* LIGAND DATABASE FILE (OPLS2005)
*
001      72    72    130    182     370
    1     0 S   NP   _N1_     1    29.49472    96.09124   -17.61965
    2     1 S   H    _HN1     2     1.02956    86.94070    11.18789
    3     1 S   H    _H1_     3     1.02844    59.55480   123.09070
    4     1 S   H    _H2_     4     1.02787    62.05961  -101.38166
    5     1 S   CT   _CA1     5     1.50083   162.38939  -176.41941
    6     5 S   HC   _HA1     6     1.09565   105.32637     6.05867
    7     5 S   CO3  _C1_     7     1.53882   112.16822  -114.39390
    8     7 S   O2Z  _O11     8     1.26377   115.06150   -48.95591
    9     7 S   O2Z  _O12     9     1.26225   114.92343   130.25965
   10     5 S   CT   _CB1    10     1.53086   107.45943   124.09851
   11    10 S   HC   HB11    11     1.09819   109.71190   -49.18307
   12    10 S   HC   HB12    12     1.09830   110.26049    67.43470
   13    10 S   CT   _CG1    13     1.53026   112.54235  -170.21455
   14    13 S   HC   HG11    14     1.09527   110.35392   -55.91728
   15    13 S   HC   HG12    15     1.09611   110.17985    63.20776
   16    13 S   C    _CD1    16     1.51771   111.99147  -176.36423
   17    16 S   O    _OE1    17     1.22745   123.10571   -11.37203
   18    16 S   N    _N2_    18     1.38585   111.78624   168.73614
   19    18 S   H    _HN2    19     1.01594   119.15687     2.34560
   20    18 S   CT1  _CA2    20     1.46235   123.30339  -175.14223
   21    20 S   HC   _HA2    21     1.09728   109.30988   -10.97067
   22    20 S   C    _C2_    22     1.53367   108.74713  -126.83596
   23    22 S   O    _O2_    23     1.23015   122.20562  -147.80741
   24    20 S   CT   _CB2    32     1.53562   111.20196   110.69926
   25    24 S   HC   HB21    33     1.09368   109.61052    60.28800
   26    24 S   HC   HB22    34     1.09536   110.34010   177.97049
   27    22 S   N    _N3_    24     1.38510   113.42081    39.73246
   28    27 S   H    _HN3    25     1.01520   118.86139    -0.79402
   29    24 S   S    _SG2    35     1.83311   111.35102   -63.23649
   30    27 S   CT   _CA3    26     1.45446   123.50206   175.05149
   31    30 S   HC   HA31    27     1.09520   109.29368    23.25058
   32    30 S   HC   HA32    28     1.09497   107.10601   140.26056
   33    29 S   CT   _C9_    36     1.87689   101.74553   133.73889
   34    30 S   CO3  _C3_    29     1.52921   113.08748  -100.26928
   35    34 S   O2Z  _O31    30     1.26406   115.40033   -44.63892
   36    34 S   O2Z  _O32    31     1.26356   114.99487   136.31024
   37    33 S   S    _S19    37     1.87202   106.54664   -68.78175
   38    33 S   CM   _C4_    46     1.53536   111.71502    56.46444
   39    37 S   CT   _C7_    38     1.80820    98.42558  -109.68236
   40    39 S   HC   _H21    39     1.09515   108.44209   -94.35886
   41    39 S   HC   _H22    40     1.09326   109.87430   148.01940
   42    38 S   CMA  _C5_    47     1.36951   127.86119    55.70413
   43    42 S   OM   _O13    48     1.26920   125.38054    -1.76436
   44    38 S   CO4  _C6_    60     1.48936   116.86907  -125.92051
   45    44 S   O    _O14    61     1.22163   123.99098    94.10502
   46    39 S   CT   _C8_    41     1.50921   107.98861    26.48706
   47    46 S   HC   _H23    42     1.09503   112.13059    69.04268
   48    46 S   HC   _H24    43     1.09396   111.17752  -169.96548
   49    42 S   OS   _O16    49     1.42173   111.92930   179.12912
   50    44 S   OS   _O17    62     1.35927   108.33335   -84.91530
   51    33 S   SZ   _S20    44     1.88505   107.74301   176.41062
   52    51 S   OZ   _O15    45     1.50231   108.19698  -165.46164
   53    49 S   CT   _C14    50     1.43711   116.62034  -142.41239
   54    53 S   HC   _H37    51     1.09649   111.10462   -50.11178
   55    50 S   CT   _C15    63     1.44041   116.86999   176.85976
   56    55 S   HC   _H38    64     1.09680   110.04914   -36.94373
   57    53 S   CT   _C10    52     1.52706   110.80831    73.28988
