* LIGAND DATABASE FILE (OPLS2005)
*
001      72    73    135    203     392
    1     0 S   NP   _N1_     1    28.75662    93.59402   -20.56615
    2     1 S   H    _HN1     2     1.02951    95.56533    38.21201
    3     1 S   H    _H1_     3     1.02824    24.32711   157.80249
    4     1 S   H    _H2_     4     1.02763    92.31393   -70.56864
    5     1 S   CT   _CA1     5     1.50336   134.86646   164.13336
    6     5 S   HC   _HA1     6     1.09591   104.98794    56.75550
    7     5 S   CO3  _C1_     7     1.53921   112.66411   -62.40461
    8     7 S   O2Z  _O11     8     1.26366   115.07932   -28.10589
    9     7 S   O2Z  _O12     9     1.26268   115.04539   150.46163
   10     5 S   CT   _CB1    10     1.53067   107.07334   174.21053
   11    10 S   HC   HB11    11     1.09818   108.99434   -50.07935
   12    10 S   HC   HB12    12     1.09694   110.26306    66.14348
   13    10 S   CT   _CG1    13     1.52966   113.33218  -171.49934
   14    13 S   HC   HG11    14     1.09571   110.19509   -67.36384
   15    13 S   HC   HG12    15     1.09632   110.22559    51.98877
   16    13 S   C    _CD1    16     1.51881   112.28901   172.02499
   17    16 S   O    _OE1    17     1.22744   123.22086   -10.14108
   18    16 S   N    _N2_    18     1.38671   111.75581   170.61481
   19    18 S   H    _HN2    19     1.01588   118.98213     0.50822
   20    18 S   CT1  _CA2    20     1.46362   123.38142  -178.03238
   21    20 S   HC   _HA2    21     1.09743   109.23364   -17.06098
   22    20 S   C    _C2_    22     1.53384   108.34820  -132.76853
   23    22 S   O    _O2_    23     1.23010   122.27870  -146.16217
   24    20 S   CT   _CB2    32     1.53668   111.45834   105.00216
   25    24 S   HC   HB21    33     1.09391   109.13778    55.51654
   26    24 S   HC   HB22    34     1.09489   110.57557   174.54346
   27    22 S   N    _N3_    24     1.38523   113.31303    41.23371
   28    27 S   H    _HN3    25     1.01539   118.88118    -0.60198
   29    24 S   S    _SG2    35     1.82537   111.16419   -65.62590
   30    27 S   CT   _CA3    26     1.45443   123.43548   175.12191
   31    30 S   HC   HA31    27     1.09525   109.20501    24.92446
   32    30 S   HC   HA32    28     1.09495   107.12937   141.92208
   33    29 S   CT   _C6_    36     1.84174   101.33130   177.32372
   34    33 S   HC   _H4_    37     1.09674   106.73283    52.78616
   35    30 S   CO3  _C3_    29     1.52926   113.14056   -98.53194
   36    35 S   O2Z  _O31    30     1.26402   115.42052   -44.28845
   37    35 S   O2Z  _O32    31     1.26357   114.97438   136.65359
   38    33 S   CT   _C7_    38     1.52984   110.88681   -65.08680
   39    38 S   HC   _H10    39     1.09477   112.37870   -53.97662
   40    38 S   HC   _H11    40     1.09405   111.30728  -175.10455
   41    38 S   HC   _H12    41     1.09422   111.41033    67.01207
   42    33 S   CT   _C5_    42     1.55051   108.74646   168.58832
   43    42 S   HC   _H3_    43     1.09975   108.05712   -56.31393
   44    42 S   CO4  _C8_    44     1.52412   112.92063    63.11872
   45    44 S   O    _O33    45     1.22397   124.40971    68.68210
   46    42 S   CT   _C4_    69     1.53007   112.91431  -173.02416
   47    46 S   HC   _H7_    70     1.09456   112.27375   -68.48166
   48    46 S   HC   _H8_    71     1.09602   110.28834   172.50962
   49    46 S   HC   _H9_    72     1.09472   110.93908    53.02982
   50    44 S   OS   _O34    46     1.36521   109.85940  -111.00845
   51    50 S   CT   _C9_    47     1.44308   116.84080   174.77955
   52    51 S   HC   _H5_    48     1.09622   110.32389    33.72275
