* LIGAND DATABASE FILE (OPLS2005)
*
001      73    74    137    210     393
    1     0 S   NP   _N1_     1    28.85150    95.44494   -19.63304
    2     1 S   H    _HN1     2     1.02974    98.81404    55.12978
    3     1 S   H    _H1_     3     1.02836    34.61994   162.45174
    4     1 S   H    _H2_     4     1.02779    79.25736   -51.94541
    5     1 S   CT   _CA1     5     1.50108   141.94416  -164.41655
    6     5 S   HC   _HA1     6     1.09578   105.28218    39.73548
    7     5 S   CO3  _C1_     7     1.53791   112.33334   -80.44128
    8     7 S   O2Z  _O11     8     1.26328   115.03442   -46.00683
    9     7 S   O2Z  _O12     9     1.26231   114.92924   133.29987
   10     5 S   CT   _CB1    10     1.53096   107.38408   157.51560
   11    10 S   HC   HB11    11     1.09810   109.26198   -52.37013
   12    10 S   HC   HB12    12     1.09830   110.42080    64.08136
   13    10 S   CT   _CG1    13     1.53006   112.70115  -173.67113
   14    13 S   HC   HG11    14     1.09572   110.16622   -60.99168
   15    13 S   HC   HG12    15     1.09615   110.30257    58.05452
   16    13 S   C    _CD1    16     1.51814   111.99761   177.97310
   17    16 S   O    _OE1    17     1.22736   123.00169   -20.96157
   18    16 S   N    _N2_    18     1.38513   111.84510   160.30080
   19    18 S   H    _HN2    19     1.01586   119.01767     0.40445
   20    18 S   CT1  _CA2    20     1.46272   123.60167  -178.33940
   21    20 S   HC   _HA2    21     1.09732   109.39435   -18.05986
   22    20 S   C    _C2_    22     1.53418   107.94621  -133.70848
   23    22 S   O    _O2_    23     1.22995   122.41160  -144.42323
   24    20 S   CT   _CB2    32     1.53498   111.16583   104.34242
   25    24 S   HC   HB21    33     1.09453   109.30242    51.95716
   26    24 S   HC   HB22    34     1.09486   110.56864   170.50562
   27    22 S   N    _N3_    24     1.38562   113.22828    42.87970
   28    27 S   H    _HN3    25     1.01533   118.90622    -0.46394
   29    24 S   S    _SG2    35     1.83048   111.46222   -70.55354
   30    27 S   CT   _CA3    26     1.45442   123.38267   175.13381
   31    30 S   HC   HA31    27     1.09528   109.15026    25.94598
   32    30 S   HC   HA32    28     1.09493   107.13929   142.94251
   33    29 S   CT   _C9_    36     1.85216   101.69174   152.87294
   34    30 S   CO3  _C3_    29     1.52934   113.19539   -97.46717
   35    34 S   O2Z  _O31    30     1.26397   115.44875   -43.34938
   36    34 S   O2Z  _O32    31     1.26362   114.95323   137.60043
   37    33 S   CT   _C8_    37     1.56393   112.07526    45.39341
   38    37 S   HC   _H11    38     1.09770   110.20754    32.99493
   39    37 S   HC   _H12    39     1.09563   113.90186   -87.08537
   40    33 S   S    _S1_    59     1.87857   108.62408   -73.73667
   41    37 S   C4T  _C7_    40     1.53638   106.92332   149.59297
   42    41 S   HC   _H4_    41     1.09692   112.32101  -130.18371
   43    40 S   CT   _C13    60     1.83257   102.12724   -58.71318
   44    43 S   HC   _H13    61     1.09404   106.84120   108.47102
   45    43 S   HC   _H14    62     1.09337   111.69550    -9.26830
   46    41 S   C4T  _C6_    42     1.55707   124.06583    85.65707
   47    46 S   HC   _H3_    43     1.09783   113.57655     9.61421
   48    41 S   N4   _N4_    46     1.47395   103.25840    -9.91050
   49    43 S   CT   _C14    63     1.52708   111.00322  -132.62508
   50    49 S   HC   _H15    64     1.09531   111.93714   -48.16883
   51    49 S   HC   _H16    65     1.09541   109.03336  -167.06175
   52    46 S   C4   _C11    44     1.54386    85.44783  -101.94630
   53    52 S   O    _O33    45     1.21047   135.45307   171.66805
