* LIGAND DATABASE FILE (OPLS2005)
*
001      66    66    115    176     338
    1     0 S   NP   _N1_     1    28.27504    95.12198   -25.86968
    2     1 S   H    _HN1     2     1.02777   119.25706  -114.27939
    3     1 S   H    _H1_     3     1.02957    86.70747    -5.06674
    4     1 S   H    _H2_     4     1.02835    20.66756  -175.12147
    5     1 S   CT   _CA1     5     1.50153   116.36646   106.07756
    6     5 S   HC   _HA1     6     1.09576   105.18837    80.92691
    7     5 S   CO3  _C1_     7     1.53766   112.32412   -39.21894
    8     7 S   O2Z  _O11     8     1.26370   114.98474   -44.07988
    9     7 S   O2Z  _O12     9     1.26229   114.92472   134.86819
   10     5 S   CT   _CB1    10     1.53081   107.40305  -161.19483
   11    10 S   HC   HB11    11     1.09832   109.27542   -50.31242
   12    10 S   HC   HB12    12     1.09816   110.45425    66.22074
   13    10 S   CT   _CG1    13     1.53043   112.71685  -171.36253
   14    13 S   HC   HG11    14     1.09589   110.54067   -65.66699
   15    13 S   HC   HG12    15     1.09660   109.87742    53.55845
   16    13 S   C    _CD1    16     1.51856   112.21117   173.89562
   17    16 S   O    _OE1    17     1.22775   123.24619     3.24679
   18    16 S   N    _N2_    18     1.38557   111.82136  -176.67834
   19    18 S   H    _HN2    19     1.01564   119.15834     3.22361
   20    18 S   CT1  _CA2    20     1.45811   122.74294   177.72437
   21    20 S   HC   _HA2    21     1.09744   108.78567    27.36724
   22    20 S   C    _C2_    22     1.53000   107.12475   -89.57788
   23    22 S   O    _O2_    23     1.22974   123.12339   -26.32101
   24    20 S   CT   _CB2    32     1.53333   112.43497   150.55068
   25    24 S   HC   HB21    33     1.09510   109.73864    54.27415
   26    24 S   HC   HB22    34     1.09383   109.59149   172.74899
   27    22 S   N    _N3_    24     1.38525   112.51149   156.34098
   28    27 S   H    _HN3    25     1.01653   120.32019    -2.22985
   29    24 S   S    _SG2    35     1.83073   110.78187   -66.29633
   30    27 S   CT   _CA3    26     1.45344   122.51783   178.48819
   31    30 S   HC   HA31    27     1.09568   107.83443   -55.08024
   32    30 S   HC   HA32    28     1.09560   107.59309    61.26222
   33    29 S   CT   _C14    36     1.90326   101.87120  -168.68187
   34    33 S   Cl   Cl1_    37     1.81663   106.41999   -55.94639
   35    30 S   CO3  _C3_    29     1.52894   114.30975  -177.01220
   36    35 S   O2Z  _O31    30     1.26339   116.06619    -0.46646
   37    35 S   O2Z  _O32    31     1.26434   114.41294   179.50347
   38    33 S   CM   _C13    38     1.53399   106.96065    61.99626
   39    38 S   HC   _H10    39     1.09209   114.35327    24.22864
   40    33 S   CT   _C15    61     1.57498   113.68935  -175.48868
   41    40 S   OM   _O36    62     1.33043   110.86547   -55.72422
   42    40 S   HC   _H4_    63     1.10009   104.20145   176.51974
   43    38 S   CM   _C12    40     1.34197   132.13435  -159.29348
   44    43 S   HC   _H9_    41     1.08659   119.06851  -178.10535
   45    40 S   CO3  _C16    64     1.56403   117.83791    64.97346
   46    45 S   O2Z  _O35    65     1.26333   117.32804   -27.38881
   47    45 S   O2Z  _O34    66     1.27036   114.50980   150.69349
   48    43 S   CO4  _C11    42     1.48762   126.31608     0.16669
   49    48 S   O    _O33    43     1.22823   119.37657    85.36105
   50    48 S   CT   _C10    44     1.53785   116.67989   -99.66973
   51    50 S   HC   _H3_    45     1.10000   104.28824    47.06079
   52    50 S   CA   _C9_    46     1.52886   110.48123   -67.09290
   53    50 S   CT   _C17    57     1.55789   114.09831   162.22449
   54    53 S   Cl   Cl2_    58     1.79595   113.99830    65.73378
   55    53 S   Cl   Cl3_    59     1.80335   110.93607   -56.06625
