* LIGAND DATABASE FILE (OPLS2005)
*
001      75    76    135    199     380
    1     0 S   NP   _N1_     1    28.74399    94.13645   -20.48642
    2     1 S   H    _HN1     2     1.02968    97.18810    48.75155
    3     1 S   H    _H1_     3     1.02830    25.18390   163.95352
    4     1 S   H    _H2_     4     1.02774    90.02426   -59.74643
    5     1 S   CT   _CA1     5     1.50175   135.43000   177.54944
    6     5 S   HC   _HA1     6     1.09577   105.18447    53.03919
    7     5 S   CO3  _C1_     7     1.53830   112.37139   -66.96618
    8     7 S   O2Z  _O11     8     1.26358   115.07519   -41.12741
    9     7 S   O2Z  _O12     9     1.26258   114.94353   137.86439
   10     5 S   CT   _CB1    10     1.53084   107.33832   170.83927
   11    10 S   HC   HB11    11     1.09812   109.26932   -50.27416
   12    10 S   HC   HB12    12     1.09814   110.37242    66.16254
   13    10 S   CT   _CG1    13     1.53009   112.79977  -171.50671
   14    13 S   HC   HG11    14     1.09490   110.32094   -61.09190
   15    13 S   HC   HG12    15     1.09629   110.21805    57.77718
   16    13 S   C    _CD1    16     1.51885   111.97676   177.39977
   17    16 S   O    _OE1    17     1.22776   122.93261   -22.72380
   18    16 S   N    _N2_    18     1.38558   112.00527   159.17620
   19    18 S   H    _HN2    19     1.01572   119.01754    -0.91429
   20    18 S   CT1  _CA2    20     1.46222   123.51714   179.22444
   21    20 S   HC   _HA2    21     1.09741   109.37190   -14.10962
   22    20 S   C    _C2_    22     1.53483   107.98981  -129.54647
   23    22 S   O    _O2_    23     1.23008   122.35275  -144.99067
   24    20 S   CT   _CB2    32     1.53594   111.66312   108.22145
   25    24 S   HC   HB21    33     1.09500   109.37929    52.41964
   26    24 S   HC   HB22    34     1.09387   109.91949   171.38432
   27    22 S   N    _N3_    24     1.38549   113.31813    42.36102
   28    27 S   H    _HN3    25     1.01528   118.90085    -0.54212
   29    24 S   S    _SG2    35     1.82883   111.50409   -68.39282
   30    27 S   CT   _CA3    26     1.45441   123.39588   175.20274
   31    30 S   HC   HA31    27     1.09528   109.15137    25.90310
   32    30 S   HC   HA32    28     1.09494   107.13655   142.88569
   33    29 S   CT   _C14    36     1.86336   102.02892  -176.30080
   34    30 S   CO3  _C3_    29     1.52930   113.20064   -97.52297
   35    34 S   O2Z  _O31    30     1.26396   115.44677   -43.73311
   36    34 S   O2Z  _O32    31     1.26362   114.95699   137.22619
   37    33 S   CM   _C9_    37     1.54877   107.54674  -174.30274
   38    33 S   CT   _C15    67     1.54327   113.09590   -44.88805
   39    38 S   HC   _H14    68     1.09750   111.34942    70.83621
   40    38 S   HC   _H15    69     1.09600   111.54916   -48.99982
   41    37 S   N4   _N4_    38     1.37823   110.75764  -101.19470
   42    37 S   CMA  _C10    54     1.36786   126.66527    80.02574
   43    42 S   OM   _O34    55     1.27036   125.58605  -179.17197
   44    38 S   OS   _O38    70     1.44311   110.04301  -169.82830
   45    41 S   C4   _C8_    39     1.36167   130.95033  -121.07421
   46    45 S   O    _O33    40     1.21001   134.42423   -32.66391
   47    41 S   C4T  _C7_    43     1.45097   118.42680     9.48373
   48    47 S   HC   _H5_    44     1.09540   112.52092    96.32574
   49    42 S   OS   _O35    56     1.41630   111.34189    -0.37378
   50    44 S   CO4  _C16    71     1.35998   116.06798   175.56774
   51    50 S   O    _O39    72     1.22515   125.58170     1.59016
   52    45 S   C4T  _C6_    41     1.55353    90.46311   141.77452
   53    52 S   HC   _H4_    42     1.10144   110.28641   107.20901
   54    33 S   S    _S1_    45     1.88184   108.36786    73.29919
   55    49 S   CO   _C11    57     1.42977   115.92899  -154.99572
   56    55 S   HC   _H9_    58     1.09553   109.98156   -65.58408
   57    55 S   HC   _H10    59     1.09776   111.24512    55.48659
   58    50 S   N    _N5_    73     1.36842   110.13632  -178.45136
