* LIGAND DATABASE FILE (OPLS2005)
*
001      71    72    127    189     365
    1     0 S   NP   _N1_     1    28.68070    95.03970   -21.73868
    2     1 S   H    _HN1     2     1.02942    85.76611     9.30987
    3     1 S   H    _H1_     3     1.02824    30.82750   143.85184
    4     1 S   H    _H2_     4     1.02769    94.89180   -98.83223
    5     1 S   CT   _CA1     5     1.50153   140.62072   126.69255
    6     5 S   HC   _HA1     6     1.09570   105.21696    68.74587
    7     5 S   CO3  _C1_     7     1.53916   112.08215   -51.54950
    8     7 S   O2Z  _O11     8     1.26421   114.94192   -46.05253
    9     7 S   O2Z  _O12     9     1.26192   115.04681   132.55666
   10     5 S   CT   _CB1    10     1.53109   107.38002  -173.14196
   11    10 S   HC   HB11    11     1.09821   109.78758   -46.61176
   12    10 S   HC   HB12    12     1.09800   110.44984    70.24498
   13    10 S   CT   _CG1    13     1.52859   112.20350  -167.36888
   14    13 S   HC   HG11    14     1.09421   110.47580   -59.23314
   15    13 S   HC   HG12    15     1.09592   109.63767    59.65764
   16    13 S   C    _CD1    16     1.51822   112.52410   179.90109
   17    16 S   O    _OE1    17     1.22739   123.28510    -0.98318
   18    16 S   N    _N2_    18     1.38509   111.57621   179.43977
   19    18 S   H    _HN2    19     1.01921   118.72429     1.50024
   20    18 S   CT1  _CA2    20     1.46098   123.84496   178.32135
   21    20 S   HC   _HA2    21     1.09713   109.35337    -7.02356
   22    20 S   C    _C2_    22     1.53645   108.77442  -122.71959
   23    22 S   O    _O2_    23     1.23092   121.97933  -152.27154
   24    20 S   CT   _CB2    32     1.53408   111.38623   115.23273
   25    24 S   HC   HB21    33     1.09619   109.54672    53.89137
   26    24 S   HC   HB22    34     1.09498   110.79586   172.83916
   27    22 S   N    _N3_    24     1.38435   113.84522    35.27896
   28    27 S   H    _HN3    25     1.01504   118.92296    -2.50335
   29    24 S   S    _SG2    35     1.82744   112.10496   -67.26035
   30    27 S   CT   _CA3    26     1.45375   123.39644   175.65630
   31    30 S   HC   HA31    27     1.09541   108.92497    29.81920
   32    30 S   HC   HA32    28     1.09494   107.16839   146.69217
   33    29 S   CT   _C15    36     1.82148    98.73737   167.24638
   34    33 S   HC   _H14    37     1.09459   109.47800   -42.88847
   35    33 S   HC   _H15    38     1.09507   107.92344    73.81104
   36    30 S   CO3  _C3_    29     1.52911   113.37695   -93.54218
   37    36 S   O2Z  _O31    30     1.26395   115.55388   -43.67174
   38    36 S   O2Z  _O32    31     1.26396   114.93853   137.32256
   39    33 S   CT   _C14    39     1.53232   112.93080  -165.42293
   40    39 S   HC   _H12    40     1.09720   109.75537   -62.15443
   41    39 S   HC   _H13    41     1.09782   107.50627  -177.14350
   42    39 S   CT   _C13    42     1.53359   115.77115    61.51767
   43    42 S   HC   _H10    43     1.09585   109.66650   174.11071
   44    42 S   HC   _H11    44     1.09499   110.43673   -67.92572
   45    42 S   N    _N6_    45     1.44452   112.97351    53.97424
   46    45 S   C    _C12    46     1.38918   127.50736  -104.24793
   47    46 S   O    _O35    47     1.21953   126.86899    -4.37058
   48    46 S   N    _N5_    48     1.39429   102.59110   175.03312
   49    48 S   CA   _C8_    49     1.41174   130.10858  -175.69288
   50    48 S   NN   _N8_    70     1.37170   108.91140     1.00911
   51    49 S   CA   _C7_    50     1.40553   121.03848     2.61434
   52    51 S   HA   _H8_    51     1.08745   119.75523    -2.49607
   53    45 S   NN   _N7_    71     1.36300   122.45918    70.95766
   54    51 S   CA   _C6_    52     1.41571   123.07504   176.82571
   55    54 S   CA   _C11    53     1.40740   116.87326     3.41455
   56    55 S   Cl   Cl1_    54     1.73483   121.62336   177.92614
   57    54 S   NM   _N4_    59     1.35651   121.18566  -179.33589
   58    55 S   CA   _C10    55     1.39634   121.17575    -2.53652
   59    58 S   HA   _H9_    56     1.08666   120.94023  -179.35320