   54    33 S   CT1  _C10    47     1.55871   114.02969   162.57257
   55    54 S   HC   _H5_    48     1.09423   111.97048    91.43057
   56    46 S   CT   _C5_    52     1.52319   117.58039   142.29219
   57    56 S   HC   _H9_    53     1.09624   110.89818    46.71690
   58    56 S   HC   _H10    54     1.09609   109.66042   164.90058
   59    49 S   N    _N5_    66     1.45277   112.14322    73.26283
   60    59 S   H    _H17    67     1.01657   117.95364   -85.60803
   61    54 S   CO3  _C12    49     1.54447   116.81031   -34.25281
   62    61 S   O2Z  _O35    50     1.26342   116.26617   -56.15845
   63    61 S   O2Z  _O34    51     1.26506   114.44244   124.49969
   64    56 S   CT   _C4_    55     1.51998   110.44744   -74.89320
   65    64 S   HC   _H6_    56     1.09495   110.97656   -58.92788
   66    64 S   HC   _H7_    57     1.09432   110.35673  -178.90443
   67    64 S   HC   _H8_    58     1.09466   111.20224    61.04671
   68    59 S   C    _C15    68     1.38358   122.58370    90.13059
   69    68 S   O    _O36    69     1.22839   125.35966     0.69492
   70    68 S   CT   _C16    70     1.50467   112.82770  -177.83228
   71    70 S   HC   _H18    71     1.09366   110.91971   -36.70836
   72    70 S   HC   _H19    72     1.09327   109.21858    83.99617
   73    70 S   HC   _H20    73     1.09354   109.46984  -156.28210
  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
  18   2   1   1  14   7   6  12  13   6   9   5   4  12   7   8
   7   4   3   8   2   4   3   6   5   4   7   3   2   1   1   3
   2   1   1   5   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    54    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41    48    54    55    61    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    42    46    52    48    54    55    61    62    63    40    43    44    45    49  
   35    36  
   36  
    0  
   38    39    41    42    46    47    52    48    54    55    61    56    40    43  
   39    41    42    46    48    54    40  
   41    42    46    48    54    40  
   43    44    45    49    50    51    59    41    48    54    55    61  
   42    46    47    52    53    48    54    55    61    56    57    58    64  
   46    47    52    48    54    56  
   44    45    49    50    51    59    60    68    54  
   45    49    50    51    59  
   49    50    51    59  
   47    52    53    48    54    56    57    58    64    65    66    67  
   52    53    48    56    57    58    64  
   54    55    61    62    63    56    52    53  
   50    51    59    60    68    69    70  
   51    59    60    68  
   59    60    68  
   53    54    55    61    56    57    58    64  
   54    56  
   55    61    62    63  
   61    62    63  
   57    58    64    65    66    67  
   58    64    65    66    67  
   64    65    66    67  
   60    68    69    70    71    72    73  
   68    69    70  
   62    63  
   63  
    0  
   65    66    67  
   66    67  
   67  
    0  
   69    70    71    72    73  
   70    71    72    73  
   71    72    73  
   72    73  
   73  
    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   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   41   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   43   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   49   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   54   3.5000   0.0660   0.040000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   3.5000   0.0660  -0.061200   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   60   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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
