* LIGAND DATABASE FILE (OPLS2005)
*
001      74    73    124    179     357
    1     0 S   NP   _N1_     1    30.01461    91.73136   -26.15758
    2     1 S   H    _HN1     2     1.02931   104.78880    -2.15994
    3     1 S   H    _H1_     3     1.02831     2.30970   168.24574
    4     1 S   H    _H2_     4     1.02786   108.52828  -117.77981
    5     1 S   CT   _CA1     5     1.50119   112.19188   117.66939
    6     5 S   HC   _HA1     6     1.09563   105.23267    61.12525
    7     5 S   CO3  _C1_     7     1.53808   112.37441   -59.22700
    8     7 S   O2Z  _O11     8     1.26369   114.99618   -42.72356
    9     7 S   O2Z  _O12     9     1.26231   114.94047   136.33962
   10     5 S   CT   _CB1    10     1.53032   107.43115   179.22317
   11    10 S   HC   HB11    11     1.09831   109.54505   -48.47049
   12    10 S   HC   HB12    12     1.09791   110.31916    68.11440
   13    10 S   CT   _CG1    13     1.53032   112.65906  -169.42986
   14    13 S   HC   HG11    14     1.09580   110.59634   -62.26208
   15    13 S   HC   HG12    15     1.09642   109.94229    57.10457
   16    13 S   C    _CD1    16     1.51727   112.05606   177.66142
   17    16 S   O    _OE1    17     1.22744   123.13174     3.16075
   18    16 S   N    _N2_    18     1.38665   111.86194  -177.24466
   19    18 S   H    _HN2    19     1.01556   119.12106     3.83446
   20    18 S   CT1  _CA2    20     1.46166   123.22056  -178.13575
   21    20 S   HC   _HA2    21     1.09544   109.07836     6.26400
   22    20 S   C    _C2_    22     1.53577   109.33914  -108.94441
   23    22 S   O    _O2_    23     1.23090   122.16547  -149.23426
   24    20 S   CT   _CB2    32     1.53574   111.88592   128.31328
   25    24 S   HC   HB21    33     1.09680   109.31106    70.81179
   26    24 S   HC   HB22    34     1.09547   110.70056  -172.57588
   27    22 S   N    _N3_    24     1.38307   113.90111    38.04381
   28    27 S   H    _HN3    25     1.01559   119.59516    -2.85328
   29    24 S   S    _SG2    35     1.83163   115.46081   -48.14626
   30    27 S   CT   _CA3    26     1.45276   123.16025   177.10727
   31    30 S   HC   HA31    27     1.09551   107.45782   -65.50768
   32    30 S   HC   HA32    28     1.09558   108.03259    50.91419
   33    29 S   CT   _C20    36     1.84197   101.07194   -63.86440
   34    33 S   HC   _H3_    37     1.09341   107.18763    42.27459
   35    30 S   CO3  _C3_    29     1.52946   114.14694   172.94150
   36    35 S   O2Z  _O31    30     1.26369   116.11530    -1.42903
   37    35 S   O2Z  _O32    31     1.26438   114.39877   178.66866
   38    33 S   CM   _C11    38     1.50951   109.56043   -76.78920
   39    38 S   HC   _H28    39     1.08951   117.03979   -56.64418
   40    33 S   CM   _C16    43     1.53220   108.35545   158.79823
   41    38 S   CMA  _C12    40     1.34808   125.76641   122.97048
   42    41 S   OM   _O18    41     1.25850   133.09366     0.17914
   43    41 S   HC   _H29    42     1.09238   111.38392  -179.80719
   44    40 S   CM   _C10    44     1.35108   118.41406  -102.07662
   45    44 S   HC   _H27    45     1.08975   117.77535     0.27124
   46    40 S   CT   _C19    71     1.51036   117.45336    77.52656
   47    46 S   HC   _H37    72     1.09474   110.94237   -46.19177
   48    46 S   HC   _H38    73     1.09235   113.38680  -165.37968
   49    46 S   HC   _H39    74     1.09476   110.28850    73.89082
   50    44 S   CM   _C5_    46     1.44802   127.92494  -179.88986
   51    50 S   HC   _H22    47     1.08490   118.28003     4.32074
   52    50 S   CM   _C4_    48     1.34331   122.35779  -175.68743
   53    52 S   HC   _H21    49     1.08504   119.07448     0.04423
   54    52 S   CM   _C8_    50     1.44805   122.91059   179.79537
   55    54 S   HC   _H25    51     1.09037   114.69907     1.19354
   56    54 S   CM   _C14    52     1.34820   127.06160  -178.49741