   56    53 S   Cl   Cl4_    60     1.80871   110.61433  -173.46661
   57    52 S   CA   _C4_    47     1.40531   119.53216   129.42599
   58    57 S   HA   _H5_    48     1.08808   120.37818     0.09065
   59    57 S   CA   _C5_    49     1.39622   120.90100  -179.94405
   60    59 S   HA   _H6_    50     1.08668   119.37334  -179.85065
   61    59 S   CA   _C6_    51     1.39249   119.69630     0.20463
   62    61 S   Cl   Cl5_    52     1.72157   119.81381   180.00000
   63    61 S   CA   _C7_    53     1.39282   120.37605     0.14265
   64    63 S   HA   _H7_    54     1.08680   120.86767   179.71264
   65    52 S   CA   _C8_    55     1.40397   122.03671   -49.96517
   66    65 S   HA   _H8_    56     1.08726   120.79437     0.38917
  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
  12   7   2   1   1  10   4   6   4   3   7   3   2   1   1  10
   4  12   7  13   5   2   1   1   8   4   6   3   5   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    43    40    41    42    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    43    44    48    40    41    42    45    46    47  
   38    39    43    40    41    42    45  
   36    37  
   37  
    0  
   39    43    44    48    49    50    40    41    42    45  
   43    44    48    40  
   41    42    45    46    47    43  
   42    45    46    47  
   45    46    47  
   44    48    49    50    51    52    53  
   48    49    50  
   46    47  
   47  
    0  
   49    50    51    52    57    65    53    54    55    56  
   50    51    52    53  
   51    52    57    58    59    63    65    66    53    54    55    56  
   52    57    65    53    54    55    56  
   57    58    59    60    61    63    64    65    66    53    54    55    56  
   54    55    56    57    65  
   55    56  
   56  
    0  
   58    59    60    61    62    63    65    66  
   59    60    61    65  
   60    61    62    63    64    65  
   61    62    63  
   62    63    64    65    66  
   63    64    65  
   64    65    66  
   65    66  
   66  
    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  -0.175000   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   0.207500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   42   2.5000   0.0500   0.060000   1.3810   1.2100   0.008598240   0.268726247
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   48   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   50   3.5000   0.0660   0.313400   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.5000   0.0660  -0.294400   1.9750   1.7500   0.005000000  -0.741685710
   54   3.4000   0.3000   0.012000   2.1950   1.9500   0.001000000   0.320982824
   55   3.4000   0.3000   0.012000   2.1950   1.9500   0.001000000   0.320982824
   56   3.4000   0.3000   0.012000   2.1950   1.9500   0.001000000   0.320982824
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   62   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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   245.000  1.781
   33    38   317.000  1.510
   33    40   268.000  1.529
   38    39   340.000  1.080
   38    43   549.000  1.340
   43    44   340.000  1.080
   43    48   320.000  1.462
   48    49   570.000  1.229
   48    50   317.000  1.522
   50    51   340.000  1.090
   50    52   317.000  1.510
   50    53   268.000  1.529
   52    57   469.000  1.400
   52    65   469.000  1.400
   57    58   367.000  1.080
   57    59   469.000  1.400
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   300.000  1.725
   61    63   469.000  1.400
   63    64   367.000  1.080
   63    65   469.000  1.400
   65    66   367.000  1.080
   53    54   245.000  1.781
   53    55   245.000  1.781
   53    56   245.000  1.781
   40    41   570.000  1.307
   40    42   340.000  1.090
   40    45   317.000  1.522
   45    46   656.000  1.250
