* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    136    222     409
    1     0 S   NP   _N1_     1    29.03037    93.89104   -23.12119
    2     1 S   H    _HN1     2     1.02778   103.37538   -86.12648
    3     1 S   H    _H1_     3     1.02960    86.71179    21.94327
    4     1 S   H    _H2_     4     1.02835    24.09033   169.87931
    5     1 S   CT   _CA1     5     1.50118   131.79842   136.58099
    6     5 S   HC   _HA1     6     1.09577   105.22520    72.99363
    7     5 S   CO3  _C1_     7     1.53776   112.38782   -47.19568
    8     7 S   O2Z  _O11     8     1.26357   114.99847   -43.99232
    9     7 S   O2Z  _O12     9     1.26240   114.91537   135.17192
   10     5 S   CT   _CB1    10     1.53096   107.43147  -169.12152
   11    10 S   HC   HB11    11     1.09826   109.29253   -50.98978
   12    10 S   HC   HB12    12     1.09820   110.44120    65.54682
   13    10 S   CT   _CG1    13     1.53019   112.68491  -172.10009
   14    13 S   HC   HG11    14     1.09595   110.44807   -64.41043
   15    13 S   HC   HG12    15     1.09654   109.97921    54.82395
   16    13 S   C    _CD1    16     1.51806   112.30072   175.13252
   17    16 S   O    _OE1    17     1.22737   123.24999    -1.66824
   18    16 S   N    _N2_    18     1.38670   111.67452   178.60156
   19    18 S   H    _HN2    19     1.01588   119.04135     1.41858
   20    18 S   CT1  _CA2    20     1.46069   123.35133   179.48376
   21    20 S   HC   _HA2    21     1.09595   109.30067    -3.29717
   22    20 S   C    _C2_    22     1.53493   108.89917  -118.40478
   23    22 S   O    _O2_    23     1.23043   122.05885  -147.53844
   24    20 S   CT   _CB2    32     1.53377   111.73334   119.01784
   25    24 S   HC   HB21    33     1.09652   109.68876    61.83271
   26    24 S   HC   HB22    34     1.09575   110.82243   179.17386
   27    22 S   N    _N3_    24     1.38455   113.58874    40.10967
   28    27 S   H    _HN3    25     1.01487   118.99823    -0.81829
   29    24 S   S    _SG2    35     1.82906   114.81117   -58.20582
   30    27 S   CT   _CA3    26     1.45449   123.42891   174.47572
   31    30 S   HC   HA31    27     1.09524   109.19490    25.31631
   32    30 S   HC   HA32    28     1.09491   107.13373   142.37090
   33    29 S   CT   _C18    36     1.82623    99.83861   -64.10233
   34    33 S   HC   _H3_    37     1.09458   108.33619   -49.14040
   35    33 S   HC   _H4_    38     1.09159   107.27536    68.27101
   36    30 S   CO3  _C3_    29     1.52954   113.15927   -98.08686
   37    36 S   O2Z  _O31    30     1.26402   115.47129   -41.83713
   38    36 S   O2Z  _O32    31     1.26362   114.93119   139.06673
   39    33 S   CT   _C13    39     1.52908   111.04890  -171.58534
   40    39 S   HC   _H32    40     1.09634   111.87759   -45.92608
   41    39 S   CO4  _C6_    41     1.52243   111.80551    77.61757
   42    41 S   O    _O17    42     1.22125   125.87274   -76.90528
   43    41 S   OS   _O19    43     1.37687   110.20534   103.10426
   44    43 S   CT   _C15    44     1.42969   108.37390    -8.01570
   45    44 S   HC   _H34    45     1.09777   106.94319   -86.53508
   46    44 S   CT   _C12    46     1.54012   114.54425   150.86953
   47    46 S   HC   _H31    47     1.09976   107.02466   -52.87496
   48    39 S   CT   _C14    61     1.52601   115.10671  -170.63137
   49    48 S   HC   _H33    62     1.10334   105.20847   163.02142
   50    46 S   CM   _C4_    48     1.50885   110.00488    64.78334
   51    50 S   CO4  _C5_    49     1.48208   121.28844    92.73113
   52    51 S   O    _O16    50     1.22704   122.48739  -173.54989
   53    50 S   CM   _C7_    70     1.34378   121.67077   -90.11012
   54    53 S   HC   _H22    71     1.08584   120.83632     1.55972
   55    53 S   HC   _H23    72     1.08526   122.77142  -178.58736
   56    51 S   OS   _O18    51     1.35416   116.81525     7.85600
   57    56 S   CT   _C11    52     1.44301   124.55167    -9.24246
   58    57 S   HC   _H29    53     1.09452   106.66040   -90.77226
   59    57 S   HC   _H30    54     1.09705   106.51513   156.53562