   57    56 S   CM   _C7_    53     1.45874   120.52970   179.31987
   58    57 S   HC   _H24    54     1.08963   114.26710  -119.65705
   59    56 S   CT   _C17    67     1.50500   126.28683     2.07519
   60    59 S   HC   _H31    68     1.09591   110.20863  -120.81575
   61    59 S   HC   _H32    69     1.09596   110.50811   119.64351
   62    59 S   HC   _H33    70     1.09204   113.70094    -0.61960
   63    57 S   CM   _C6_    55     1.34415   128.14566    61.79810
   64    63 S   HC   _H23    56     1.08671   116.20486  -180.00000
   65    63 S   CM   _C9_    57     1.45013   126.70467     1.88326
   66    65 S   HC   _H26    58     1.08828   115.16370     4.33025
   67    65 S   CM   _C15    59     1.34518   126.19462  -176.65848
   68    67 S   CO4  _C13    60     1.49116   115.67356  -179.25244
   69    68 S   O    _O19    61     1.22567   122.93561   179.86152
   70    68 S   HC   _H30    62     1.10321   116.15502    -0.08623
   71    67 S   CT   _C18    63     1.49774   128.28398     1.12605
   72    71 S   HC   _H34    64     1.09543   110.23878   123.36825
   73    71 S   HC   _H35    65     1.09214   113.47549     3.41856
   74    71 S   HC   _H36    66     1.09515   110.16852  -117.16028
  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   8   5   4   3
  14   6   2   1   1   7   4  10   2   1   1  10   4   4   2   1
   1   6   3   6   3   9   3   9  10   4   4   2   1   1   6   3
   9   3   7   6   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    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    41    40    44    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    43    40    44    45    50    46    47    48    49  
   38    39    41    40    44    46  
   36    37  
   37  
    0  
   39    41    42    43    40    44    46  
   41    42    43    40  
   44    45    50    51    52    46    47    48    49    41  
   42    43  
   43  
    0  
   45    50    51    52    53    54    46    47    48    49  
   50    51    52    46  
   47    48    49    50  
   48    49  
   49  
    0  
   51    52    53    54    55    56  
   52    53    54  
   53    54    55    56    57    59  
   54    55    56  
   55    56    57    58    63    59    60    61    62  
   56    57    59  
   57    58    63    64    65    59    60    61    62  
   58    63    64    65    66    67    59    60    61    62  
   63    64    65    59  
   60    61    62    63  
   61    62  
   62  
    0  
   64    65    66    67    68    71  
   65    66    67  
   66    67    68    69    70    71    72    73    74  
   67    68    71  
   68    69    70    71    72    73    74  
   69    70    71    72    73    74  
   70    71  
   71  
   72    73    74  
   73    74  
   74  
    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   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5500   0.0760   0.437200   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   2.5000   0.0500  -0.062100   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   57   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   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  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   66   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   68   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   70   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   317.000  1.510
   33    40   317.000  1.510
   38    39   340.000  1.080
   38    41   465.000  1.376
   41    42   745.000  1.250
   41    43   335.000  1.111
   40    44   549.000  1.340
   40    46   317.000  1.510
   44    45   340.000  1.080
   44    50   380.000  1.444
   50    51   340.000  1.080
   50    52   549.000  1.340
   52    53   340.000  1.080
   52    54   380.000  1.444
   54    55   340.000  1.080
   54    56   549.000  1.340
