* LIGAND DATABASE FILE (OPLS2005)
*
001      73    74    135    205     392
    1     0 S   NP   _N1_     1    28.13805    95.30589   -22.86072
    2     1 S   H    _HN1     2     1.02836    26.93711   139.16374
    3     1 S   H    _H1_     3     1.02777   102.17312  -115.21581
    4     1 S   H    _H2_     4     1.02958    84.59639    -7.58690
    5     1 S   CT   _CA1     5     1.50128   134.45262   105.83547
    6     5 S   HC   _HA1     6     1.09574   105.21927    74.60254
    7     5 S   CO3  _C1_     7     1.53787   112.36090   -45.59666
    8     7 S   O2Z  _O11     8     1.26365   114.99798   -44.06132
    9     7 S   O2Z  _O12     9     1.26236   114.93126   135.04817
   10     5 S   CT   _CB1    10     1.53096   107.42208  -167.48816
   11    10 S   HC   HB11    11     1.09827   109.33802   -50.53648
   12    10 S   HC   HB12    12     1.09816   110.42465    66.02037
   13    10 S   CT   _CG1    13     1.53017   112.66657  -171.60838
   14    13 S   HC   HG11    14     1.09594   110.48685   -64.23481
   15    13 S   HC   HG12    15     1.09656   109.92245    54.96422
   16    13 S   C    _CD1    16     1.51842   112.31905   175.33675
   17    16 S   O    _OE1    17     1.22749   123.27185     0.13270
   18    16 S   N    _N2_    18     1.38546   111.69650  -179.91153
   19    18 S   H    _HN2    19     1.01560   119.03148     4.69953
   20    18 S   CT1  _CA2    20     1.45820   122.92300   177.81537
   21    20 S   HC   _HA2    21     1.09719   109.00179    22.77123
   22    20 S   C    _C2_    22     1.52898   106.87188   -94.47420
   23    22 S   O    _O2_    23     1.23002   122.83843   -32.07004
   24    20 S   CT   _CB2    32     1.53196   112.16310   145.96210
   25    24 S   HC   HB21    33     1.09547   110.12371    51.68118
   26    24 S   HC   HB22    34     1.09268   109.57755   170.21009
   27    22 S   N    _N3_    24     1.38510   112.70695   150.59160
   28    27 S   H    _HN3    25     1.01616   120.33602    -1.67012
   29    24 S   S    _SG2    35     1.83066   110.83566   -68.50394
   30    27 S   CT   _CA3    26     1.45360   122.49520   177.92925
   31    30 S   HC   HA31    27     1.09571   107.26723   -65.39540
   32    30 S   HC   HA32    28     1.09558   108.12472    50.89895
   33    29 S   CT   _C16    36     1.86239   101.35486  -163.66811
   34    30 S   CO3  _C3_    29     1.52877   114.43093   172.80974
   35    34 S   O2Z  _O31    30     1.26319   116.13270   -10.91654
   36    34 S   O2Z  _O32    31     1.26460   114.46439   169.25689
   37    33 S   CM   _C15    37     1.52420   107.55098    71.06214
   38    37 S   HC   _H16    38     1.09223   113.13727    62.08545
   39    33 S   CT   _C17    66     1.53646   109.60415   -57.94544
   40    39 S   HC   _H17    67     1.09707   111.35691   -56.48329
   41    39 S   HC   _H18    68     1.09677   110.85585  -175.02925
   42    39 S   HC   _H19    69     1.09412   113.10671    64.34442
   43    33 S   CT   _C18    70     1.54191   106.14200  -173.94142
   44    43 S   HC   _H20    71     1.09696   111.78711    61.72040
   45    43 S   HC   _H21    72     1.09727   110.69378  -179.00181
   46    43 S   HC   _H22    73     1.09734   112.36168   -59.46572
   47    37 S   CMA  _C14    39     1.35375   130.38159  -117.32663
   48    47 S   OM   _O35    40     1.26134   131.97017    -1.59053
   49    47 S   CT   _C13    41     1.54019   116.74565  -179.52522
   50    49 S   HC   _H14    42     1.10058   109.07904    31.52952
   51    49 S   HC   _H15    43     1.10171   108.99766   144.66413
   52    49 S   CT   _C5_    44     1.55370   116.75765   -91.42263
   53    52 S   CT   _C6_    45     1.53256   110.32137  -175.70554
   54    53 S   HC   _H7_    46     1.09701   110.98020    34.42526
   55    53 S   HC   _H8_    47     1.09441   113.46617   -86.78939
   56    52 S   CT   _C4_    62     1.53479   112.13618    60.47625
   57    56 S   HC   _H4_    63     1.09300   111.31634   -65.85152
   58    56 S   HC   _H5_    64     1.09477   111.64666   176.66546
   59    56 S   HC   _H6_    65     1.09471   111.42134    55.83670
   60    53 S   CT   _C7_    48     1.51114   103.08674   150.61895
   61    60 S   HC   _H9_    49     1.09656   109.51159    83.20486
   62    60 S   HC   _H10    50     1.09458   112.92257  -157.39803
   63    60 S   CT   _C8_    51     1.52337   103.02752   -33.47027
   64    63 S   HC   _H3_    52     1.09588   109.85988   140.20932
