* LIGAND DATABASE FILE (OPLS2005)
*
001      75    74    131    190     382
    1     0 S   NP   _N1_     1    30.68005    91.66916    -5.85699
    2     1 S   H    _HN1     2     1.02828   108.49996   167.32371
    3     1 S   H    _H1_     3     1.02928    42.68854    73.00022
    4     1 S   H    _H2_     4     1.02762   138.43595    15.26693
    5     1 S   CT   _CA1     5     1.49871    69.73654   -86.02323
    6     5 S   HC   _HA1     6     1.09705   104.60570    74.07349
    7     5 S   CO3  _C1_     7     1.54243   114.13361   -41.33036
    8     7 S   O2Z  _O11     8     1.26309   115.83340  -165.19654
    9     7 S   O2Z  _O12     9     1.26439   114.69707    16.00357
   10     5 S   CT   _CB1    10     1.53183   109.21648  -170.11682
   11    10 S   HC   HB11    11     1.09729   108.84619  -178.03049
   12    10 S   HC   HB12    12     1.09828   109.38424   -63.28438
   13    10 S   CT   _CG1    13     1.53241   114.34257    58.60637
   14    13 S   HC   HG11    14     1.09611   110.13153   -74.15237
   15    13 S   HC   HG12    15     1.09554   110.57945    45.01865
   16    13 S   C    _CD1    16     1.51810   112.17738   164.99382
   17    16 S   O    _OE1    17     1.22793   122.97013    -6.56608
   18    16 S   N    _N2_    18     1.38650   112.23347   174.10904
   19    18 S   H    _HN2    19     1.01596   119.16459     1.79613
   20    18 S   CT1  _CA2    20     1.45575   122.43306   171.59662
   21    20 S   HC   _HA2    21     1.09342   109.25375     1.65682
   22    20 S   C    _C2_    22     1.52887   105.94072  -114.92650
   23    22 S   O    _O2_    23     1.23010   122.62781   -35.47667
   24    20 S   CT   _CB2    32     1.53056   113.69305   126.14419
   25    24 S   HC   HB21    33     1.09704   109.49005    63.53635
   26    24 S   HC   HB22    34     1.09589   110.07072   179.26432
   27    22 S   N    _N3_    24     1.38403   112.86100   147.79825
   28    27 S   H    _HN3    25     1.01572   120.40051    -2.26624
   29    24 S   S    _SG2    35     1.83064   117.26458   -56.76427
   30    27 S   CT   _CA3    26     1.45380   122.19491   179.56569
   31    30 S   HC   HA31    27     1.09566   107.46498   -61.67902
   32    30 S   HC   HA32    28     1.09558   107.96166    54.64583
   33    29 S   CT   _C4_    36     1.81398   102.55164   -49.65151
   34    33 S   HC   _H3_    37     1.09111   108.31306    72.15676
   35    33 S   HC   _H4_    38     1.09510   108.19265  -171.90214
   36    30 S   CO3  _C3_    29     1.52795   114.19117   176.14451
   37    36 S   O2Z  _O31    30     1.26372   115.84220   -15.84323
   38    36 S   O2Z  _O32    31     1.26379   114.63410   164.29490
   39    33 S   CO4  _C5_    39     1.50944   113.27316   -52.57758
   40    39 S   O    _O33    40     1.22419   124.84992   -35.88278
   41    39 S   S    _S1_    41     1.76669   112.85056   146.72533
   42    41 S   CT   _C6_    42     1.82111   100.70860  -157.31730
   43    42 S   HC   _H5_    43     1.09623   109.76873    36.23685
   44    42 S   HC   _H6_    44     1.09472   106.99699   -80.36650
   45    42 S   CT1  _C7_    45     1.53554   111.15580   157.84237
   46    45 S   HC   _H7_    46     1.09756   110.75939    46.40662
   47    45 S   C    _C8_    47     1.53547   111.02975   164.08490
   48    47 S   O    _O34    48     1.23041   122.27262   -26.68533
   49    45 S   N    _N5_    57     1.46330   111.13718   -74.99181
   50    49 S   H    _H11    58     1.02035   116.84139   -76.93047
   51    47 S   N    _N4_    49     1.38530   113.39327   161.46111
   52    51 S   H    _H8_    50     1.01516   118.85925    -2.41468
   53    49 S   C    _C11    59     1.38560   124.19479   102.95023
   54    53 S   O    _O37    60     1.22727   125.10472     1.06422
   55    51 S   CT   _C9_    51     1.45413   123.41398   174.81265
   56    55 S   HC   _H9_    52     1.09531   109.10415    26.60216
   57    55 S   HC   _H10    53     1.09493   107.14947   143.55662
   58    53 S   CT   _C12    61     1.51925   111.66341   179.79923
   59    58 S   HC   _H12    62     1.09463   108.29197    47.24206
   60    58 S   HC   _H13    63     1.09649   107.63742   -69.14591
   61    55 S   CO3  _C10    54     1.52942   113.23937   -96.79798