   56    57   380.000  1.444
   56    59   317.000  1.510
   57    58   340.000  1.080
   57    63   549.000  1.340
   63    64   340.000  1.080
   63    65   380.000  1.444
   65    66   340.000  1.080
   65    67   549.000  1.340
   67    68   320.000  1.462
   67    71   317.000  1.510
   68    69   570.000  1.229
   68    70   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   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  112.20000
   29    33    40    75.00000  112.20000
   33    38    39    35.00000  117.00000
   33    38    41    70.00000  124.00000
   33    40    44    70.00000  124.00000
   33    40    46    65.00000  117.92700
   38    33    34    35.00000  109.50000
   38    41    42    65.00000  137.10300
   38    41    43    45.00000  105.30000
   41    38    39    40.00000  120.50800
   43    41    42    50.00000  124.16400
   40    33    34    35.00000  109.50000
   40    33    38    70.00000  110.12100
   40    44    45    35.00000  120.00000
   40    44    50    70.00000  123.01800
   40    46    47    35.00000  109.50000
   40    46    48    35.00000  109.50000
   40    46    49    35.00000  109.50000
   44    50    51    35.00000  120.00000
   44    50    52    70.00000  123.01800
   50    44    45    35.00000  120.00000
   50    52    53    35.00000  120.00000
   50    52    54    70.00000  123.01800
   52    50    51    35.00000  120.00000
   52    54    55    35.00000  120.00000
   52    54    56    70.00000  123.01800
   54    52    53    35.00000  120.00000
   54    56    57    70.00000  123.01800
   54    56    59    70.00000  124.00000
   56    54    55    35.00000  120.00000
   56    57    58    35.00000  120.00000
   56    57    63    70.00000  123.01800
   56    59    60    35.00000  109.50000
   56    59    61    35.00000  109.50000
   56    59    62    35.00000  109.50000
   57    63    64    35.00000  120.00000
   57    63    65    70.00000  123.01800
   63    57    58    35.00000  120.00000
   63    65    66    35.00000  120.00000
   63    65    67    70.00000  123.01800
   65    63    64    35.00000  120.00000
   65    67    68    65.00000  118.96000
   65    67    71    70.00000  124.00000
   67    65    66    35.00000  120.00000
   67    68    69    80.00000  123.72100
   67    68    70    40.00000  115.75000
   67    71    72    35.00000  109.50000
   67    71    73    35.00000  109.50000
   67    71    74    35.00000  109.50000
   70    68    69    35.00000  123.00000
   71    67    68    65.00000  116.34900
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   59    56    57    70.00000  124.00000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   46    40    44    70.00000  124.00000
   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  -0.62250  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  -0.62250  1.0 1.0
   24    29    33    40  -0.38450 -1.0 2.0
   24    29    33    40   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    41   0.42700  1.0 1.0
   29    33    38    41  -0.70350 -1.0 2.0
   29    33    38    41  -0.43150  1.0 3.0
   29    33    40    44   0.42700  1.0 1.0
   29    33    40    44  -0.70350 -1.0 2.0
   29    33    40    44  -0.43150  1.0 3.0
   29    33    40    46   0.30250  1.0 1.0
   29    33    40    46  -0.14950 -1.0 2.0
   29    33    40    46   0.36900  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    43   7.00000 -1.0 2.0
   33    40    44    45   7.00000 -1.0 2.0
   33    40    44    50   7.00000 -1.0 2.0
   33    40    46    47   0.34800  1.0 3.0
   33    40    46    48   0.34800  1.0 3.0
   33    40    46    49   0.34800  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    40    44   0.00000  1.0 1.0
   34    33    40    46   0.34800  1.0 3.0
   38    33    40    44  -0.28300  1.0 1.0
   38    33    40    44   0.26700 -1.0 2.0
   38    33    40    44  -0.63300  1.0 3.0