   59    58 S   H    _H16    74     1.01301   121.10699   179.82529
   60    58 S   H    _H17    75     1.01351   120.87250     0.72064
   61    52 S   CT   _C5_    46     1.52482   115.52111  -127.32732
   62    61 S   HC   _H3_    47     1.09492   111.57671    51.15443
   63    55 S   OS   _O36    60     1.44112   110.99520   177.53423
   64    61 S   CT   _C4_    48     1.52254   110.67131   174.78857
   65    64 S   HC   _H6_    49     1.09599   110.88576    60.14137
   66    64 S   HC   _H7_    50     1.09315   112.05128   -60.72272
   67    64 S   HC   _H8_    51     1.09531   110.45855   178.19149
   68    61 S   OH   _O40    52     1.42724   108.12881   -66.90575
   69    68 S   HO   _H18    53     0.97243   107.54570   177.46750
   70    63 S   CO4  _C12    61     1.36169   115.96840   -73.66518
   71    70 S   O    _O37    62     1.22290   126.41169    -1.40458
   72    70 S   CT   _C13    63     1.49818   109.59988   178.97741
   73    72 S   HC   _H11    64     1.09320   109.92411   -53.04236
   74    72 S   HC   _H12    65     1.09358   109.34033  -171.52588
   75    72 S   HC   _H13    66     1.09250   109.80034    68.86241
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  15   2   1   1  15  10   4   3  11   9   2   6  10   4   8   4
   5   4   3  10   5   1   6   3   2   2   1   1   7   6   6   5
   3   2   1   1   1   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    54    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    47    54    42    38    39    40    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    45    52    47    48    54    42    43    49    38    39    40    44    50  
   35    36  
   36  
    0  
   41    45    46    52    47    48    54    42    43    49    55    38    39    40    44  
   39    40    44    50    51    58    41    42    47    54  
   40    44    50    54  
   44    50    54  
   45    46    52    53    47    48    54    61    42    43    49  
   43    49    55    56    57    63    45    47    54  
   49    55  
   50    51    58    59    60    54  
   46    52    53    47    48    54    61    62    64    68  
   52    53    47    61  
   48    54    61    62    64    68    52    53  
   54    61    52    53  
   55    56    57    63    70  
   51    58    59    60  
   58    59    60  
   53    54    61    62    64    65    66    67    68    69  
   54    61    62    64    68  
   61  
   56    57    63    70    71    72  
   57    63    70  
   63    70  
   59    60  
   60  
    0  
   62    64    65    66    67    68    69  
   64    65    66    67    68    69  
   70    71    72    73    74    75  
   65    66    67    68    69  
   66    67    68  
   67    68  
   68  
   69  
    0  
   71    72    73    74    75  
   72    73    74    75  
   73    74    75  
   74    75  
   75  
    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   0.335000   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  -0.549900   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   40   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   41   3.2500   0.1700  -0.296300   1.8100   1.6000   0.054801302  -1.445846770
   42   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   45   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5000   0.0660   0.219000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   49   2.8500   0.1400  -0.685000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.7500   0.1050   0.632500   1.9250   1.7000   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.497000   1.8100   1.6000   0.001000000  -1.480495490
   52   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.6000   0.3550  -0.324000   2.0300   1.8000   0.025682759  -1.666211680
   55   3.5000   0.0660   0.171400   1.9750   1.7500   0.005000000  -0.741685710
   56   2.4200   0.0150   0.100000   1.3810   1.2100   0.008598240   0.268726247
   57   2.4200   0.0150   0.100000   1.3810   1.2100   0.008598240   0.268726247