   65    63 S   C5BC _C9_    53     1.49528   113.04597   -98.70012
   66    52 S   OS   _O33    61     1.44110   110.47810   -60.00400
   67    65 S   C5BC _C10    54     1.42414   128.25177    91.67867
   68    67 S   HA   _H11    55     1.08083   127.41843     0.30067
   69    67 S   C5A  _C11    56     1.37452   106.60617  -179.98022
   70    69 S   HA   _H12    57     1.08015   133.78864  -179.90721
   71    69 S   OA   _O34    58     1.35692   110.50220    -0.02798
   72    65 S   C5A  _C12    59     1.38145   126.63972   -88.46061
   73    72 S   HA   _H13    60     1.08071   133.40687    -0.07402
  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  12   5   4   3
  13   2   1   1  15   5   8   3   2   1   4   2   1   1   8   4
  13   5   4  14  13   7   6   6   3   2   1   8   5   4   9   4
   8   2   6   4   4   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    43    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    47    39    40    41    42    43    44    45    46  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    47    48    49    39    40    41    42    43    44    45    46  
   35    36  
   36  
    0  
   38    47    48    49    50    51    52    39    40    41    42    43    44    45    46  
   47    48    49    39    43  
   40    41    42    43    44    45    46    47  
   41    42    43  
   42    43  
   43  
   44    45    46    47  
   45    46  
   46  
    0  
   48    49    50    51    52    53    66    56  
   49    50    51    52  
   50    51    52    53    54    55    60    63    66    56    57    58    59  
   51    52    53    66    56  
   52    53    66    56  
   53    54    55    60    61    62    63    64    65    66    56    57    58    59  
   54    55    60    61    62    63    64    65    66    56    57    58    59  
   55    60    61    62    63    66    56  
   60    61    62    63    66    56  
   57    58    59    60    63    66  
   58    59    66  
   59    66  
   66  
   61    62    63    64    65    67    72    66  
   62    63    64    65    66  
   63    64    65    66  
   64    65    67    68    69    71    72    73    66  
   65    67    72    66  
   67    68    69    70    71    72    73    66  
   67    72  
   68    69    70    71    72    73  
   69    70    71    72  
   70    71    72    73  
   71    72  
   72    73  
   73  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   48   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660   0.285000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   67   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   69   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   70   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   71   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   72   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   73   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    39   268.000  1.529
   33    43   268.000  1.529
   37    38   340.000  1.080
   37    47   465.000  1.376
   47    48   745.000  1.250
   47    49   270.000  1.512
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   268.000  1.529
   52    53   268.000  1.529
   52    66   320.000  1.410
   52    56   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   268.000  1.529
   63    64   340.000  1.090
   63    65   285.000  1.502
   63    66   320.000  1.410
   65    67   469.000  1.424
   65    72   546.000  1.367
   67    68   367.000  1.080
   67    69   546.000  1.367
   69    70   367.000  1.080
   69    71   340.000  1.360
   71    72   340.000  1.360
   72    73   367.000  1.080
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   340.000  1.090
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  112.20000
   29    33    39    75.00000  111.63000
   29    33    43    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    47    70.00000  124.00000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   33    43    44    37.50000  110.70000
   33    43    45    37.50000  110.70000
   33    43    46    37.50000  110.70000
   37    47    48    65.00000  137.10300
   37    47    49    65.00000  122.18000
   47    37    38    40.00000  120.50800
   47    49    50    45.00000  110.52000
   47    49    51    45.00000  110.52000
   47    49    52    70.00000  112.02700
   49    47    48    85.00000  112.85300
   49    52    53    58.35000  112.70000