   62    61 S   O2Z  _O36    55     1.26384   114.97609   137.46878
   63    61 S   O2Z  _O35    56     1.26410   115.50504   -43.50072
   64    58 S   CT   _C13    64     1.53024   112.81559   169.19830
   65    64 S   HC   _H14    65     1.09806   109.06868    54.60742
   66    64 S   HC   _H15    66     1.09658   109.33209   -61.01535
   67    64 S   CT   _C14    67     1.53162   112.38989   175.86052
   68    67 S   HC   _H16    68     1.09633   109.59287   -62.64143
   69    67 S   CO3  _C15    69     1.53866   112.57606    59.90563
   70    69 S   O2Z  _O39    70     1.26296   114.69598  -123.76071
   71    69 S   O2Z  _O38    71     1.26232   115.34898    57.40886
   72    67 S   NP   _N6_    72     1.49970   107.58617  -176.32752
   73    72 S   H    _H17    73     1.03556   111.44925   -66.79225
   74    72 S   H    _H18    74     1.02810   110.93740   175.04860
   75    72 S   H    _H19    75     1.02718   112.46071    54.20499
  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   6   5   4   3
   6   4   3   2   1   1   6   2   7  10   5   4  11   6  10   4
   8   3   7   4   8   4   5   4   3   9   5   4   2   1   1  11
   5   4   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42  
   35    39    40    41  
   39    40    41  
   37    38  
   38  
    0  
   40    41    42    43    44    45  
   41    42  
   42    43    44    45    46    47    49  
   43    44    45    46    47    48    51    49    50    53  
   44    45    46    47    49  
   45    46    47    49  
   46    47    48    51    52    55    49    50    53    54    58  
   47    48    51    49    50    53  
   48    51    52    55    56    57    61    49    50    53  
   51    52    55    49  
   50    53    54    58    59    60    64    51  
   53    54    58  
   52    55    56    57    61    62    63  
   55    56    57    61  
   54    58    59    60    64    65    66    67  
   58    59    60    64  
   56    57    61    62    63  
   57    61    62    63  
   61    62    63  
   59    60    64    65    66    67    68    69    72  
   60    64    65    66    67  
   64    65    66    67  
   62    63  
   63  
    0  
   65    66    67    68    69    70    71    72    73    74    75  
   66    67    68    69    72  
   67    68    69    72  
   68    69    70    71    72    73    74    75  
   69    70    71    72    73    74    75  
   70    71    72    73    74    75  
   71    72  
   72  
   73    74    75  
   74    75  
   75  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.7500   0.1050   0.482400   2.1120   1.8750   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   41   3.6000   0.3550  -0.219900   2.0300   1.8000   0.025682759  -1.666211680
   42   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   49   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   50   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   51   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   52   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   53   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   55   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   61   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   67   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   69   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
   70   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   71   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   72   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
   73   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
   74   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
   75   0.5000   0.0300   0.210000   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    35   340.000  1.090
   33    39   317.000  1.522
   39    40   570.000  1.229
   39    41   210.000  1.799
   41    42   222.000  1.810
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   268.000  1.529
   45    46   340.000  1.090
   45    47   317.000  1.522
   45    49   337.000  1.449
   47    48   570.000  1.229
   47    51   490.000  1.335
   51    52   434.000  1.010
   51    55   337.000  1.449
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    61   317.000  1.522
   61    62   656.000  1.250
   61    63   656.000  1.250
   49    50   434.000  1.010