   60    57 S   SY   _S1_    60     1.59952   120.36456    63.29647
   61    60 S   OY   _O33    61     1.46094   117.03899   -25.25741
   62    60 S   OY   _O34    62     1.46084   114.16059  -163.81894
   63    49 S   CA   _C9_    57     1.39848   121.63289  -178.51115
   64    63 S   F    F1__    58     1.34190   121.13089     1.51801
   65    60 S   CT   _C5_    63     1.79470   100.06524    86.00107
   66    65 S   HC   _H6_    64     1.09444   108.05901   -60.95262
   67    65 S   HC   _H7_    65     1.09477   107.84337    57.02123
   68    65 S   CT   _C4_    66     1.51831   112.10400   178.20180
   69    68 S   HC   _H3_    67     1.09442   111.32423   -59.78046
   70    68 S   HC   _H4_    68     1.09448   111.18927    60.48811
   71    68 S   HC   _H5_    69     1.09430   110.22119  -179.71538
  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   7   5   4   3
   9   5   4   2   1   1   8   5   4   8   4   3   6   7   4   9
  11   3   9   4   1  10   7   4   8   3   2   9   5   4   1   1
   6   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    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    42  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    45  
   35    39    40    41    42  
   39    40    41    42  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    53  
   41    42    43    44    45  
   42    43    44    45  
   43    44    45    46    47    48    50    53  
   44    45    46    53  
   45    46    53  
   46    47    48    49    50    53  
   47    48    49    51    63    50    53  
   48    49    50    53  
   49    51    52    54    58    63    64    50    53  
   51    52    54    55    58    59    63    64    57    50    53  
   53    51    63  
   52    54    55    56    58    63    64    57    60  
   54    55    63    57  
    0  
   55    56    58    59    63    57    60    61    62    65  
   56    58    59    63    64    57    60  
   58    59    63    57  
   60    61    62    65    66    67    68    58  
   59    63    64  
   63    64  
   61    62    65    66    67    68    69    70    71  
   62    65    66    67    68  
   65    66    67    68  
   64  
    0  
   66    67    68    69    70    71  
   67    68    69    70    71  
   68    69    70    71  
   69    70    71  
   70    71  
   71  
    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   3.5000   0.0660  -0.120000   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   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   45   3.2500   0.1700  -0.245000   1.8100   1.6000   0.054801302  -1.445846770
   46   3.7500   0.1050   0.861300   1.9250   1.7000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.616300   1.5250   1.4250   0.001000000  -1.480495490
   48   3.2500   0.1700  -0.207500   1.8100   1.6000   0.054801302  -1.445846770
   49   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.2500   0.1700   0.000000   1.8375   1.6250   0.005000000   0.000000000
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.2500   0.1700   0.000000   1.8375   1.6250   0.005000000   0.000000000
   54   3.5500   0.0700  -0.542400   2.0020   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   57   3.4200   0.1700  -0.252300   1.9310   1.7100   0.005000000   0.000000000
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.2500   1.494700   2.0020   1.7750   0.025682759  -1.666211680
   61   2.9600   0.1700  -0.784100   1.6780   1.4800   0.001000000  -0.126889456
   62   2.9600   0.1700  -0.784100   1.6780   1.4800   0.001000000  -0.126889456
   63   3.5500   0.0700   0.220000   2.5000   1.7750   0.001000000  -0.843144165
   64   2.8500   0.0610  -0.220000   2.4980   2.2250   0.001000000   0.985400000
   65   3.5000   0.0660  -0.633200   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.195000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.195000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.068600   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
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   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   268.000  1.529
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   337.000  1.449