   49    52    66    50.00000  109.50000
   49    52    56    58.35000  112.70000
   51    49    50    33.00000  107.80000
   52    49    50    37.50000  110.70000
   52    49    51    37.50000  110.70000
   52    53    54    37.50000  110.70000
   52    53    55    37.50000  110.70000
   52    53    60    58.35000  112.70000
   52    66    63    60.00000  109.50000
   52    56    57    37.50000  110.70000
   52    56    58    37.50000  110.70000
   52    56    59    37.50000  110.70000
   53    60    61    37.50000  110.70000
   53    60    62    37.50000  110.70000
   53    60    63    58.35000  112.70000
   55    53    54    33.00000  107.80000
   60    53    54    37.50000  110.70000
   60    53    55    37.50000  110.70000
   60    63    64    37.50000  110.70000
   60    63    65    70.00000  112.17500
   60    63    66    50.00000  109.50000
   62    60    61    33.00000  107.80000
   63    60    61    37.50000  110.70000
   63    60    62    37.50000  110.70000
   63    65    67    60.00000  130.00000
   63    65    72    60.00000  130.00000
   65    63    64    35.00000  109.50000
   65    67    68    35.00000  127.50000
   65    67    69    70.00000  107.30000
   65    72    71    70.00000  110.60000
   65    72    73    35.00000  132.10000
   67    69    70    35.00000  132.10000
   67    69    71    70.00000  110.60000
   69    67    68    35.00000  125.70000
   69    71    72    70.00000  106.50000
   71    69    70    35.00000  113.40000
   71    72    73    35.00000  113.40000
   72    65    67    70.00000  107.30000
   66    52    53    50.00000  109.50000
   66    63    64    35.00000  109.50000
   66    63    65    85.00000  111.85700
   56    52    53    58.35000  112.70000
   56    52    66    50.00000  109.50000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   39    33    37    70.00000  112.02700
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    33.00000  107.80000
   43    33    37    70.00000  112.02700
   43    33    39    58.35000  112.70000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  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
   24    29    33    43   0.01700  1.0 1.0
   24    29    33    43  -0.23550 -1.0 2.0
   24    29    33    43   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    37    38   0.00000  1.0 1.0
   29    33    37    47   0.42700  1.0 1.0
   29    33    37    47  -0.70350 -1.0 2.0
   29    33    37    47  -0.43150  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.15000  1.0 3.0
   29    33    43    44   0.15000  1.0 3.0
   29    33    43    45   0.15000  1.0 3.0
   29    33    43    46   0.15000  1.0 3.0
   33    37    47    48   7.00000 -1.0 2.0
   33    37    47    49   7.00000 -1.0 2.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    42   0.15000  1.0 3.0
   37    33    43    44   0.15000  1.0 3.0
   37    33    43    45   0.15000  1.0 3.0
   37    33    43    46   0.15000  1.0 3.0
   37    47    49    50   0.00000  1.0 1.0
   37    47    49    51   0.00000  1.0 1.0
   37    47    49    52   0.09850  1.0 1.0
   37    47    49    52   0.15250 -1.0 2.0
   37    47    49    52  -0.50650  1.0 3.0
   38    37    47    48   7.00000 -1.0 2.0
   38    37    47    49   7.00000 -1.0 2.0
   47    49    52    53   0.34400  1.0 1.0
   47    49    52    53   0.09450 -1.0 2.0
   47    49    52    53   0.11100  1.0 3.0
   47    49    52    66   0.61850  1.0 1.0
   47    49    52    66  -0.22750 -1.0 2.0
   47    49    52    66   0.15300  1.0 3.0
   47    49    52    56   0.34400  1.0 1.0
   47    49    52    56   0.09450 -1.0 2.0
   47    49    52    56   0.11100  1.0 3.0
   48    47    49    50   0.00000  1.0 1.0
   48    47    49    51   0.00000  1.0 1.0
   48    47    49    52   0.09700  1.0 1.0
   48    47    49    52   0.15600 -1.0 2.0
   48    47    49    52  -0.50800  1.0 3.0
   49    52    53    54   0.15000  1.0 3.0
   49    52    53    55   0.15000  1.0 3.0
   49    52    53    60   0.56750  1.0 1.0
   49    52    53    60  -0.07550 -1.0 2.0
   49    52    53    60   0.20000  1.0 3.0
   49    52    66    63   0.06250  1.0 1.0
   49    52    66    63  -0.01100 -1.0 2.0
   49    52    66    63   0.28050  1.0 3.0
   49    52    56    57   0.15000  1.0 3.0
   49    52    56    58   0.15000  1.0 3.0
   49    52    56    59   0.15000  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    66   0.23400  1.0 3.0
