    33   0.28050  1.0 3.0
   42    45    58    59   0.15000  1.0 3.0
   42    45    58    60   0.15000  1.0 3.0
   42    45    58    61   0.15000  1.0 3.0
   45    42    47    48   0.15000  1.0 3.0
   45    42    47    49   0.15000  1.0 3.0
   45    42    47    50   0.15000  1.0 3.0
   45    42    51    52   0.15000  1.0 3.0
   45    42    51    53   0.15000  1.0 3.0
   45    42    51    54   0.15000  1.0 3.0
   46    45    57    33   0.37050  1.0 3.0
   46    45    58    59   0.15000  1.0 3.0
   46    45    58    60   0.15000  1.0 3.0
   46    45    58    61   0.15000  1.0 3.0
   57    33    37    40   0.64500  1.0 1.0
   57    33    37    40   0.14800 -1.0 2.0
   57    33    37    40   0.20650  1.0 3.0
   57    33    37    64   0.64500  1.0 1.0
   57    33    37    64   0.14800 -1.0 2.0
   57    33    37    64   0.20650  1.0 3.0
   57    33    38    67  -0.09450  1.0 1.0
   57    33    38    67  -1.12950 -1.0 2.0
   57    33    38    67   0.54000  1.0 3.0
   57    33    38    39   0.23400  1.0 3.0
   57    33   -38    42   0.62750  1.0 1.0
   57    33   -38    42  -0.30950 -1.0 2.0
   57    33   -38    42   0.27300  1.0 3.0
   57    45    58    59   0.23400  1.0 3.0
   57    45    58    60   0.23400  1.0 3.0
   57    45    58    61   0.23400  1.0 3.0
   58    45    57    33   0.06250  1.0 1.0
   58    45    57    33  -0.01100 -1.0 2.0
   58    45    57    33   0.28050  1.0 3.0
   47    42    45    46   0.15000  1.0 3.0
   47    42    45    57   0.62750  1.0 1.0
   47    42    45    57  -0.30950 -1.0 2.0
   47    42    45    57   0.27300  1.0 3.0
   47    42    45    58   0.56750  1.0 1.0
   47    42    45    58  -0.07550 -1.0 2.0
   47    42    45    58   0.20000  1.0 3.0
   47    42    51    52   0.15000  1.0 3.0
   47    42    51    53   0.15000  1.0 3.0
   47    42    51    54   0.15000  1.0 3.0
   51    42    45    46   0.15000  1.0 3.0
   51    42    45    57   0.62750  1.0 1.0
   51    42    45    57  -0.30950 -1.0 2.0
   51    42    45    57   0.27300  1.0 3.0
   51    42    45    58   0.56750  1.0 1.0
   51    42    45    58  -0.07550 -1.0 2.0
   51    42    45    58   0.20000  1.0 3.0
   51    42    47    48   0.15000  1.0 3.0
   51    42    47    49   0.15000  1.0 3.0
   51    42    47    50   0.15000  1.0 3.0
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
   36    30    34    35  10.50000 -1.0 2.0
   40    64    37    33   4.00000 -1.0 2.0
   43    41    40    37   1.10000 -1.0 2.0
   55    44    43    40   1.10000 -1.0 2.0
   62    56    55    43   1.10000 -1.0 2.0
   64    63    62    55   1.10000 -1.0 2.0
   62    65    64    37   4.00000 -1.0 2.0
   64    67    65    66  10.50000 -1.0 2.0
   65    38    67    68  10.50000 -1.0 2.0
END