   60    46 S   CT   _C17    55     1.56063   110.98201  -171.76381
   61    60 S   CT   _C10    56     1.56075   111.41442    47.84812
   62    61 S   HC   _H27    57     1.09913   110.54330  -170.45579
   63    61 S   HC   _H28    58     1.10044   109.41226    74.69477
   64    60 S   CM   _C9_    65     1.53269   115.01054   168.43472
   65    64 S   HC   _H26    66     1.09069   115.36526   170.89286
   66    61 S   CT   _C16    59     1.53821   114.86683   -47.03179
   67    66 S   HC   _H35    60     1.09476   110.30239   -69.87053
   68    64 S   CM   _C8_    67     1.33906   128.49454   -10.30217
   69    68 S   HC   _H24    68     1.08562   119.94020  -179.49294
   70    68 S   HC   _H25    69     1.08253   123.11789     0.01978
   71    66 S   OH   _O20    63     1.42208   109.55554   171.50789
   72    71 S   HO   _H38    64     0.97263   107.59225    62.88159
  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
  11   5   4   2   1   1  13   7   8   3   9  15   7  21   8  10
   4  10   9   3   4   1   1   6  10   4   3  11   9   5   4   5
   3   3   2   2   1   1   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    48  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    66    48    49  
   35    39    40    41    48  
   39    40    41    48  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    61    66    67    48    49    71  
   41    42    43    44    66    48    49  
   42    43    44    45    46    66    48    49  
   43    44    48  
   44    45    46    47    50    60    66    48    49  
   45    46    47    50    51    57    60    61    66    67    48    49    71    64    53  
   46    47    50    60    66    48    49  
   47    50    51    52    56    57    58    59    60    61    62    63    66    48    49    64    65    68    53    54    55  
   50    51    57    60    61    48    64    53  
   49    71    72    50    60    61    62    63    66    67  
   71    61    66    67  
   51    52    56    57    60    61    64    53    54    55  
   52    56    57    58    59    60    53    54    55  
   56    57    53  
   54    55    56    60  
   55  
    0  
   57    58    59    60    61    64  
   58    59    60    61    62    63    66    64    65    68  
   59    60    61    64  
   60    61    64  
   61    62    63    66    67    71    64    65    68    69    70  
   62    63    66    67    71    72    64    65    68  
   63    66    67    71    64  
   66    67    71    64  
   65    68    69    70    66  
   68    69    70  
   67    71    72  
   71    72  
   69    70  
   70  
    0  
   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   0.047500   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   44   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   57   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   59   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   60   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   69   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   70   2.4200   0.0300   0.115000   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    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   317.000  1.522
   39    48   268.000  1.529
   41    42   570.000  1.229
   41    43   214.000  1.327
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    48   268.000  1.529
   46    47   340.000  1.090
   46    50   317.000  1.510
   46    60   268.000  1.529
   50    51   320.000  1.462
   50    53   549.000  1.340
   51    52   570.000  1.229
   51    56   214.000  1.327
   56    57   320.000  1.410
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   268.000  1.529
   60    61   268.000  1.529
   60    64   317.000  1.510
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    66   268.000  1.529
   66    67   340.000  1.090
   66    48   268.000  1.529
   66    71   320.000  1.410
   48    49   340.000  1.090
   71    72   553.000  0.945
   64    65   340.000  1.080
   64    68   549.000  1.340
   68    69   340.000  1.080
   68    70   340.000  1.080
   53    54   340.000  1.080
   53    55   340.000  1.080