   53    51 S   CT   _C10    49     1.52292   108.20878   153.50674
   54    53 S   HC   _H13    50     1.09432   112.98785   -31.40526
   55    53 S   HC   _H14    51     1.09645   110.00047  -153.18180
   56    53 S   CT   _C11    52     1.51705   103.51721    89.45198
   57    56 S   HC   _H15    53     1.09521   112.78499   160.25801
   58    56 S   HC   _H16    54     1.09696   109.68624   -80.60638
   59    56 S   NT   _N4_    55     1.46453   105.43776    36.02501
   60    59 S   CT   _C15    56     1.47850   113.46930    86.04278
   61    60 S   HC   _H18    57     1.09457   109.23782   110.54964
   62    60 S   HC   _H19    58     1.09610   113.34521   -10.57717
   63    60 S   CM   _C14    59     1.48962   105.72652  -130.51501
   64    63 S   HC   _H17    60     1.08023   124.17960  -171.61810
   65    63 S   CM   _C13    61     1.33573   110.64137     8.54528
   66    51 S   CT   _C12    62     1.53856   109.12309   -92.80001
   67    66 S   HC   _H6_    63     1.09479   112.19184    11.57560
   68    65 S   CT   _C16    64     1.48653   127.20363  -179.08571
   69    68 S   HC   _H20    65     1.09480   111.34554     2.86362
   70    68 S   HC   _H21    66     1.09386   110.72109  -117.76604
   71    68 S   OH   _O35    67     1.42082   109.10961   122.58006
   72    71 S   HO   _H22    68     0.97219   106.97791  -173.94366
  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  10   5   4   3
  14   8   2   1   1   7   3   2   1   9   7  10   3   4   2   1
   1  10  14   8  10   6   5  10   4   3   9   8   5   4   8   3
   7   5   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    42    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    42    43    44    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    50    46    47    48    49  
   38    39    40    41    42    43    44    46  
   36    37  
   37  
    0  
   39    40    41    42    43    44    46  
   40    41    42  
   41    42  
   42  
   43    44    45    50    51    46    47    48    49  
   44    45    50    46    47    48    49  
   45    50    51    52    53    66    46    47    48    49  
   50    51    46  
   47    48    49    50  
   48    49  
   49  
    0  
   51    52    53    54    55    56    59    65    66    67  
   52    53    54    55    56    57    58    59    60    63    65    66    67    68  
   53    54    55    56    59    65    66    67  
   54    55    56    57    58    59    60    65    66    67  
   55    56    57    58    59    66  
   56    57    58    59    66  
   57    58    59    60    61    62    63    65    66    67  
   58    59    60    66  
   59    60    66  
   60    61    62    63    64    65    66    67    68  
   61    62    63    64    65    66    67    68  
   62    63    64    65    66  
   63    64    65    66  
   64    65    66    67    68    69    70    71  
   65    66    68  
   66    67    68    69    70    71    72  
   67    68    69    70    71  
   68  
   69    70    71    72  
   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   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  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   51   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   60   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   66   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660   0.145000   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   340.000  1.090
   33    38   268.000  1.529
   33    42   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   340.000  1.090
   42    43   340.000  1.090
   42    44   317.000  1.522
   42    46   268.000  1.529
   44    45   570.000  1.229