   58   3.2500   0.1700  -0.883900   1.8100   1.6000   0.054801302  -1.445846770
   59   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
   60   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
   61   3.5000   0.0660   0.263800   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.0000   0.1700  -0.251400   1.7660   1.5600   0.020110767  -0.896042159
   64   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   70   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   71   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   72   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   74   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   75   2.4200   0.0150   0.060000   1.3810   1.2100   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    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    54   222.000  1.810
   33    38   268.000  1.529
   37    41   400.000  1.384
   37    42   465.000  1.376
   41    45   440.000  1.369
   41    47   305.000  1.456
   45    46   930.000  1.212
   45    52   250.000  1.540
   52    53   340.000  1.090
   52    47   268.000  1.529
   52    61   260.000  1.519
   47    48   340.000  1.090
   47    54   200.000  1.824
   61    62   340.000  1.090
   61    64   268.000  1.529
   61    68   320.000  1.410
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   68    69   553.000  0.945
   42    43   745.000  1.250
   42    49   440.000  1.360
   49    55   320.000  1.380
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    63   320.000  1.380
   63    70   214.000  1.327
   70    71   570.000  1.229
   70    72   317.000  1.522
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    75   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    44   320.000  1.410
   44    50   214.000  1.327
   50    51   570.000  1.229
   50    58   435.000  1.380
   58    59   434.000  1.010
   58    60   434.000  1.010
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    54    75.00000  118.28000
   29    33    38    75.00000  111.63000
   33    37    41    70.00000  113.82800
   33    37    42    70.00000  124.00000
   33    54    47    85.00000   99.86700
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    44    50.00000  109.50000
   37    41    45    50.00000  132.10000
   37    41    47    50.00000  132.70000
   37    42    43    65.00000  137.10300
   37    42    49    80.00000  120.01400
   41    45    46    75.00000  131.60000
   41    45    52    95.00000   92.72400
   41    47    52   105.00000   87.49700
   41    47    48    50.00000  112.01000
   41    47    54    80.00000  108.62000
   45    52    53    40.00000  113.37500
   45    52    47   100.00000   86.36000
   45    52    61    63.00000  111.10000
   52    45    46    60.00000  136.58000
   52    47    48    37.50000  110.70000
   52    47    54    65.00000  119.05700
   52    61    62    45.00000  111.22300
   52    61    64    70.00000  112.98000
   52    61    68    50.00000  109.50000
   47    41    45   100.00000   93.00000
   47    52    53    37.50000  110.70000
   54    33    37    75.00000  112.20000
   54    47    48    45.00000  109.41400
   61    52    53    45.00000  112.72800
   61    52    47    65.00000  119.52000
   61    64    65    37.50000  110.70000
   61    64    66    37.50000  110.70000
   61    64    67    37.50000  110.70000
   61    68    69    55.00000  108.50000
   64    61    62    37.50000  110.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   68    61    62    35.00000  109.50000
   68    61    64    50.00000  109.50000
   42    37    41    75.00000  120.83300
   42    49    55    85.00000  113.97000
   49    42    43    65.00000  121.00000
   49    55    56    35.00000  109.50000
   49    55    57    35.00000  109.50000
   49    55    63    92.60000  111.55000
   55    63    70    95.00000  111.08000
   57    55    56    33.00000  109.50000
   63    55    56    35.00000  109.50000
   63    55    57    35.00000  109.50000
   63    70    71    83.00000  123.40000