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    63.00000  111.10000
   33    39    48    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    41    42    80.00000  120.40000
   39    41    43    81.00000  111.40000
   39    48    44    58.35000  112.70000
   39    48    66    58.35000  112.70000
   39    48    49    37.50000  110.70000
   41    39    40    35.00000  109.50000
   41    43    44    83.00000  116.90000
   43    41    42    83.00000  123.40000
   43    44    45    35.00000  109.50000
   43    44    46    50.00000  109.50000
   43    44    48    50.00000  109.50000
   44    46    47    37.50000  110.70000
   44    46    50    70.00000  112.02700
   44    46    60    58.35000  112.70000
   44    48    66    58.35000  112.70000
   44    48    49    37.50000  110.70000
   46    44    45    37.50000  110.70000
   46    50    51    65.00000  116.34900
   46    50    53    70.00000  124.00000
   46    60    57    58.35000  112.70000
   46    60    61    58.35000  112.70000
   46    60    64    70.00000  112.02700
   50    46    47    35.00000  109.50000
   50    51    52    80.00000  123.72100
   50    51    56    90.00000  111.29400
   50    53    54    35.00000  120.00000
   50    53    55    35.00000  120.00000
   51    56    57    83.00000  116.90000
   56    51    52    83.00000  123.40000
   56    57    58    35.00000  109.50000
   56    57    59    35.00000  109.50000
   56    57    60    50.00000  109.50000
   57    60    61    58.35000  112.70000
   57    60    64    70.00000  112.02700
   59    57    58    33.00000  107.80000
   60    46    47    37.50000  110.70000
   60    46    50    70.00000  112.02700
   60    57    58    37.50000  110.70000
   60    57    59    37.50000  110.70000
   60    61    62    37.50000  110.70000
   60    61    63    37.50000  110.70000
   60    61    66    58.35000  112.70000
   60    64    65    35.00000  117.00000
   60    64    68    70.00000  124.00000
   61    66    67    37.50000  110.70000
   61    66    48    58.35000  112.70000
   61    66    71    50.00000  109.50000
   63    61    62    33.00000  107.80000
   66    61    62    37.50000  110.70000
   66    61    63    37.50000  110.70000
   66    48    49    37.50000  110.70000
   66    71    72    55.00000  108.50000
   48    39    40    37.50000  110.70000
   48    39    41    63.00000  111.10000
   48    44    45    37.50000  110.70000
   48    44    46    58.35000  112.70000
   48    66    67    37.50000  110.70000
   71    66    67    35.00000  109.50000
   71    66    48    50.00000  109.50000
   64    60    61    70.00000  112.02700
   64    68    69    35.00000  120.00000
   64    68    70    35.00000  120.00000
   68    64    65    35.00000  120.00000
   70    68    69    35.00000  117.00000
   53    50    51    65.00000  118.96000
   55    53    54    35.00000  117.00000
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    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   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    48   0.44750  1.0 1.0
   29    33    39    48  -0.17800 -1.0 2.0
   29    33    39    48   0.20200  1.0 3.0
   33    39    41    42   0.30150 -1.0 2.0
   33    39    41    43   0.36750  1.0 3.0
   33    39    48    44   0.56750  1.0 1.0
   33    39    48    44  -0.07550 -1.0 2.0
   33    39    48    44   0.20000  1.0 3.0
   33    39    48    66   0.56750  1.0 1.0
   33    39    48    66  -0.07550 -1.0 2.0
   33    39    48    66   0.20000  1.0 3.0
   33    39    48    49   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    48   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    48   0.15000  1.0 3.0
   39    41   -43    44   1.63150  1.0 1.0
   39    41   -43    44   2.92000 -1.0 2.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    48    44   0.15000  1.0 3.0
   40    39    48    66   0.15000  1.0 3.0
   40    39    48    49   0.15000  1.0 3.0
   41    39   -48    44  -0.95700  1.0 1.0
   41    39   -48    44  -0.18200 -1.0 2.0
   41    39   -48    44   0.29450  1.0 3.0
   41    39    48    66  -0.95700  1.0 1.0
   41    39    48    66  -0.18200 -1.0 2.0