   73   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   268.000  1.529
   33    54   268.000  1.529
   33    40   222.000  1.810
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    41   260.000  1.519
   41    42   340.000  1.090
   41    46   268.000  1.529
   41    48   305.000  1.456
   46    47   340.000  1.090
   46    52   250.000  1.540
   46    56   260.000  1.519
   52    53   930.000  1.212
   52    48   440.000  1.369
   48    54   337.000  1.449
   54    55   340.000  1.090
   54    61   317.000  1.522
   61    62   656.000  1.250
   61    63   656.000  1.250
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   40    43   222.000  1.810
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    59   337.000  1.449
   59    60   434.000  1.010
   59    68   490.000  1.335
   68    69   570.000  1.229
   68    70   317.000  1.522
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    54    75.00000  108.68000
   29    33    40    75.00000  118.28000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    41    70.00000  112.98000
   33    54    48    80.00000  109.70000
   33    54    55    37.50000  110.70000
   33    54    61    63.00000  111.10000
   33    40    43    62.00000   98.90000
   37    41    42    45.00000  112.72800
   37    41    46    65.00000  119.52000
   37    41    48    80.00000  110.05700
   39    37    38    33.00000  107.80000
   41    37    38    45.00000  111.22300
   41    37    39    45.00000  111.22300
   41    46    47    37.50000  110.70000
   41    46    52   100.00000   86.36000
   41    46    56    65.00000  119.52000
   41    48    52   100.00000   93.00000
   41    48    54    50.00000  132.70000
   46    41    42    37.50000  110.70000
   46    52    53    60.00000  136.58000
   46    52    48    95.00000   92.72400
   46    56    57    45.00000  111.22300
   46    56    58    45.00000  111.22300
   46    56    64    70.00000  112.98000
   52    46    47    40.00000  113.37500
   52    48    54    50.00000  132.10000
   48    41    42    50.00000  112.01000
   48    41    46   105.00000   87.49700
   48    52    53    75.00000  131.60000
   48    54    55    35.00000  109.50000
   48    54    61    63.00000  110.10000
   54    33    37    58.35000  112.70000
   54    61    62    70.00000  117.00000
   54    61    63    70.00000  117.00000
   61    54    55    35.00000  109.50000
   63    61    62    80.00000  126.00000
   56    46    47    45.00000  112.72800
   56    46    52    63.00000  111.10000
   56    64    65    37.50000  110.70000
   56    64    66    37.50000  110.70000
   56    64    67    37.50000  110.70000
   58    56    57    33.00000  107.80000
   64    56    57    37.50000  110.70000
   64    56    58    37.50000  110.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   40    33    37    75.00000  111.63000
   40    33    54    75.00000  108.68000
   40    43    44    35.00000  109.50000
   40    43    45    35.00000  109.50000
   40    43    49    75.00000  111.63000
   43    49    50    37.50000  110.70000
   43    49    51    37.50000  110.70000
   43    49    59    70.00000  110.72300
   45    43    44    33.00000  107.80000
   49    43    44    37.50000  110.70000
   49    43    45    37.50000  110.70000
   49    59    60    38.00000  118.40000
   49    59    68    50.00000  121.90000
   51    49    50    33.00000  107.80000
   59    49    50    35.00000  109.50000
   59    49    51    35.00000  109.50000
   59    68    69    80.00000  122.90000
   59    68    70    70.00000  116.60000
   68    59    60    35.00000  119.80000
   68    70    71    35.00000  109.50000
   68    70    72    35.00000  109.50000