   58    57 S   HC   _H25    53     1.09459   111.00008    54.47822
   59    57 S   HC   _H26    54     1.09448   111.12739   175.52280
   60    57 S   HC   _H27    55     1.09466   111.23268   -64.07202
   61    53 S   CT   _C11    56     1.52631   106.46303  -167.07058
   62    61 S   HC   _H28    57     1.09586   111.03485   -59.00283
   63    61 S   HC   _H29    58     1.09428   111.37356   179.65057
   64    61 S   HC   _H30    59     1.09550   110.32314    59.03661
   65    55 S   CT   _C12    65     1.52346   109.70063    84.52994
   66    65 S   HC   _H31    66     1.09502   110.99798    58.38883
   67    65 S   HC   _H32    67     1.09430   111.13150   179.29224
   68    65 S   HC   _H33    68     1.09482   110.93129   -60.02304
   69    55 S   CT   _C13    69     1.52285   107.10713  -154.88761
   70    69 S   HC   _H34    70     1.09571   111.04730   -58.78718
   71    69 S   HC   _H35    71     1.09415   111.35489   179.83929
   72    69 S   HC   _H36    72     1.09554   110.29448    59.18793
  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   9   5   4   3
  16   2   1   1  11  12   7   5   4  10   3   8   2   4   3   2
  10  10   1   1   9   8   9   8   7   3   2   1   3   2   1   1
   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    39    46    51    52    38    42    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    39    40    41    46    47    48    51    52    38    42    43    49    44    45    50  
   35    36  
   36  
    0  
   39    40    41    46    47    48    51    52    38    42    44  
   42    43    49    53    44    45    50    55    39    46    51    52  
   40    41    46    47    48    51    52  
   41    46    47    48    51  
   46    47    48    51  
   43    49    53    54    57    61    44    45    50    51  
   49    53    44  
   45    50    55    56    65    69    49    51  
   50    55  
   47    48    51    52  
   48    51    52  
   51    52  
   53    54    57    58    59    60    61    62    63    64  
   55    56    65    66    67    68    69    70    71    72  
   52  
    0  
   54    57    58    59    60    61    62    63    64  
   57    58    59    60    61    62    63    64  
   56    65    66    67    68    69    70    71    72  
   65    66    67    68    69    70    71    72  
   58    59    60    61    62    63    64  
   59    60    61  
   60    61  
   61  
   62    63    64  
   63    64  
   64  
    0  
   66    67    68    69    70    71    72  
   67    68    69  
   68    69  
   69  
   70    71    72  
   71    72  
   72  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.480000   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   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5000   0.0660   0.025000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   50   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   51   3.5600   0.3950   0.170000   2.0080   1.7800   0.025682759  -1.666211680
   52   2.7000   0.2800  -0.460000   1.5350   1.3500   0.001000000  -0.126889456
   53   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   222.000  1.810
   33    51   340.000  1.853
   33    38   317.000  1.510
   37    39   222.000  1.810
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    46   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    51   340.000  1.853
   51    52   700.000  1.530
   38    42   465.000  1.376
   38    44   320.000  1.462
   42    43   745.000  1.250
   42    49   440.000  1.360
   49    53   320.000  1.410
   53    54   340.000  1.090
   53    57   268.000  1.529
   53    61   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   44    45   570.000  1.229
   44    50   214.000  1.327
   50    55   320.000  1.410
   55    56   340.000  1.090
   55    65   268.000  1.529
   55    69   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   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  118.28000
   29    33    51    75.00000  118.00000