   44    50   214.000  1.327
   50    51   320.000  1.410
   51    52   340.000  1.090
   51    53   268.000  1.529
   51    66   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   382.000  1.448
   59    60   382.000  1.448
   59    66   382.000  1.448
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   317.000  1.510
   63    64   340.000  1.080
   63    65   549.000  1.340
   65    66   317.000  1.510
   65    68   317.000  1.510
   66    67   340.000  1.090
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   320.000  1.410
   71    72   553.000  0.945
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   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    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    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   33    42    43    37.50000  110.70000
   33    42    44    63.00000  111.10000
   33    42    46    58.35000  112.70000
   38    33    34    37.50000  110.70000
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    33.00000  107.80000
   42    33    34    37.50000  110.70000
   42    33    38    58.35000  112.70000
   42    44    45    80.00000  120.40000
   42    44    50    81.00000  111.40000
   42    46    47    37.50000  110.70000
   42    46    48    37.50000  110.70000
   42    46    49    37.50000  110.70000
   44    42    43    35.00000  109.50000
   44    50    51    83.00000  116.90000
   50    44    45    83.00000  123.40000
   50    51    52    35.00000  109.50000
   50    51    53    50.00000  109.50000
   50    51    66    50.00000  109.50000
   51    53    54    37.50000  110.70000
   51    53    55    37.50000  110.70000
   51    53    56    58.35000  112.70000
   51    66    59    56.20000  109.47000
   51    66    65    70.00000  112.02700
   51    66    67    37.50000  110.70000
   53    51    52    37.50000  110.70000
   53    56    57    37.50000  110.70000
   53    56    58    37.50000  110.70000
   53    56    59    56.20000  109.47000
   55    53    54    33.00000  107.80000
   56    53    54    37.50000  110.70000
   56    53    55    37.50000  110.70000
   56    59    60    51.80000  107.20000
   56    59    66    51.80000  107.20000
   58    56    57    33.00000  107.80000
   59    56    57    35.00000  109.50000
   59    56    58    35.00000  109.50000
   59    60    61    35.00000  109.50000
   59    60    62    35.00000  109.50000
   59    60    63    75.00000  110.70900
   59    66    65    75.00000  110.70900
   59    66    67    35.00000  109.50000
   60    63    64    35.00000  117.00000
   60    63    65    70.00000  124.00000
   62    60    61    33.00000  107.80000
   63    60    61    35.00000  109.50000
   63    60    62    35.00000  109.50000
   63    65    66    70.00000  124.00000
   63    65    68    70.00000  124.00000
   65    63    64    35.00000  120.00000
   65    66    67    35.00000  109.50000
   65    68    69    35.00000  109.50000
   65    68    70    35.00000  109.50000
   65    68    71    90.00000  110.39200
   66    51    52    37.50000  110.70000
   66    51    53    58.35000  112.70000
   66    59    60    51.80000  107.20000
   68    65    66    65.00000  117.92700
   68    71    72    55.00000  108.50000
   70    68    69    33.00000  107.80000
   71    68    69    35.00000  109.50000
   71    68    70    35.00000  109.50000
   46    42    43    37.50000  110.70000
   46    42    44    63.00000  111.10000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    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    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   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    42   0.01700  1.0 1.0