   38    33    40    46   0.09700  1.0 1.0
   38    33    40    46   0.15600 -1.0 2.0
   38    33    40    46  -0.50800  1.0 3.0
   39    38    41    42   7.00000 -1.0 2.0
   39    38    41    43   7.00000 -1.0 2.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    41  -0.28300  1.0 1.0
   40    33    38    41   0.26700 -1.0 2.0
   40    33    38    41  -0.63300  1.0 3.0
   40    44    50    51  -0.18600  1.0 3.0
   40    44    50    52   0.28850  1.0 1.0
   40    44    50    52   2.61350 -1.0 2.0
   40    44    50    52   0.78400  1.0 3.0
   44    40    46    47   0.00000  1.0 1.0
   44    40    46    48   0.00000  1.0 1.0
   44    40    46    49   0.00000  1.0 1.0
   44    50    52    53   7.00000 -1.0 2.0
   44    50    52    54   7.00000 -1.0 2.0
   45    44    50    51   0.00000  1.0 1.0
   45    44    50    52  -0.18600  1.0 3.0
   50    52    54    55  -0.18600  1.0 3.0
   50    52    54    56   0.28850  1.0 1.0
   50    52    54    56   2.61350 -1.0 2.0
   50    52    54    56   0.78400  1.0 3.0
   51    50    52    53   7.00000 -1.0 2.0
   51    50    52    54   7.00000 -1.0 2.0
   52    54    56    57   7.00000 -1.0 2.0
   52    54    56    59   7.00000 -1.0 2.0
   53    52    54    55   0.00000  1.0 1.0
   53    52    54    56  -0.18600  1.0 3.0
   54    56    57    58  -0.18600  1.0 3.0
   54    56    57    63   0.28850  1.0 1.0
   54    56    57    63   2.61350 -1.0 2.0
   54    56    57    63   0.78400  1.0 3.0
   54    56    59    60   0.00000  1.0 1.0
   54    56    59    61   0.00000  1.0 1.0
   54    56    59    62   0.00000  1.0 1.0
   55    54    56    57   7.00000 -1.0 2.0
   55    54    56    59   7.00000 -1.0 2.0
   56    57    63    64   7.00000 -1.0 2.0
   56    57    63    65   7.00000 -1.0 2.0
   57    56    59    60   0.00000  1.0 1.0
   57    56    59    61   0.00000  1.0 1.0
   57    56    59    62   0.00000  1.0 1.0
   57    63    65    66  -0.18600  1.0 3.0
   57    63    65    67   0.28850  1.0 1.0
   57    63    65    67   2.61350 -1.0 2.0
   57    63    65    67   0.78400  1.0 3.0
   58    57    63    64   7.00000 -1.0 2.0
   58    57    63    65   7.00000 -1.0 2.0
   63    65    67    68   7.00000 -1.0 2.0
   63    65    67    71   7.00000 -1.0 2.0
   64    63    65    66   0.00000  1.0 1.0
   64    63    65    67  -0.18600  1.0 3.0
   65    67    68    69   1.00000 -1.0 2.0
   65    67    68    70  -0.79650  1.0 1.0
   65    67    68    70   1.60950 -1.0 2.0
   65    67    68    70  -0.26250  1.0 3.0
   65    67    71    72   0.00000  1.0 1.0
   65    67    71    73   0.00000  1.0 1.0
   65    67    71    74   0.00000  1.0 1.0
   66    65    67    68   7.00000 -1.0 2.0
   66    65    67    71   7.00000 -1.0 2.0
   68    67    71    72   0.15000  1.0 3.0
   68    67    71    73   0.15000  1.0 3.0
   68    67    71    74   0.15000  1.0 3.0
   71    67    68    69  -0.64400  1.0 1.0
   71    67    68    69   0.26850 -1.0 2.0
   71    67    68    70  -0.07900  1.0 1.0
   71    67    68    70   0.77700 -1.0 2.0
   71    67    68    70   0.13200  1.0 3.0
   59    56    57    58   0.00000  1.0 1.0
   59    56    57    63  -0.18600  1.0 3.0
   46    40    44    45   7.00000 -1.0 2.0
   46    40    44    50   7.00000 -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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    41  15.00000 -1.0 2.0
   42    43    41    38  15.00000 -1.0 2.0
   33    46    40    44  15.00000 -1.0 2.0
   50    45    44    40  15.00000 -1.0 2.0
   44    51    50    52  15.00000 -1.0 2.0
   54    53    52    50  15.00000 -1.0 2.0
   52    55    54    56  15.00000 -1.0 2.0
   57    59    56    54  15.00000 -1.0 2.0
   56    58    57    63  15.00000 -1.0 2.0
   65    64    63    57  15.00000 -1.0 2.0
   63    66    65    67  15.00000 -1.0 2.0
   68    71    67    65  15.00000 -1.0 2.0
   67    70    68    69  10.50000 -1.0 2.0
END