   41    39    48    66   0.29450  1.0 3.0
   41    39    48    49  -0.11250  1.0 3.0
   41    43    44    45   0.08050  1.0 3.0
   41    43    44    46  -0.25900  1.0 1.0
   41    43    44    46  -0.47000 -1.0 2.0
   41    43    44    46   0.11750  1.0 3.0
   41    43   -44    48  -0.25900  1.0 1.0
   41    43   -44    48  -0.47000 -1.0 2.0
   41    43   -44    48   0.11750  1.0 3.0
   42    41    43    44   3.00000 -1.0 2.0
   43    44    46    47   0.23400  1.0 3.0
   43    44    46    50   0.61850  1.0 1.0
   43    44    46    50  -0.22750 -1.0 2.0
   43    44    46    50   0.15300  1.0 3.0
   43    44    46    60   0.62750  1.0 1.0
   43    44    46    60  -0.30950 -1.0 2.0
   43    44    46    60   0.27300  1.0 3.0
   43    44   -48    39   0.62750  1.0 1.0
   43    44   -48    39  -0.30950 -1.0 2.0
   43    44   -48    39   0.27300  1.0 3.0
   43    44    48    66   0.62750  1.0 1.0
   43    44    48    66  -0.30950 -1.0 2.0
   43    44    48    66   0.27300  1.0 3.0
   43    44    48    49   0.23400  1.0 3.0
   44    46    50    51   0.09700  1.0 1.0
   44    46    50    51   0.15600 -1.0 2.0
   44    46    50    51  -0.50800  1.0 3.0
   44    46    50    53   0.09850  1.0 1.0
   44    46    50    53   0.15250 -1.0 2.0
   44    46    50    53  -0.50650  1.0 3.0
   44    46    60    57   0.56750  1.0 1.0
   44    46    60    57  -0.07550 -1.0 2.0
   44    46    60    57   0.20000  1.0 3.0
   44    46    60    61   0.56750  1.0 1.0
   44    46    60    61  -0.07550 -1.0 2.0
   44    46    60    61   0.20000  1.0 3.0
   44    46    60    64   0.34400  1.0 1.0
   44    46    60    64   0.09450 -1.0 2.0
   44    46    60    64   0.11100  1.0 3.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    50   0.15000  1.0 3.0
   45    44    46    60   0.15000  1.0 3.0
   45    44    48    39   0.15000  1.0 3.0
   45    44    48    66   0.15000  1.0 3.0
   45    44    48    49   0.15000  1.0 3.0
   46    44    48    39   0.56750  1.0 1.0
   46    44    48    39  -0.07550 -1.0 2.0
   46    44    48    39   0.20000  1.0 3.0
   46    44    48    66   0.56750  1.0 1.0
   46    44    48    66  -0.07550 -1.0 2.0
   46    44    48    66   0.20000  1.0 3.0
   46    44    48    49   0.15000  1.0 3.0
   46    50    51    52  -0.64400  1.0 1.0
   46    50    51    52   0.26850 -1.0 2.0
   46    50    51    56  -0.15000  1.0 1.0
   46    50    51    56   0.89550 -1.0 2.0
   46    50    51    56  -0.06900  1.0 3.0
   46    50    53    54   7.00000 -1.0 2.0
   46    50    53    55   7.00000 -1.0 2.0
   46    60    61    62   0.15000  1.0 3.0
   46    60    61    63   0.15000  1.0 3.0
   46    60   -61    66   0.56750  1.0 1.0
   46    60   -61    66  -0.07550 -1.0 2.0
   46    60   -61    66   0.20000  1.0 3.0
   46    60    64    65   0.00000  1.0 1.0
   46    60    64    68   0.09850  1.0 1.0
   46    60    64    68   0.15250 -1.0 2.0
   46    60    64    68  -0.50650  1.0 3.0
   47    46    50    51   0.15000  1.0 3.0
   47    46    50    53   0.00000  1.0 1.0
   47    46    60    57   0.15000  1.0 3.0
   47    46    60    61   0.15000  1.0 3.0
   47    46    60    64   0.15000  1.0 3.0
   50    46    60    57   0.34400  1.0 1.0
   50    46    60    57   0.09450 -1.0 2.0
   50    46    60    57   0.11100  1.0 3.0
   50    46    60    61   0.34400  1.0 1.0
   50    46    60    61   0.09450 -1.0 2.0
   50    46    60    61   0.11100  1.0 3.0
   50    46    60    64   0.31000  1.0 1.0
   50    46    60    64   0.14700 -1.0 2.0
   50    46    60    64   0.07550  1.0 3.0
   50    51   -56    57   2.00000 -1.0 2.0
   51    50    53    54   7.00000 -1.0 2.0
   51    50    53    55   7.00000 -1.0 2.0
   51    56    57    58   0.08050  1.0 3.0
   51    56    57    59   0.08050  1.0 3.0
   51    56    57    60  -0.25900  1.0 1.0
   51    56    57    60  -0.47000 -1.0 2.0
   51    56    57    60   0.11750  1.0 3.0
   52    51    56    57   3.00000 -1.0 2.0
   56    57   -60    46   0.62750  1.0 1.0
   56    57   -60    46  -0.30950 -1.0 2.0
   56    57   -60    46   0.27300  1.0 3.0
   56    57    60    61   0.62750  1.0 1.0
   56    57    60    61  -0.30950 -1.0 2.0