   24    29    33    42  -0.23550 -1.0 2.0
   24    29    33    42   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   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.15000  1.0 3.0
   29    33    42    43   0.15000  1.0 3.0
   29    33    42    44   0.56750  1.0 1.0
   29    33    42    44  -0.07550 -1.0 2.0
   29    33    42    44   0.20000  1.0 3.0
   29    33    42    46   0.44750  1.0 1.0
   29    33    42    46  -0.17800 -1.0 2.0
   29    33    42    46   0.20200  1.0 3.0
   33    42    44    45   0.30150 -1.0 2.0
   33    42    44    50   0.36750  1.0 3.0
   33    42    46    47   0.15000  1.0 3.0
   33    42    46    48   0.15000  1.0 3.0
   33    42    46    49   0.15000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    42    43   0.15000  1.0 3.0
   34    33    42    44  -0.11250  1.0 3.0
   34    33    42    46   0.15000  1.0 3.0
   38    33    42    43   0.15000  1.0 3.0
   38    33    42    44  -0.95700  1.0 1.0
   38    33    42    44  -0.18200 -1.0 2.0
   38    33    42    44   0.29450  1.0 3.0
   38    33    42    46   0.56750  1.0 1.0
   38    33    42    46  -0.07550 -1.0 2.0
   38    33    42    46   0.20000  1.0 3.0
   42    33    38    39   0.15000  1.0 3.0
   42    33    38    40   0.15000  1.0 3.0
   42    33    38    41   0.15000  1.0 3.0
   42    44    50    51   1.63150  1.0 1.0
   42    44    50    51   2.92000 -1.0 2.0
   43    42    44    45   0.00000  1.0 1.0
   43    42    44    50   0.00000  1.0 1.0
   43    42    46    47   0.15000  1.0 3.0
   43    42    46    48   0.15000  1.0 3.0
   43    42    46    49   0.15000  1.0 3.0
   44    42    46    47  -0.11250  1.0 3.0
   44    42    46    48  -0.11250  1.0 3.0
   44    42    46    49  -0.11250  1.0 3.0
   44    50    51    52   0.08050  1.0 3.0
   44    50    51    53  -0.25900  1.0 1.0
   44    50    51    53  -0.47000 -1.0 2.0
   44    50    51    53   0.11750  1.0 3.0
   44    50    51    66  -0.25900  1.0 1.0
   44    50    51    66  -0.47000 -1.0 2.0
   44    50    51    66   0.11750  1.0 3.0
   45    44    50    51   3.00000 -1.0 2.0
   50    51    53    54   0.23400  1.0 3.0
   50    51    53    55   0.23400  1.0 3.0
   50    51    53    56   0.62750  1.0 1.0
   50    51    53    56  -0.30950 -1.0 2.0
   50    51    53    56   0.27300  1.0 3.0
   50    51    66    59   1.74050  1.0 1.0
   50    51    66    65   0.61850  1.0 1.0
   50    51    66    65  -0.22750 -1.0 2.0
   50    51    66    65   0.15300  1.0 3.0
   50    51    66    67   0.23400  1.0 3.0
   51    53    56    57   0.15000  1.0 3.0
   51    53    56    58   0.15000  1.0 3.0
   51    53   -56    59   1.53400  1.0 1.0
   51    53   -56    59  -0.09950 -1.0 2.0
   51    53   -56    59   0.05700  1.0 3.0
   52    51    53    54   0.15000  1.0 3.0
   52    51    53    55   0.15000  1.0 3.0
   52    51    53    56   0.15000  1.0 3.0
   52    51    66    59   0.15000  1.0 3.0
   52    51    66    65   0.15000  1.0 3.0
   52    51    66    67   0.15000  1.0 3.0
   53    51   -66    59   1.53400  1.0 1.0
   53    51   -66    59  -0.09950 -1.0 2.0
   53    51   -66    59   0.05700  1.0 3.0
   53    51    66    65   0.34400  1.0 1.0
   53    51    66    65   0.09450 -1.0 2.0
   53    51    66    65   0.11100  1.0 3.0
   53    51    66    67   0.15000  1.0 3.0
   53    56    59    60   0.23450  1.0 1.0
   53    56    59    60   0.02050 -1.0 2.0
   53    56    59    60   0.25250  1.0 3.0
   53    56   -59    66   0.23450  1.0 1.0
   53    56   -59    66   0.02050 -1.0 2.0
   53    56   -59    66   0.25250  1.0 3.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   54    53    56    59   0.15000  1.0 3.0