   45    46   490.000  1.335
   45    53   255.000  1.385
   46    47   570.000  1.229
   46    48   490.000  1.335
   48    49   360.000  1.404
   48    50   255.000  1.385
   49    51   469.000  1.400
   49    63   469.000  1.400
   51    52   367.000  1.080
   51    54   469.000  1.400
   54    55   469.000  1.400
   54    57   515.000  1.335
   55    56   300.000  1.725
   55    58   469.000  1.400
   58    59   367.000  1.080
   58    63   469.000  1.400
   63    64   420.000  1.354
   57    60   350.000  1.613
   60    61   735.000  1.471
   60    62   735.000  1.471
   60    65   205.000  1.840
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   50    53   555.000  1.240
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  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    42    43    37.50000  110.70000
   39    42    44    37.50000  110.70000
   39    42    45    70.00000  110.72300
   41    39    40    33.00000  107.80000
   42    39    40    37.50000  110.70000
   42    39    41    37.50000  110.70000
   42    45    46    50.00000  121.90000
   42    45    53    85.00000  117.02000
   44    42    43    33.00000  107.80000
   45    42    43    35.00000  109.50000
   45    42    44    35.00000  109.50000
   45    46    47    80.00000  122.90000
   45    46    48    90.00000  111.91700
   45    53    50    90.00000  115.96000
   46    48    49    65.00000  121.96500
   46    48    50    80.00000  116.89000
   48    46    47    80.00000  122.90000
   48    49    51    70.00000  119.01900
   48    49    63    70.00000  119.01900
   48    50    53    90.00000  115.96000
   49    51    52    35.00000  120.00000
   49    51    54    63.00000  120.00000
   49    63    58    63.00000  120.00000
   49    63    64    80.00000  120.00000
   51    54    55    63.00000  120.00000
   51    54    57    65.00000  124.38400
   54    51    52    35.00000  120.00000
   54    55    56    75.00000  120.00000
   54    55    58    63.00000  120.00000
   54    57    60    75.00000  122.36500
   55    58    59    35.00000  120.00000
   55    58    63    63.00000  120.00000
   58    55    56    75.00000  120.00000
   58    63    64    80.00000  120.00000
   63    49    51    63.00000  120.00000
   63    58    59    35.00000  120.00000
   57    54    55    65.00000  124.38400
   57    60    61   105.00000  114.79700
   57    60    62   105.00000  114.79700
   57    60    65   100.00000  102.99600
   60    65    66    45.00000  108.39800
   60    65    67    45.00000  108.39800
   60    65    68    75.00000  110.51500
   62    60    61   115.00000  120.17200
   65    60    61   100.00000  108.55000
   65    60    62   100.00000  108.55000
   65    68    69    37.50000  110.70000
   65    68    70    37.50000  110.70000
   65    68    71    37.50000  110.70000
   67    65    66    33.00000  107.80000
   68    65    66    37.50000  110.70000
   68    65    67    37.50000  110.70000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   50    48    49    75.00000  123.91000
   53    45    46    80.00000  116.89000
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   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.44750  1.0 1.0
   29    33    39    42  -0.17800 -1.0 2.0
   29    33    39    42   0.20200  1.0 3.0
   33    39    42    43   0.15000  1.0 3.0
   33    39    42    44   0.15000  1.0 3.0
   33    39    42    45   0.43900  1.0 1.0
   33    39    42    45   0.49100 -1.0 2.0
   33    39    42    45   0.28400  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    42   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    42   0.15000  1.0 3.0
   39    42    45    46  -0.43950  1.0 1.0
   39    42    45    46  -0.08100 -1.0 2.0
   39    42    45    46   0.03350  1.0 3.0
   39    42    45    53   0.17850 -1.0 2.0
   40    39    42    43   0.15000  1.0 3.0
   40    39    42    44   0.15000  1.0 3.0
   40    39    42    45   0.15000  1.0 3.0
   41    39    42    43   0.15000  1.0 3.0
   41    39    42    44   0.15000  1.0 3.0
   41    39    42    45   0.15000  1.0 3.0
   42    45    46    47   3.04450 -1.0 2.0