   56    57    60    61   0.27300  1.0 3.0
   56    57    60    64   0.61850  1.0 1.0
   56    57    60    64  -0.22750 -1.0 2.0
   56    57    60    64   0.15300  1.0 3.0
   57    60    61    62   0.15000  1.0 3.0
   57    60    61    63   0.15000  1.0 3.0
   57    60    61    66   0.56750  1.0 1.0
   57    60    61    66  -0.07550 -1.0 2.0
   57    60    61    66   0.20000  1.0 3.0
   57    60    64    65   0.00000  1.0 1.0
   57    60    64    68   0.09850  1.0 1.0
   57    60    64    68   0.15250 -1.0 2.0
   57    60    64    68  -0.50650  1.0 3.0
   58    57    60    46   0.15000  1.0 3.0
   58    57    60    61   0.15000  1.0 3.0
   58    57    60    64   0.15000  1.0 3.0
   59    57    60    46   0.15000  1.0 3.0
   59    57    60    61   0.15000  1.0 3.0
   59    57    60    64   0.15000  1.0 3.0
   60    46   -50    51   0.09700  1.0 1.0
   60    46   -50    51   0.15600 -1.0 2.0
   60    46   -50    51  -0.50800  1.0 3.0
   60    46    50    53   0.09850  1.0 1.0
   60    46    50    53   0.15250 -1.0 2.0
   60    46    50    53  -0.50650  1.0 3.0
   60    61    66    67   0.15000  1.0 3.0
   60    61    66    48   0.56750  1.0 1.0
   60    61    66    48  -0.07550 -1.0 2.0
   60    61    66    48   0.20000  1.0 3.0
   60    61    66    71   0.86500  1.0 1.0
   60    61    66    71  -0.17500 -1.0 2.0
   60    61    66    71   0.20800  1.0 3.0
   60    64    68    69   7.00000 -1.0 2.0
   60    64    68    70   7.00000 -1.0 2.0
   61    60    64    65   0.00000  1.0 1.0
   61    60    64    68   0.09850  1.0 1.0
   61    60    64    68   0.15250 -1.0 2.0
   61    60    64    68  -0.50650  1.0 3.0
   61    66    48    39   0.56750  1.0 1.0
   61    66    48    39  -0.07550 -1.0 2.0
   61    66    48    39   0.20000  1.0 3.0
   61    66   -48    44   0.56750  1.0 1.0
   61    66   -48    44  -0.07550 -1.0 2.0
   61    66   -48    44   0.20000  1.0 3.0
   61    66    48    49   0.15000  1.0 3.0
   61    66    71    72  -0.11600  1.0 1.0
   61    66    71    72  -0.09450 -1.0 2.0
   61    66    71    72   0.21250  1.0 3.0
   62    61    66    67   0.15000  1.0 3.0
   62    61    66    48   0.15000  1.0 3.0
   62    61    66    71   0.23400  1.0 3.0
   63    61    66    67   0.15000  1.0 3.0
   63    61    66    48   0.15000  1.0 3.0
   63    61    66    71   0.23400  1.0 3.0
   67    66    48    39   0.15000  1.0 3.0
   67    66    48    44   0.15000  1.0 3.0
   67    66    48    49   0.15000  1.0 3.0
   67    66    71    72   0.19450  1.0 3.0
   48    39    41    42   0.30150 -1.0 2.0
   48    39   -41    43   0.36750  1.0 3.0
   48    44    46    47   0.15000  1.0 3.0
   48    44    46    50   0.34400  1.0 1.0
   48    44    46    50   0.09450 -1.0 2.0
   48    44    46    50   0.11100  1.0 3.0
   48    44   -46    60   0.56750  1.0 1.0
   48    44   -46    60  -0.07550 -1.0 2.0
   48    44   -46    60   0.20000  1.0 3.0
   48    66    71    72  -0.11600  1.0 1.0
   48    66    71    72  -0.09450 -1.0 2.0
   48    66    71    72   0.21250  1.0 3.0
   71    66    48    39   0.86500  1.0 1.0
   71    66    48    39  -0.17500 -1.0 2.0
   71    66    48    39   0.20800  1.0 3.0
   71    66    48    44   0.86500  1.0 1.0
   71    66    48    44  -0.17500 -1.0 2.0
   71    66    48    44   0.20800  1.0 3.0
   71    66    48    49   0.23400  1.0 3.0
   64    60    61    62   0.15000  1.0 3.0
   64    60    61    63   0.15000  1.0 3.0
   64    60    61    66   0.34400  1.0 1.0
   64    60    61    66   0.09450 -1.0 2.0
   64    60    61    66   0.11100  1.0 3.0
   65    64    68    69   7.00000 -1.0 2.0
   65    64    68    70   7.00000 -1.0 2.0
   53    50    51    52   1.00000 -1.0 2.0
   53    50    51    56  -0.56150  1.0 1.0
   53    50    51    56   2.19150 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   38    30    36    37  10.50000 -1.0 2.0
   39    43    41    42  10.50000 -1.0 2.0
   46    51    50    53   1.10000 -1.0 2.0
   50    56    51    52  10.50000 -1.0 2.0
   60    65    64    68  15.00000 -1.0 2.0
   69    70    68    64  15.00000 -1.0 2.0
   54    55    53    50   1.10000 -1.0 2.0
END