   55    53    56    57   0.15000  1.0 3.0
   55    53    56    58   0.15000  1.0 3.0
   55    53    56    59   0.15000  1.0 3.0
   56    59    60    61   0.28000  1.0 3.0
   56    59    60    62   0.28000  1.0 3.0
   56    59    60    63  -0.60800  1.0 1.0
   56    59    60    63   1.10050 -1.0 2.0
   56    59    60    63   0.47000  1.0 3.0
   56    59   -66    51   0.23450  1.0 1.0
   56    59   -66    51   0.02050 -1.0 2.0
   56    59   -66    51   0.25250  1.0 3.0
   56    59    66    65  -0.60800  1.0 1.0
   56    59    66    65   1.10050 -1.0 2.0
   56    59    66    65   0.47000  1.0 3.0
   56    59    66    67   0.28000  1.0 3.0
   57    56    59    60   0.28000  1.0 3.0
   57    56    59    66   0.28000  1.0 3.0
   58    56    59    60   0.28000  1.0 3.0
   58    56    59    66   0.28000  1.0 3.0
   59    60    63    64   0.00000  1.0 1.0
   59    60   -63    65   0.90200  1.0 1.0
   59    60   -63    65   0.57900 -1.0 2.0
   59    60   -63    65  -0.62100  1.0 3.0
   60    59    66    51   0.23450  1.0 1.0
   60    59    66    51   0.02050 -1.0 2.0
   60    59    66    51   0.25250  1.0 3.0
   60    59   -66    65  -0.60800  1.0 1.0
   60    59   -66    65   1.10050 -1.0 2.0
   60    59   -66    65   0.47000  1.0 3.0
   60    59    66    67   0.28000  1.0 3.0
   60    63   -65    66   7.00000 -1.0 2.0
   60    63    65    68   7.00000 -1.0 2.0
   61    60    63    64   0.33100  1.0 3.0
   61    60    63    65   0.00000  1.0 1.0
   62    60    63    64   0.33100  1.0 3.0
   62    60    63    65   0.00000  1.0 1.0
   63    65    66    51   0.09850  1.0 1.0
   63    65    66    51   0.15250 -1.0 2.0
   63    65    66    51  -0.50650  1.0 3.0
   63    65   -66    59   0.90200  1.0 1.0
   63    65   -66    59   0.57900 -1.0 2.0
   63    65   -66    59  -0.62100  1.0 3.0
   63    65    66    67   0.00000  1.0 1.0
   63    65    68    69   0.00000  1.0 1.0
   63    65    68    70   0.00000  1.0 1.0
   63    65    68    71   0.67800  1.0 1.0
   63    65    68    71   0.47050 -1.0 2.0
   63    65    68    71  -0.62500  1.0 3.0
   64    63    65    66   7.00000 -1.0 2.0
   64    63    65    68   7.00000 -1.0 2.0
   65    68    71    72  -0.07800  1.0 1.0
   65    68    71    72  -0.21500 -1.0 2.0
   65    68    71    72  -0.03150  1.0 3.0
   66    51    53    54   0.15000  1.0 3.0
   66    51    53    55   0.15000  1.0 3.0
   66    51   -53    56   0.56750  1.0 1.0
   66    51   -53    56  -0.07550 -1.0 2.0
   66    51   -53    56   0.20000  1.0 3.0
   66    59    60    61   0.28000  1.0 3.0
   66    59    60    62   0.28000  1.0 3.0
   66    59   -60    63  -0.60800  1.0 1.0
   66    59   -60    63   1.10050 -1.0 2.0
   66    59   -60    63   0.47000  1.0 3.0
   66    65    68    69   0.34800  1.0 3.0
   66    65    68    70   0.34800  1.0 3.0
   66    65    68    71   0.18000  1.0 1.0
   66    65    68    71   0.16450 -1.0 2.0
   66    65    68    71   0.04450  1.0 3.0
   68    65    66    51   0.46850  1.0 1.0
   68    65    66    51   0.08550 -1.0 2.0
   68    65    66    51   0.09800  1.0 3.0
   68    65    66    59   0.52100  1.0 1.0
   68    65    66    59  -0.20350 -1.0 2.0
   68    65    66    59   0.29750  1.0 3.0
   68    65    66    67   0.34800  1.0 3.0
   69    68    71    72   0.19450  1.0 3.0
   70    68    71    72   0.19450  1.0 3.0
   46    42    44    45   0.30150 -1.0 2.0
   46    42    44    50   0.36750  1.0 3.0
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
   42    50    44    45  10.50000 -1.0 2.0
   60    64    63    65   1.10000 -1.0 2.0
   66    68    65    63   1.10000 -1.0 2.0
END