   49    53   490.000  1.335
   53    54   570.000  1.229
   53    58   317.000  1.522
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   268.000  1.529
   67    68   340.000  1.090
   67    69   317.000  1.522
   67    72   367.000  1.471
   69    70   656.000  1.250
   69    71   656.000  1.250
   72    73   434.000  1.010
   72    74   434.000  1.010
   72    75   434.000  1.010
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  110.18000
   33    39    40    80.00000  120.40000
   33    39    41    70.00000  114.16300
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    41    42    90.00000   96.72000
   41    39    40    80.00000  121.30200
   41    42    43    35.00000  109.50000
   41    42    44    35.00000  109.50000
   41    42    45    75.00000  108.68000
   42    45    46    37.50000  110.70000
   42    45    47    63.00000  111.10000
   42    45    49    80.00000  109.70000
   44    42    43    33.00000  107.80000
   45    42    43    37.50000  110.70000
   45    42    44    37.50000  110.70000
   45    47    48    80.00000  120.40000
   45    47    51    70.00000  116.60000
   45    49    50    38.00000  118.40000
   45    49    53    50.00000  121.90000
   47    45    46    35.00000  109.50000
   47    51    52    35.00000  119.80000
   47    51    55    50.00000  121.90000
   51    47    48    80.00000  122.90000
   51    55    56    35.00000  109.50000
   51    55    57    35.00000  109.50000
   51    55    61    63.00000  110.10000
   55    51    52    38.00000  118.40000
   55    61    62    70.00000  117.00000
   55    61    63    70.00000  117.00000
   57    55    56    33.00000  107.80000
   61    55    56    35.00000  109.50000
   61    55    57    35.00000  109.50000
   63    61    62    80.00000  126.00000
   49    45    46    35.00000  109.50000
   49    45    47    63.00000  110.10000
   49    53    54    80.00000  122.90000
   49    53    58    70.00000  116.60000
   53    49    50    35.00000  119.80000
   53    58    59    35.00000  109.50000
   53    58    60    35.00000  109.50000
   53    58    64    63.00000  111.10000
   58    53    54    80.00000  120.40000
   58    64    65    37.50000  110.70000
   58    64    66    37.50000  110.70000
   58    64    67    58.35000  112.70000
   60    58    59    33.00000  107.80000
   64    58    59    37.50000  110.70000
   64    58    60    37.50000  110.70000
   64    67    68    37.50000  110.70000
   64    67    69    70.00000  109.69300
   64    67    72    80.00000  111.20000
   66    64    65    33.00000  107.80000
   67    64    65    37.50000  110.70000
   67    64    66    37.50000  110.70000
   67    69    70    70.00000  117.00000
   67    69    71    70.00000  117.00000
   67    72    73    35.00000  109.50000
   67    72    74    35.00000  109.50000
   67    72    75    35.00000  109.50000
   69    67    68    35.00000  109.50000
   71    69    70    80.00000  126.00000
   72    67    68    35.00000  109.50000
   72    67    69    80.00000  109.26000
   74    72    73    35.00000  109.50000
   75    72    73    35.00000  109.50000
   75    72    74    35.00000  109.50000
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.30150 -1.0 2.0
   29    33    39    41   0.00000  1.0 1.0
   33    39    41    42  -0.11550  1.0 1.0
   33    39    41    42   1.88700 -1.0 2.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    41   0.00000  1.0 1.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    41   0.00000  1.0 1.0
   39    41    42    43   0.24000  1.0 3.0
   39    41    42    44   0.24000  1.0 3.0
   39    41    42    45   0.00000  1.0 1.0
   40    39    41    42  -0.11550  1.0 1.0
   40    39    41    42   1.88700 -1.0 2.0
   41    42    45    46   0.15000  1.0 3.0
   41    42    45    47  -2.17200  1.0 1.0
   41    42    45    47  -0.85700 -1.0 2.0
   41    42    45    49   0.71400  1.0 1.0
   41    42    45    49   0.04300 -1.0 2.0
   41    42    45    49   0.01450  1.0 3.0
   42    45    47    48   0.00000  1.0 1.0
   42    45    47    51   0.93250  1.0 1.0
   42    45    47    51   0.04450 -1.0 2.0
   42    45    47    51   0.17550  1.0 3.0
   42    45    49    50   0.00000  1.0 1.0
   42    45    49    53   0.25950  1.0 1.0
   42    45    49    53   0.43850 -1.0 2.0