   68    70    73    35.00000  109.50000
   70    68    69    80.00000  120.40000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   0.21350  1.0 3.0
   24    29    33    40   0.08500  1.0 1.0
   24    29    33    40  -0.53150 -1.0 2.0
   24    29    33    40   0.48050  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    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    41   0.44750  1.0 1.0
   29    33    37    41  -0.17800 -1.0 2.0
   29    33    37    41   0.20200  1.0 3.0
   29    33    54    48   0.71400  1.0 1.0
   29    33    54    48   0.04300 -1.0 2.0
   29    33    54    48   0.01450  1.0 3.0
   29    33    54    55   0.15000  1.0 3.0
   29    33    54    61  -2.17200  1.0 1.0
   29    33    54    61  -0.85700 -1.0 2.0
   29    33    40    43   0.08500  1.0 1.0
   29    33    40    43  -0.53150 -1.0 2.0
   29    33    40    43   0.48050  1.0 3.0
   33    37    41    42   0.15000  1.0 3.0
   33    37    41    46   0.04050  1.0 1.0
   33    37    41    46   0.63700 -1.0 2.0
   33    37    41    46   0.17650  1.0 3.0
   33    37   -41    48   0.43900  1.0 1.0
   33    37   -41    48   0.49100 -1.0 2.0
   33    37   -41    48   0.28400  1.0 3.0
   33    54    61    62   0.00000  1.0 1.0
   33    54    61    63   0.00000  1.0 1.0
   33    40    43    44   0.32350  1.0 3.0
   33    40    43    45   0.32350  1.0 3.0
   33    40    43    49   0.01700  1.0 1.0
   33    40    43    49  -0.23550 -1.0 2.0
   33    40    43    49   0.21350  1.0 3.0
   37    33   -54    48   0.42250  1.0 1.0
   37    33   -54    48  -0.48100 -1.0 2.0
   37    33   -54    48   0.35650  1.0 3.0
   37    33    54    55   0.15000  1.0 3.0
   37    33    54    61  -0.84850  1.0 1.0
   37    33    54    61  -0.22800 -1.0 2.0
   37    33    54    61   0.29250  1.0 3.0
   37    33    40    43   0.01700  1.0 1.0
   37    33    40    43  -0.23550 -1.0 2.0
   37    33    40    43   0.21350  1.0 3.0
   37    41    46    47   0.15000  1.0 3.0
   37    41    46    52  -0.95700  1.0 1.0
   37    41    46    52  -0.18200 -1.0 2.0
   37    41    46    52   0.29450  1.0 3.0
   37    41    46    56   0.56750  1.0 1.0
   37    41    46    56  -0.07550 -1.0 2.0
   37    41    46    56   0.20000  1.0 3.0
   37    41   -48    52   0.00000  1.0 1.0
   37    41   -48    54   0.00000  1.0 1.0
   38    37    41    42   0.15000  1.0 3.0
   38    37    41    46   0.00000  1.0 1.0
   38    37    41    48   0.15000  1.0 3.0
   39    37    41    42   0.15000  1.0 3.0
   39    37    41    46   0.00000  1.0 1.0
   39    37    41    48   0.15000  1.0 3.0
   41    46    52    53  -0.11250  1.0 1.0
   41    46    52    53   0.11400 -1.0 2.0
   41    46    52    53  -0.28950  1.0 3.0
   41    46   -52    48   3.00000 -1.0 2.0
   41    46    56    57   0.00000  1.0 1.0
   41    46    56    58   0.00000  1.0 1.0
   41    46    56    64   0.04050  1.0 1.0
   41    46    56    64   0.63700 -1.0 2.0
   41    46    56    64   0.17650  1.0 3.0
   41    48   -54    33   0.00000  1.0 1.0
   41    48    54    55   0.00000  1.0 1.0
   41    48    54    61   0.00000  1.0 1.0
   42    41    46    47   0.15000  1.0 3.0
   42    41    46    52   0.15000  1.0 3.0
   42    41    46    56   0.15000  1.0 3.0
   42    41   -48    52   0.00000  1.0 1.0
   42    41    48    54   0.00000  1.0 1.0
   46    41   -48    52   0.00000  1.0 1.0
   46    41    48    54   0.00000  1.0 1.0
   46    52   -48    41   3.00000 -1.0 2.0
   46    52   -48    54   3.00000 -1.0 2.0
   46    56    64    65   0.15000  1.0 3.0
   46    56    64    66   0.15000  1.0 3.0
   46    56    64    67   0.15000  1.0 3.0
   47    46    52    53   0.00000  1.0 1.0
   47    46    52    48   0.00000  1.0 1.0