   63    70    72    81.00000  111.40000
   70    72    73    35.00000  109.50000
   70    72    74    35.00000  109.50000
   70    72    75    35.00000  109.50000
   72    70    71    80.00000  120.40000
   74    72    73    33.00000  107.80000
   75    72    73    33.00000  107.80000
   75    72    74    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    54    75.00000  111.63000
   38    44    50    83.00000  116.90000
   40    38    39    33.00000  107.80000
   44    38    39    35.00000  109.50000
   44    38    40    35.00000  109.50000
   44    50    51    83.00000  123.40000
   44    50    58   110.00000  108.75700
   50    58    59    50.00000  116.34900
   50    58    60    50.00000  116.34900
   58    50    51    85.00000  125.96000
   60    58    59    35.00000  120.00000
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    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    54   0.08500  1.0 1.0
   24    29    33    54  -0.53150 -1.0 2.0
   24    29    33    54   0.48050  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    41   0.09700  1.0 1.0
   29    33    37    41   0.15600 -1.0 2.0
   29    33    37    41  -0.50800  1.0 3.0
   29    33    37    42   0.42700  1.0 1.0
   29    33    37    42  -0.70350 -1.0 2.0
   29    33    37    42  -0.43150  1.0 3.0
   29    33    54    47   0.08500  1.0 1.0
   29    33    54    47  -0.53150 -1.0 2.0
   29    33    54    47   0.48050  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    44   0.56750  1.0 1.0
   29    33    38    44  -0.07550 -1.0 2.0
   29    33    38    44   0.20000  1.0 3.0
   33    37    41    45   0.00000  1.0 1.0
   33    37   -41    47   0.00000  1.0 1.0
   33    37    42    43   7.00000 -1.0 2.0
   33    37    42    49   7.00000 -1.0 2.0
   33    38    44    50  -0.25900  1.0 1.0
   33    38    44    50  -0.47000 -1.0 2.0
   33    38    44    50   0.11750  1.0 3.0
   37    33   -54    47  -0.70200  1.0 1.0
   37    33   -54    47  -0.14350 -1.0 2.0
   37    33   -54    47   0.55200  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    33    38    44   0.61850  1.0 1.0
   37    33    38    44  -0.22750 -1.0 2.0
   37    33    38    44   0.15300  1.0 3.0
   37    41    45    46   3.00000 -1.0 2.0
   37    41    45    52   3.00000 -1.0 2.0
   37    41   -47    52   0.00000  1.0 1.0
   37    41    47    48   0.00000  1.0 1.0
   37    41   -47    54   0.00000  1.0 1.0
   37    42    49    55  -2.26850  1.0 1.0
   37    42    49    55   3.39050 -1.0 2.0
   41    37    42    43   7.00000 -1.0 2.0
   41    37    42    49   7.00000 -1.0 2.0
   41    45    52    53   0.00000  1.0 1.0
   41    45   -52    47   3.00000 -1.0 2.0
   41    45    52    61   1.39750  1.0 1.0
   41    45    52    61  -0.07950 -1.0 2.0
   41    45    52    61  -0.18750  1.0 3.0
   41    47   -54    33   0.01700  1.0 1.0
   41    47   -54    33  -0.23550 -1.0 2.0
   41    47   -54    33   0.21350  1.0 3.0
   45    41   -47    52   0.00000  1.0 1.0
   45    41    47    48   0.00000  1.0 1.0
   45    41    47    54   0.00000  1.0 1.0
   45    52   -47    41   3.00000 -1.0 2.0
   45    52   -47    48   0.15000  1.0 3.0
   45    52   -47    54   0.00000  1.0 1.0
   45    52    61    62  -0.11250  1.0 3.0
   45    52    61    64  -0.95700  1.0 1.0
   45    52    61    64  -0.18200 -1.0 2.0
   45    52    61    64   0.29450  1.0 3.0
   45    52    61    68  -0.09450  1.0 1.0
   45    52    61    68  -1.12950 -1.0 2.0
   45    52    61    68   0.54000  1.0 3.0
   46    45    52    53   0.00000  1.0 1.0
   46    45    52    47  -0.11250  1.0 1.0
   46    45    52    47   0.11400 -1.0 2.0
   46    45    52    47  -0.28950  1.0 3.0
   46    45    52    61   0.30150 -1.0 2.0
   52    47    54    33   0.25150  1.0 1.0
   52    47    54    33  -1.17200 -1.0 2.0
   52    47    54    33   0.53050  1.0 3.0
   52    61    64    65   0.15000  1.0 3.0
   52    61    64    66   0.15000  1.0 3.0
   52    61    64    67   0.15000  1.0 3.0
   52    61    68    69  -0.11600  1.0 1.0