   50    49    52    56   0.15000  1.0 3.0
   51    49    52    53   0.15000  1.0 3.0
   51    49    52    66   0.23400  1.0 3.0
   51    49    52    56   0.15000  1.0 3.0
   52    53    60    61   0.15000  1.0 3.0
   52    53    60    62   0.15000  1.0 3.0
   52    53   -60    63   0.56750  1.0 1.0
   52    53   -60    63  -0.07550 -1.0 2.0
   52    53   -60    63   0.20000  1.0 3.0
   53    52   -66    63   0.06250  1.0 1.0
   53    52   -66    63  -0.01100 -1.0 2.0
   53    52   -66    63   0.28050  1.0 3.0
   53    52    56    57   0.15000  1.0 3.0
   53    52    56    58   0.15000  1.0 3.0
   53    52    56    59   0.15000  1.0 3.0
   53    60    63    64   0.15000  1.0 3.0
   53    60    63    65  -0.03700  1.0 1.0
   53    60    63    65   0.37200 -1.0 2.0
   53    60    63    65  -0.47300  1.0 3.0
   53    60   -63    66   0.62750  1.0 1.0
   53    60   -63    66  -0.30950 -1.0 2.0
   53    60   -63    66   0.27300  1.0 3.0
   54    53    60    61   0.15000  1.0 3.0
   54    53    60    62   0.15000  1.0 3.0
   54    53    60    63   0.15000  1.0 3.0
   55    53    60    61   0.15000  1.0 3.0
   55    53    60    62   0.15000  1.0 3.0
   55    53    60    63   0.15000  1.0 3.0
   60    63    65    67   0.04150 -1.0 2.0
   60    63    65    72   0.04150 -1.0 2.0
   60    63   -66    52   0.06250  1.0 1.0
   60    63   -66    52  -0.01100 -1.0 2.0
   60    63   -66    52   0.28050  1.0 3.0
   61    60    63    64   0.15000  1.0 3.0
   61    60    63    65   0.43200  1.0 3.0
   61    60    63    66   0.23400  1.0 3.0
   62    60    63    64   0.15000  1.0 3.0
   62    60    63    65   0.43200  1.0 3.0
   62    60    63    66   0.23400  1.0 3.0
   63    65    67    68   3.62500 -1.0 2.0
   63    65    67    69   3.62500 -1.0 2.0
   63    65    72    71   3.62500 -1.0 2.0
   63    65    72    73   3.62500 -1.0 2.0
   64    63    65    67   0.00000  1.0 1.0
   64    63    65    72   0.00000  1.0 1.0
   64    63    66    52   0.37050  1.0 3.0
   65    63    66    52   0.37500  1.0 3.0
   65    67    69    70   3.62500 -1.0 2.0
   65    67   -69    71   3.62500 -1.0 2.0
   67    65   -72    71   3.62500 -1.0 2.0
   67    65    72    73   3.62500 -1.0 2.0
   67    69   -71    72   3.62500 -1.0 2.0
   68    67    69    70   3.62500 -1.0 2.0
   68    67    69    71   3.62500 -1.0 2.0
   69    71   -72    65   3.62500 -1.0 2.0
   69    71    72    73   3.62500 -1.0 2.0
   70    69    71    72   3.62500 -1.0 2.0
   72    65    67    68   3.62500 -1.0 2.0
   72    65   -67    69   3.62500 -1.0 2.0
   66    52    53    54   0.23400  1.0 3.0
   66    52    53    55   0.23400  1.0 3.0
   66    52   -53    60   0.62750  1.0 1.0
   66    52   -53    60  -0.30950 -1.0 2.0
   66    52   -53    60   0.27300  1.0 3.0
   66    52    56    57   0.23400  1.0 3.0
   66    52    56    58   0.23400  1.0 3.0
   66    52    56    59   0.23400  1.0 3.0
   66    63    65    67   0.64500  1.0 1.0
   66    63    65    67   0.14800 -1.0 2.0
   66    63    65    67   0.20650  1.0 3.0
   66    63    65    72   0.64500  1.0 1.0
   66    63    65    72   0.14800 -1.0 2.0
   66    63    65    72   0.20650  1.0 3.0
   56    52    53    54   0.15000  1.0 3.0
   56    52    53    55   0.15000  1.0 3.0
   56    52    53    60   0.56750  1.0 1.0
   56    52    53    60  -0.07550 -1.0 2.0
   56    52    53    60   0.20000  1.0 3.0
   56    52    66    63   0.06250  1.0 1.0
   56    52    66    63  -0.01100 -1.0 2.0
   56    52    66    63   0.28050  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    47   0.09850  1.0 1.0
   39    33    37    47   0.15250 -1.0 2.0
   39    33    37    47  -0.50650  1.0 3.0
   39    33    43    44   0.15000  1.0 3.0
   39    33    43    45   0.15000  1.0 3.0
   39    33    43    46   0.15000  1.0 3.0
   43    33    37    38   0.00000  1.0 1.0
   43    33    37    47   0.09850  1.0 1.0
   43    33    37    47   0.15250 -1.0 2.0
   43    33    37    47  -0.50650  1.0 3.0
   43    33    39    40   0.15000  1.0 3.0
   43    33    39    41   0.15000  1.0 3.0
   43    33    39    42   0.15000  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
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    47  15.00000 -1.0 2.0
   49    48    47    37  15.00000 -1.0 2.0
   67    72    65    63   4.00000 -1.0 2.0
   69    68    67    65   1.10000 -1.0 2.0
   71    70    69    67   1.10000 -1.0 2.0
   71    73    72    65   1.10000 -1.0 2.0
END