   45    47   656.000  1.250
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    85.00000  110.65400
   29    33    38    75.00000  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    43    70.00000  124.00000
   33    40    41    50.00000  109.50000
   33    40    42    37.50000  110.70000
   33    40    45    70.00000  109.69300
   38    33    34    75.00000  111.90500
   38    43    44    35.00000  120.00000
   38    43    48    65.00000  118.96000
   43    38    39    35.00000  120.00000
   43    48    49    80.00000  123.72100
   43    48    50    65.00000  118.62400
   48    43    44    40.00000  117.72500
   48    50    51    35.00000  109.50000
   48    50    52    70.00000  110.93000
   48    50    53    63.00000  111.10000
   50    48    49    80.00000  120.40000
   50    52    57    70.00000  120.00000
   50    52    65    70.00000  120.00000
   50    53    54    69.00000  109.80000
   50    53    55    69.00000  109.80000
   50    53    56    69.00000  109.80000
   52    50    51    35.00000  109.50000
   52    57    58    35.00000  120.00000
   52    57    59    63.00000  120.00000
   52    65    63    63.00000  120.00000
   52    65    66    35.00000  120.00000
   57    59    60    35.00000  120.00000
   57    59    61    63.00000  120.00000
   59    57    58    35.00000  120.00000
   59    61    62    75.00000  120.00000
   59    61    63    63.00000  120.00000
   61    59    60    35.00000  120.00000
   61    63    64    35.00000  120.00000
   61    63    65    63.00000  120.00000
   63    61    62    75.00000  120.00000
   63    65    66    35.00000  120.00000
   65    52    57    63.00000  120.00000
   65    63    64    35.00000  120.00000
   53    50    51    37.50000  110.70000
   53    50    52    70.00000  112.17500
   55    53    54    80.00000  110.42200
   56    53    54    80.00000  110.42200
   56    53    55    80.00000  110.42200
   40    33    34    69.00000  109.80000
   40    33    38    70.00000  112.02700
   40    45    46    70.00000  117.00000
   40    45    47    70.00000  117.00000
   42    40    41    45.00000  125.66300
   45    40    41    85.00000  109.63000
   45    40    42    35.00000  109.50000
   47    45    46    80.00000  126.00000
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   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
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    38    39   0.00000  1.0 1.0
   29    33    38    43   0.42700  1.0 1.0
   29    33    38    43  -0.70350 -1.0 2.0
   29    33    38    43  -0.43150  1.0 3.0
   29    33    40    41   0.56750  1.0 1.0
   29    33    40    41  -0.07550 -1.0 2.0
   29    33    40    41   0.20000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    45   0.56750  1.0 1.0
   29    33    40    45  -0.07550 -1.0 2.0
   29    33    40    45   0.20000  1.0 3.0
   33    38    43    44   7.00000 -1.0 2.0
   33    38    43    48   7.00000 -1.0 2.0
   33    40    45    46   0.41150 -1.0 2.0
   33    40    45    47   0.41150 -1.0 2.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    43   0.09700  1.0 1.0
   34    33    38    43   0.15600 -1.0 2.0
   34    33    38    43  -0.50800  1.0 3.0
   34    33    40    41   0.56750  1.0 1.0
   34    33    40    41  -0.07550 -1.0 2.0
   34    33    40    41   0.20000  1.0 3.0
   34    33    40    42   0.27000  1.0 3.0
   34    33    40    45   0.56750  1.0 1.0
   34    33    40    45  -0.07550 -1.0 2.0
   34    33    40    45   0.20000  1.0 3.0
   38    33    40    41   0.61850  1.0 1.0
   38    33    40    41  -0.22750 -1.0 2.0
   38    33    40    41   0.15300  1.0 3.0
   38    33    40    42   0.15000  1.0 3.0
   38    33    40    45  -0.98800  1.0 1.0
   38    33    40    45   0.48800 -1.0 2.0
   38    33    40    45   0.76800  1.0 3.0
   38    43    48    49   1.00000 -1.0 2.0