   52    61    68    69  -0.09450 -1.0 2.0
   52    61    68    69   0.21250  1.0 3.0
   53    52   -47    41   0.15000  1.0 3.0
   53    52    47    48   0.15000  1.0 3.0
   53    52    47    54   0.00000  1.0 1.0
   53    52    61    62   0.15000  1.0 3.0
   53    52    61    64   0.15000  1.0 3.0
   53    52    61    68   0.23400  1.0 3.0
   47    41   -45    46   3.00000 -1.0 2.0
   47    41   -45    52   3.00000 -1.0 2.0
   47    52    61    62   0.00000  1.0 1.0
   47    52    61    64   0.04050  1.0 1.0
   47    52    61    64   0.63700 -1.0 2.0
   47    52    61    64   0.17650  1.0 3.0
   47    52    61    68   0.86500  1.0 1.0
   47    52    61    68  -0.17500 -1.0 2.0
   47    52    61    68   0.20800  1.0 3.0
   48    47    54    33   0.00000  1.0 1.0
   54    33   -37    41   0.09700  1.0 1.0
   54    33   -37    41   0.15600 -1.0 2.0
   54    33   -37    41  -0.50800  1.0 3.0
   54    33    37    42   0.42700  1.0 1.0
   54    33    37    42  -0.70350 -1.0 2.0
   54    33    37    42  -0.43150  1.0 3.0
   54    33    38    39   0.15000  1.0 3.0
   54    33    38    40   0.15000  1.0 3.0
   54    33    38    44   0.56750  1.0 1.0
   54    33    38    44  -0.07550 -1.0 2.0
   54    33    38    44   0.20000  1.0 3.0
   61    52   -47    41   0.43900  1.0 1.0
   61    52   -47    41   0.49100 -1.0 2.0
   61    52   -47    41   0.28400  1.0 3.0
   61    52    47    48   0.15000  1.0 3.0
   61    52    47    54   0.44750  1.0 1.0
   61    52    47    54  -0.17800 -1.0 2.0
   61    52    47    54   0.20200  1.0 3.0
   62    61    64    65   0.15000  1.0 3.0
   62    61    64    66   0.15000  1.0 3.0
   62    61    64    67   0.15000  1.0 3.0
   62    61    68    69   0.19450  1.0 3.0
   64    61    68    69  -0.11600  1.0 1.0
   64    61    68    69  -0.09450 -1.0 2.0
   64    61    68    69   0.21250  1.0 3.0
   68    61    64    65   0.23400  1.0 3.0
   68    61    64    66   0.23400  1.0 3.0
   68    61    64    67   0.23400  1.0 3.0
   42    37    41    45   0.00000  1.0 1.0
   42    37    41    47   0.00000  1.0 1.0
   42    49    55    56   0.08050  1.0 3.0
   42    49    55    57   0.08050  1.0 3.0
   42    49    55    63  -0.48150  1.0 1.0
   42    49    55    63   0.09250 -1.0 2.0
   42    49    55    63  -0.12850  1.0 3.0
   43    42    49    55   2.00000 -1.0 2.0
   49    55    63    70  -1.83450  1.0 1.0
   49    55    63    70  -0.02700 -1.0 2.0
   49    55    63    70  -0.20100  1.0 3.0
   55    63    70    71   3.00000 -1.0 2.0
   55    63    70    72   1.63150  1.0 1.0
   55    63    70    72   2.92000 -1.0 2.0
   56    55    63    70   0.08050  1.0 3.0
   57    55    63    70   0.08050  1.0 3.0
   63    70    72    73   0.00000  1.0 1.0
   63    70    72    74   0.00000  1.0 1.0
   63    70    72    75   0.00000  1.0 1.0
   71    70    72    73   0.00000  1.0 1.0
   71    70    72    74   0.00000  1.0 1.0
   71    70    72    75   0.00000  1.0 1.0
   38    33    37    41  -0.93550  1.0 1.0
   38    33    37    41   0.38900 -1.0 2.0
   38    33    37    41   0.16950  1.0 3.0
   38    33    37    42   0.09850  1.0 1.0
   38    33    37    42   0.15250 -1.0 2.0
   38    33    37    42  -0.50650  1.0 3.0
   38    33    54    47  -0.25000 -1.0 2.0
   38    33    54    47  -0.01800  1.0 3.0
   38    44    50    51   3.00000 -1.0 2.0
   38    44    50    58  -0.80800  1.0 1.0
   38    44    50    58   2.06850 -1.0 2.0
   39    38    44    50   0.08050  1.0 3.0
   40    38    44    50   0.08050  1.0 3.0
   44    50    58    59   2.56700 -1.0 2.0
   44    50    58    60   2.56700 -1.0 2.0
   51    50    58    59   2.45000 -1.0 2.0
   51    50    58    60   2.45000 -1.0 2.0
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    41    37    42   1.10000 -1.0 2.0
   47    45    41    37   1.00000 -1.0 2.0
   41    52    45    46  10.50000 -1.0 2.0
   43    49    42    37   1.10000 -1.0 2.0
   63    72    70    71  10.50000 -1.0 2.0
   44    58    50    51  10.50000 -1.0 2.0
   60    50    58    59   1.00000 -1.0 2.0
END