   29    33    38    75.00000  112.20000
   33    37    39    62.00000   98.90000
   33    51    46    62.00000   96.00000
   33    51    52    74.00000  107.00000
   33    38    42    70.00000  124.00000
   33    38    44    65.00000  116.34900
   37    39    40    35.00000  109.50000
   37    39    41    35.00000  109.50000
   37    39    46    75.00000  111.63000
   39    46    47    37.50000  110.70000
   39    46    48    37.50000  110.70000
   39    46    51    75.00000  107.60000
   41    39    40    33.00000  107.80000
   46    39    40    37.50000  110.70000
   46    39    41    37.50000  110.70000
   46    51    52    74.00000  107.00000
   48    46    47    33.00000  107.80000
   51    33    37    75.00000  118.00000
   51    46    47    35.00000  109.50000
   51    46    48    35.00000  109.50000
   38    33    37    75.00000  112.20000
   38    33    51    70.00000  113.14000
   38    42    43    65.00000  137.10300
   38    42    49    80.00000  120.01400
   38    44    45    80.00000  123.72100
   38    44    50    90.00000  111.29400
   42    49    53    90.00000  111.18400
   49    42    43    65.00000  121.00000
   49    53    54    35.00000  109.50000
   49    53    57    50.00000  109.50000
   49    53    61    50.00000  109.50000
   53    57    58    37.50000  110.70000
   53    57    59    37.50000  110.70000
   53    57    60    37.50000  110.70000
   53    61    62    37.50000  110.70000
   53    61    63    37.50000  110.70000
   53    61    64    37.50000  110.70000
   57    53    54    37.50000  110.70000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   61    53    54    37.50000  110.70000
   61    53    57    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   44    38    42    60.00000  125.92000
   44    50    55    83.00000  116.90000
   50    44    45    83.00000  123.40000
   50    55    56    35.00000  109.50000
   50    55    65    50.00000  109.50000
   50    55    69    50.00000  109.50000
   55    65    66    37.50000  110.70000
   55    65    67    37.50000  110.70000
   55    65    68    37.50000  110.70000
   55    69    70    37.50000  110.70000
   55    69    71    37.50000  110.70000
   55    69    72    37.50000  110.70000
   65    55    56    37.50000  110.70000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   69    55    56    37.50000  110.70000
   69    55    65    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
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   0.08500  1.0 1.0
   24    29    33    37  -0.53150 -1.0 2.0
   24    29    33    37   0.48050  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    39   0.08500  1.0 1.0
   29    33    37    39  -0.53150 -1.0 2.0
   29    33    37    39   0.48050  1.0 3.0
   29    33    51    46   0.00000  1.0 1.0
   29    33    51    52   0.00000  1.0 1.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    38    44   0.09700  1.0 1.0
   29    33    38    44   0.15600 -1.0 2.0
   29    33    38    44  -0.50800  1.0 3.0
   33    37    39    40   0.32350  1.0 3.0
   33    37    39    41   0.32350  1.0 3.0
   33    37   -39    46   0.01700  1.0 1.0
   33    37   -39    46  -0.23550 -1.0 2.0
   33    37   -39    46   0.21350  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    49   7.00000 -1.0 2.0
   33    38    44    45  -0.64400  1.0 1.0
   33    38    44    45   0.26850 -1.0 2.0
   33    38    44    50  -0.15000  1.0 1.0
   33    38    44    50   0.89550 -1.0 2.0
   33    38    44    50  -0.06900  1.0 3.0
   37    33   -51    46   0.00000  1.0 1.0
   37    33    51    52   0.00000  1.0 1.0
   37    33    38    42   0.42700  1.0 1.0
   37    33    38    42  -0.70350 -1.0 2.0
   37    33    38    42  -0.43150  1.0 3.0
   37    33    38    44   0.09700  1.0 1.0
   37    33    38    44   0.15600 -1.0 2.0
   37    33    38    44  -0.50800  1.0 3.0
   37    39    46    47   0.15000  1.0 3.0
   37    39    46    48   0.15000  1.0 3.0
   37    39   -46    51   0.56750  1.0 1.0