   42    45    46    48   4.56800  1.0 1.0
   42    45    46    48   0.31650 -1.0 2.0
   42    45    53    50   2.00000 -1.0 2.0
   43    42    45    46   0.00000  1.0 1.0
   43    42    45    53   0.00000  1.0 1.0
   44    42    45    46   0.00000  1.0 1.0
   44    42    45    53   0.00000  1.0 1.0
   45    46    48    49   0.54900  1.0 1.0
   45    46    48    49   1.90750 -1.0 2.0
   45    46   -48    50   0.63000  1.0 1.0
   45    46   -48    50   1.73150 -1.0 2.0
   46    45   -53    50   2.00000 -1.0 2.0
   46    48    49    51   1.00100  1.0 1.0
   46    48    49    51   0.85050 -1.0 2.0
   46    48    49    63   1.00100  1.0 1.0
   46    48    49    63   0.85050 -1.0 2.0
   46    48   -50    53   2.00000 -1.0 2.0
   47    46    48    49   0.04000 -1.0 2.0
   47    46    48    50  -0.75150  1.0 1.0
   47    46    48    50   0.83450 -1.0 2.0
   48    49    51    52   3.62500 -1.0 2.0
   48    49    51    54   3.62500 -1.0 2.0
   48    49    63    58   3.62500 -1.0 2.0
   48    49    63    64   3.62500 -1.0 2.0
   48    50   -53    45   5.00000 -1.0 2.0
   49    48    50    53   2.00000 -1.0 2.0
   49    51    54    55   3.62500 -1.0 2.0
   49    51    54    57   3.62500 -1.0 2.0
   51    49    63    58   3.62500 -1.0 2.0
   51    49    63    64   3.62500 -1.0 2.0
   51    54    55    56   3.62500 -1.0 2.0
   51    54   -55    58   3.62500 -1.0 2.0
   51    54    57    60   1.50000 -1.0 2.0
   52    51    54    55   3.62500 -1.0 2.0
   52    51    54    57   3.62500 -1.0 2.0
   54    55    58    59   3.62500 -1.0 2.0
   54    55    58    63   3.62500 -1.0 2.0
   54    57    60    61  -0.23550  1.0 1.0
   54    57    60    61   0.77000 -1.0 2.0
   54    57    60    61   0.47650  1.0 3.0
   54    57    60    62  -0.23550  1.0 1.0
   54    57    60    62   0.77000 -1.0 2.0
   54    57    60    62   0.47650  1.0 3.0
   54    57    60    65   0.34100  1.0 1.0
   54    57    60    65  -0.43950 -1.0 2.0
   54    57    60    65   0.17850  1.0 3.0
   55    54    57    60   1.50000 -1.0 2.0
   55    58   -63    49   3.62500 -1.0 2.0
   55    58    63    64   3.62500 -1.0 2.0
   56    55    58    59   3.62500 -1.0 2.0
   56    55    58    63   3.62500 -1.0 2.0
   59    58    63    49   3.62500 -1.0 2.0
   59    58    63    64   3.62500 -1.0 2.0
   63    49    51    52   3.62500 -1.0 2.0
   63    49   -51    54   3.62500 -1.0 2.0
   57    54    55    56   3.62500 -1.0 2.0
   57    54    55    58   3.62500 -1.0 2.0
   57    60    65    66  -0.06500  1.0 3.0
   57    60    65    67  -0.06500  1.0 3.0
   57    60    65    68   0.86900  1.0 1.0
   57    60    65    68   0.26850 -1.0 2.0
   60    65    68    69   0.15000  1.0 3.0
   60    65    68    70   0.15000  1.0 3.0
   60    65    68    71   0.15000  1.0 3.0
   61    60    65    66   0.26000  1.0 3.0
   61    60    65    67   0.26000  1.0 3.0
   61    60    65    68  -0.82900  1.0 1.0
   61    60    65    68   0.81700 -1.0 2.0
   61    60    65    68  -0.10400  1.0 3.0
   62    60    65    66   0.26000  1.0 3.0
   62    60    65    67   0.26000  1.0 3.0
   62    60    65    68  -0.82900  1.0 1.0
   62    60    65    68   0.81700 -1.0 2.0
   62    60    65    68  -0.10400  1.0 3.0
   66    65    68    69   0.15000  1.0 3.0
   66    65    68    70   0.15000  1.0 3.0
   66    65    68    71   0.15000  1.0 3.0
   67    65    68    69   0.15000  1.0 3.0
   67    65    68    70   0.15000  1.0 3.0
   67    65    68    71   0.15000  1.0 3.0
   50    48    49    51   0.96250 -1.0 2.0
   50    48    49    63   0.96250 -1.0 2.0
   53    45    46    47  -0.75150  1.0 1.0
   53    45    46    47   0.83450 -1.0 2.0
   53    45   -46    48   0.63000  1.0 1.0
   53    45   -46    48   1.73150 -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
   53    46    45    42   1.00000 -1.0 2.0
   45    48    46    47  10.50000 -1.0 2.0
   50    46    48    49   1.00000 -1.0 2.0
   51    63    49    48   4.00000 -1.0 2.0
   54    52    51    49   1.10000 -1.0 2.0
   55    57    54    51   4.00000 -1.0 2.0
   58    56    55    54   4.00000 -1.0 2.0
   63    59    58    55   1.10000 -1.0 2.0
   58    64    63    49   4.00000 -1.0 2.0
END