   47    46    56    57   0.15000  1.0 3.0
   47    46    56    58   0.15000  1.0 3.0
   47    46    56    64   0.15000  1.0 3.0
   52    46    56    57  -0.11250  1.0 3.0
   52    46    56    58  -0.11250  1.0 3.0
   52    46    56    64  -0.95700  1.0 1.0
   52    46    56    64  -0.18200 -1.0 2.0
   52    46    56    64   0.29450  1.0 3.0
   52    48    54    33   0.00000  1.0 1.0
   52    48    54    55   0.00000  1.0 1.0
   52    48    54    61   0.00000  1.0 1.0
   53    52   -48    41   3.00000 -1.0 2.0
   53    52    48    54   3.00000 -1.0 2.0
   48    41   -46    47   0.15000  1.0 3.0
   48    41   -46    52   3.00000 -1.0 2.0
   48    41    46    56   0.43900  1.0 1.0
   48    41    46    56   0.49100 -1.0 2.0
   48    41    46    56   0.28400  1.0 3.0
   48    54    61    62   0.00000  1.0 1.0
   48    54    61    63   0.00000  1.0 1.0
   54    33    37    38   0.15000  1.0 3.0
   54    33    37    39   0.15000  1.0 3.0
   54    33   -37    41   0.31550 -1.0 2.0
   54    33   -37    41   0.11250  1.0 3.0
   54    33    40    43   0.01700  1.0 1.0
   54    33    40    43  -0.23550 -1.0 2.0
   54    33    40    43   0.21350  1.0 3.0
   55    54    61    62   0.00000  1.0 1.0
   55    54    61    63   0.00000  1.0 1.0
   56    46    52    53   0.30150 -1.0 2.0
   56    46   -52    48   1.39750  1.0 1.0
   56    46   -52    48  -0.07950 -1.0 2.0
   56    46   -52    48  -0.18750  1.0 3.0
   57    56    64    65   0.15000  1.0 3.0
   57    56    64    66   0.15000  1.0 3.0
   57    56    64    67   0.15000  1.0 3.0
   58    56    64    65   0.15000  1.0 3.0
   58    56    64    66   0.15000  1.0 3.0
   58    56    64    67   0.15000  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    41   0.44750  1.0 1.0
   40    33    37    41  -0.17800 -1.0 2.0
   40    33    37    41   0.20200  1.0 3.0
   40    33    54    48   0.71400  1.0 1.0
   40    33    54    48   0.04300 -1.0 2.0
   40    33    54    48   0.01450  1.0 3.0
   40    33    54    55   0.15000  1.0 3.0
   40    33    54    61  -2.17200  1.0 1.0
   40    33    54    61  -0.85700 -1.0 2.0
   40    43    49    50   0.15000  1.0 3.0
   40    43    49    51   0.15000  1.0 3.0
   40    43    49    59   0.56750  1.0 1.0
   40    43    49    59  -0.07550 -1.0 2.0
   40    43    49    59   0.20000  1.0 3.0
   43    49    59    60   0.00000  1.0 1.0
   43    49    59    68  -0.43950  1.0 1.0
   43    49    59    68  -0.08100 -1.0 2.0
   43    49    59    68   0.03350  1.0 3.0
   44    43    49    50   0.15000  1.0 3.0
   44    43    49    51   0.15000  1.0 3.0
   44    43    49    59   0.15000  1.0 3.0
   45    43    49    50   0.15000  1.0 3.0
   45    43    49    51   0.15000  1.0 3.0
   45    43    49    59   0.15000  1.0 3.0
   49    59    68    69   3.04450 -1.0 2.0
   49    59    68    70   1.49850  1.0 1.0
   49    59    68    70   1.53950 -1.0 2.0
   50    49    59    60   0.00000  1.0 1.0
   50    49    59    68   0.00000  1.0 1.0
   51    49    59    60   0.00000  1.0 1.0
   51    49    59    68   0.00000  1.0 1.0
   59    68    70    71   0.00000  1.0 1.0
   59    68    70    72   0.00000  1.0 1.0
   59    68    70    73   0.00000  1.0 1.0
   60    59    68    69   2.45000 -1.0 2.0
   60    59    68    70   2.45000 -1.0 2.0
   69    68    70    71   0.00000  1.0 1.0
   69    68    70    72   0.00000  1.0 1.0
   69    68    70    73   0.00000  1.0 1.0
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
   46    48    52    53  10.50000 -1.0 2.0
   54    52    48    41   1.00000 -1.0 2.0
   62    54    61    63  10.50000 -1.0 2.0
   60    68    59    49   1.00000 -1.0 2.0
   59    70    68    69  10.50000 -1.0 2.0
END