   37    39   -46    51  -0.07550 -1.0 2.0
   37    39   -46    51   0.20000  1.0 3.0
   39    46   -51    33   0.00000  1.0 1.0
   39    46    51    52   0.00000  1.0 1.0
   40    39    46    47   0.15000  1.0 3.0
   40    39    46    48   0.15000  1.0 3.0
   40    39    46    51   0.15000  1.0 3.0
   41    39    46    47   0.15000  1.0 3.0
   41    39    46    48   0.15000  1.0 3.0
   41    39    46    51   0.15000  1.0 3.0
   47    46    51    33   0.53150  1.0 3.0
   47    46    51    52  -0.07200  1.0 3.0
   48    46    51    33   0.53150  1.0 3.0
   48    46    51    52  -0.07200  1.0 3.0
   51    33   -37    39   0.01700  1.0 1.0
   51    33   -37    39  -0.23550 -1.0 2.0
   51    33   -37    39   0.21350  1.0 3.0
   51    33    38    42   0.09700  1.0 1.0
   51    33    38    42   0.15600 -1.0 2.0
   51    33    38    42  -0.50800  1.0 3.0
   51    33    38    44   0.09700  1.0 1.0
   51    33    38    44   0.15600 -1.0 2.0
   51    33    38    44  -0.50800  1.0 3.0
   38    33    37    39  -0.62250  1.0 1.0
   38    33    37    39  -0.38450 -1.0 2.0
   38    33    37    39   0.81900  1.0 3.0
   38    33    51    46   0.00000  1.0 1.0
   38    33    51    52   0.00000  1.0 1.0
   38    42    49    53  -2.26850  1.0 1.0
   38    42    49    53   3.39050 -1.0 2.0
   38    44    50    55   2.00000 -1.0 2.0
   42    38    44    45   1.00000 -1.0 2.0
   42    38    44    50  -0.56150  1.0 1.0
   42    38    44    50   2.19150 -1.0 2.0
   42    49    53    54   0.08050  1.0 3.0
   42    49    53    57  -0.46850  1.0 1.0
   42    49    53    57   0.09300 -1.0 2.0
   42    49    53    57  -0.12850  1.0 3.0
   42    49    53    61  -0.46850  1.0 1.0
   42    49    53    61   0.09300 -1.0 2.0
   42    49    53    61  -0.12850  1.0 3.0
   43    42    49    53   2.00000 -1.0 2.0
   49    53    57    58   0.23400  1.0 3.0
   49    53    57    59   0.23400  1.0 3.0
   49    53    57    60   0.23400  1.0 3.0
   49    53    61    62   0.23400  1.0 3.0
   49    53    61    63   0.23400  1.0 3.0
   49    53    61    64   0.23400  1.0 3.0
   54    53    57    58   0.15000  1.0 3.0
   54    53    57    59   0.15000  1.0 3.0
   54    53    57    60   0.15000  1.0 3.0
   54    53    61    62   0.15000  1.0 3.0
   54    53    61    63   0.15000  1.0 3.0
   54    53    61    64   0.15000  1.0 3.0
   57    53    61    62   0.15000  1.0 3.0
   57    53    61    63   0.15000  1.0 3.0
   57    53    61    64   0.15000  1.0 3.0
   61    53    57    58   0.15000  1.0 3.0
   61    53    57    59   0.15000  1.0 3.0
   61    53    57    60   0.15000  1.0 3.0
   44    38    42    43   7.00000 -1.0 2.0
   44    38    42    49   7.00000 -1.0 2.0
   44    50    55    56   0.08050  1.0 3.0
   44    50    55    65  -0.25900  1.0 1.0
   44    50    55    65  -0.47000 -1.0 2.0
   44    50    55    65   0.11750  1.0 3.0
   44    50    55    69  -0.25900  1.0 1.0
   44    50    55    69  -0.47000 -1.0 2.0
   44    50    55    69   0.11750  1.0 3.0
   45    44    50    55   3.00000 -1.0 2.0
   50    55    65    66   0.23400  1.0 3.0
   50    55    65    67   0.23400  1.0 3.0
   50    55    65    68   0.23400  1.0 3.0
   50    55    69    70   0.23400  1.0 3.0
   50    55    69    71   0.23400  1.0 3.0
   50    55    69    72   0.23400  1.0 3.0
   56    55    65    66   0.15000  1.0 3.0
   56    55    65    67   0.15000  1.0 3.0
   56    55    65    68   0.15000  1.0 3.0
   56    55    69    70   0.15000  1.0 3.0
   56    55    69    71   0.15000  1.0 3.0
   56    55    69    72   0.15000  1.0 3.0
   65    55    69    70   0.15000  1.0 3.0
   65    55    69    71   0.15000  1.0 3.0
   65    55    69    72   0.15000  1.0 3.0
   69    55    65    66   0.15000  1.0 3.0
   69    55    65    67   0.15000  1.0 3.0
   69    55    65    68   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
   33    44    38    42  15.00000 -1.0 2.0
   43    49    42    38  15.00000 -1.0 2.0
   38    50    44    45  10.50000 -1.0 2.0
END