   38    43    48    50  -0.33500  1.0 1.0
   38    43    48    50   1.06600 -1.0 2.0
   38    43    48    50  -0.14000  1.0 3.0
   39    38    43    44   7.00000 -1.0 2.0
   39    38    43    48   7.00000 -1.0 2.0
   43    48    50    51   0.00000  1.0 1.0
   43    48    50    52   0.65300  1.0 1.0
   43    48    50    52  -0.03850 -1.0 2.0
   43    48    50    52   0.33900  1.0 3.0
   43    48    50    53   0.65300  1.0 1.0
   43    48    50    53  -0.03850 -1.0 2.0
   43    48    50    53   0.33900  1.0 3.0
   44    43    48    49   0.00000  1.0 1.0
   44    43    48    50   0.04550  1.0 1.0
   44    43    48    50   0.83000 -1.0 2.0
   44    43    48    50  -0.04000  1.0 3.0
   48    50    52    57   0.04300 -1.0 2.0
   48    50    52    65   0.04300 -1.0 2.0
   48    50    53    54   0.56750  1.0 1.0
   48    50    53    54  -0.07550 -1.0 2.0
   48    50    53    54   0.20000  1.0 3.0
   48    50    53    55   0.56750  1.0 1.0
   48    50    53    55  -0.07550 -1.0 2.0
   48    50    53    55   0.20000  1.0 3.0
   48    50    53    56   0.56750  1.0 1.0
   48    50    53    56  -0.07550 -1.0 2.0
   48    50    53    56   0.20000  1.0 3.0
   49    48    50    51   0.00000  1.0 1.0
   49    48    50    52   0.30150 -1.0 2.0
   49    48    50    53   0.30150 -1.0 2.0
   50    52    57    58   3.62500 -1.0 2.0
   50    52    57    59   3.62500 -1.0 2.0
   50    52    65    63   3.62500 -1.0 2.0
   50    52    65    66   3.62500 -1.0 2.0
   51    50    52    57   0.00000  1.0 1.0
   51    50    52    65   0.00000  1.0 1.0
   51    50    53    54   0.27000  1.0 3.0
   51    50    53    55   0.27000  1.0 3.0
   51    50    53    56   0.27000  1.0 3.0
   52    50    53    54   0.56750  1.0 1.0
   52    50    53    54  -0.07550 -1.0 2.0
   52    50    53    54   0.20000  1.0 3.0
   52    50    53    55   0.56750  1.0 1.0
   52    50    53    55  -0.07550 -1.0 2.0
   52    50    53    55   0.20000  1.0 3.0
   52    50    53    56   0.56750  1.0 1.0
   52    50    53    56  -0.07550 -1.0 2.0
   52    50    53    56   0.20000  1.0 3.0
   52    57    59    60   3.62500 -1.0 2.0
   52    57    59    61   3.62500 -1.0 2.0
   57    52    65    63   3.62500 -1.0 2.0
   57    52    65    66   3.62500 -1.0 2.0
   57    59    61    62   3.62500 -1.0 2.0
   57    59   -61    63   3.62500 -1.0 2.0
   58    57    59    60   3.62500 -1.0 2.0
   58    57    59    61   3.62500 -1.0 2.0
   59    61    63    64   3.62500 -1.0 2.0
   59    61    63    65   3.62500 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    63   3.62500 -1.0 2.0
   61    63   -65    52   3.62500 -1.0 2.0
   61    63    65    66   3.62500 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    65   3.62500 -1.0 2.0
   64    63    65    52   3.62500 -1.0 2.0
   64    63    65    66   3.62500 -1.0 2.0
   65    52    57    58   3.62500 -1.0 2.0
   65    52   -57    59   3.62500 -1.0 2.0
   53    50    52    57   0.04150 -1.0 2.0
   53    50    52    65   0.04150 -1.0 2.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    43   0.09850  1.0 1.0
   40    33    38    43   0.15250 -1.0 2.0
   40    33    38    43  -0.50650  1.0 3.0
   41    40    45    46   0.30150 -1.0 2.0
   41    40    45    47   0.30150 -1.0 2.0
   42    40    45    46   0.00000  1.0 1.0
   42    40    45    47   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
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    43  15.00000 -1.0 2.0
   48    44    43    38  15.00000 -1.0 2.0
   43    50    48    49  10.50000 -1.0 2.0
   57    65    52    50   4.00000 -1.0 2.0
   59    58    57    52   1.10000 -1.0 2.0
   61    60    59    57   1.10000 -1.0 2.0
   63    62    61    59   4.00000 -1.0 2.0
   65    64    63    61   1.10000 -1.0 2.0
   63    66    65    52   1.10000 -1.0 2.0
   46    40    45    47  10.50000 -1.0 2.0
END