   42    45    49    53   2.61650  1.0 3.0
   43    42    45    46   0.15000  1.0 3.0
   43    42    45    47  -0.03800  1.0 3.0
   43    42    45    49   0.23200  1.0 3.0
   44    42    45    46   0.15000  1.0 3.0
   44    42    45    47  -0.03800  1.0 3.0
   44    42    45    49   0.23200  1.0 3.0
   45    47    51    52   2.45000 -1.0 2.0
   45    47    51    55   1.15000  1.0 1.0
   45    47    51    55   3.04450 -1.0 2.0
   45    49    53    54   3.04450 -1.0 2.0
   45    49    53    58   1.15000  1.0 1.0
   45    49    53    58   3.04450 -1.0 2.0
   46    45    47    48   0.00000  1.0 1.0
   46    45    47    51   0.00000  1.0 1.0
   46    45    49    50   0.00000  1.0 1.0
   46    45    49    53   0.00000  1.0 1.0
   47    45    49    50   0.00000  1.0 1.0
   47    45    49    53  -0.29800  1.0 1.0
   47    45    49    53   0.13950 -1.0 2.0
   47    45    49    53  -2.45650  1.0 3.0
   47    51    55    56   0.00000  1.0 1.0
   47    51    55    57   0.00000  1.0 1.0
   47    51    55    61  -0.29800  1.0 1.0
   47    51    55    61   0.13950 -1.0 2.0
   47    51    55    61  -2.45650  1.0 3.0
   48    47    51    52   2.45000 -1.0 2.0
   48    47    51    55   3.04450 -1.0 2.0
   51    55    61    62   0.00000  1.0 1.0
   51    55    61    63   0.00000  1.0 1.0
   52    51    55    56   0.00000  1.0 1.0
   52    51    55    57   0.00000  1.0 1.0
   52    51    55    61   0.00000  1.0 1.0
   56    55    61    62   0.00000  1.0 1.0
   56    55    61    63   0.00000  1.0 1.0
   57    55    61    62   0.00000  1.0 1.0
   57    55    61    63   0.00000  1.0 1.0
   49    45    47    48   0.00000  1.0 1.0
   49    45    47    51   0.37150  1.0 1.0
   49    45    47    51   1.25400 -1.0 2.0
   49    45    47    51  -0.40250  1.0 3.0
   49    53    58    59   0.00000  1.0 1.0
   49    53    58    60   0.00000  1.0 1.0
   49    53    58    64   1.39750  1.0 1.0
   49    53    58    64  -0.07950 -1.0 2.0
   49    53    58    64  -0.18750  1.0 3.0
   50    49    53    54   2.45000 -1.0 2.0
   50    49    53    58   2.45000 -1.0 2.0
   53    58    64    65  -0.11250  1.0 3.0
   53    58    64    66  -0.11250  1.0 3.0
   53    58    64    67  -0.95700  1.0 1.0
   53    58    64    67  -0.18200 -1.0 2.0
   53    58    64    67   0.29450  1.0 3.0
   54    53    58    59   0.00000  1.0 1.0
   54    53    58    60   0.00000  1.0 1.0
   54    53    58    64   0.30150 -1.0 2.0
   58    64    67    68   0.15000  1.0 3.0
   58    64    67    69  -1.63150  1.0 1.0
   58    64    67    69  -0.43550 -1.0 2.0
   58    64    67    69   0.24500  1.0 3.0
   58    64    67    72   1.36600  1.0 1.0
   58    64    67    72  -0.11450 -1.0 2.0
   58    64    67    72   0.24250  1.0 3.0
   59    58    64    65   0.15000  1.0 3.0
   59    58    64    66   0.15000  1.0 3.0
   59    58    64    67   0.15000  1.0 3.0
   60    58    64    65   0.15000  1.0 3.0
   60    58    64    66   0.15000  1.0 3.0
   60    58    64    67   0.15000  1.0 3.0
   64    67    69    70   0.41150 -1.0 2.0
   64    67    69    71   0.41150 -1.0 2.0
   64    67    72    73   0.17350  1.0 3.0
   64    67    72    74   0.17350  1.0 3.0
   64    67    72    75   0.17350  1.0 3.0
   65    64    67    68   0.15000  1.0 3.0
   65    64    67    69  -0.11250  1.0 3.0
   65    64    67    72   0.19200  1.0 3.0
   66    64    67    68   0.15000  1.0 3.0
   66    64    67    69  -0.11250  1.0 3.0
   66    64    67    72   0.19200  1.0 3.0
   68    67    69    70   0.00000  1.0 1.0
   68    67    69    71   0.00000  1.0 1.0
   68    67    72    73   0.13050  1.0 3.0
   68    67    72    74   0.13050  1.0 3.0
   68    67    72    75   0.13050  1.0 3.0
   69    67    72    73   0.17350  1.0 3.0
   69    67    72    74   0.17350  1.0 3.0
   69    67    72    75   0.17350  1.0 3.0
   72    67    69    70   0.30150 -1.0 2.0
   72    67    69    71   0.30150 -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
   37    30    36    38  10.50000 -1.0 2.0
   33    41    39    40  10.50000 -1.0 2.0
   45    51    47    48  10.50000 -1.0 2.0
   52    47    51    55   1.00000 -1.0 2.0
   62    55    61    63  10.50000 -1.0 2.0
   50    53    49    45   1.00000 -1.0 2.0
   49    58    53    54  10.50000 -1.0 2.0
   70    67    69    71  10.50000 -1.0 2.0
END
