* LIGAND DATABASE FILE (OPLS2005)
*
001      63    63    116    174     342
    1     0 S   NP   _N1_     1    28.92787    94.85830   -23.42855
    2     1 S   H    _HN1     2     1.02790   106.03779  -116.04264
    3     1 S   H    _H1_     3     1.02949    83.21393    -8.83271
    4     1 S   H    _H2_     4     1.02828    26.42228   145.94497
    5     1 S   CT   _CA1     5     1.50124   131.68525   102.54482
    6     5 S   HC   _HA1     6     1.09569   105.19990    78.39025
    7     5 S   CO3  _C1_     7     1.53801   112.39357   -41.90497
    8     7 S   O2Z  _O11     8     1.26383   114.99976   -43.48795
    9     7 S   O2Z  _O12     9     1.26221   114.95875   135.53422
   10     5 S   CT   _CB1    10     1.53060   107.41076  -163.57187
   11    10 S   HC   HB11    11     1.09836   109.47865   -48.88680
   12    10 S   HC   HB12    12     1.09811   110.42146    67.75348
   13    10 S   CT   _CG1    13     1.52985   112.56495  -169.79332
   14    13 S   HC   HG11    14     1.09545   110.65131   -64.88054
   15    13 S   HC   HG12    15     1.09664   109.75965    54.31147
   16    13 S   C    _CD1    16     1.51798   112.06640   174.91338
   17    16 S   O    _OE1    17     1.22748   123.22905    10.42323
   18    16 S   N    _N2_    18     1.38557   111.77942  -169.92266
   19    18 S   H    _HN2    19     1.01657   119.05712     1.46380
   20    18 S   CT1  _CA2    20     1.46206   123.53550   177.90090
   21    20 S   HC   _HA2    21     1.09733   109.35269     4.66854
   22    20 S   C    _C2_    22     1.53576   108.91617  -110.81821
   23    22 S   O    _O2_    23     1.23076   122.24151  -149.81585
   24    20 S   CT   _CB2    32     1.53076   111.17228   126.65692
   25    24 S   HC   HB21    33     1.09566   110.14965    54.76174
   26    24 S   HC   HB22    34     1.09504   111.06596   173.27772
   27    22 S   N    _N3_    24     1.38345   113.80537    38.01296
   28    27 S   H    _HN3    25     1.01562   119.58370    -4.07972
   29    24 S   S    _SG2    35     1.82561   111.68793   -67.24705
   30    27 S   CT   _CA3    26     1.45272   123.19956   176.93778
   31    30 S   HC   HA31    27     1.09552   107.62003   -61.61032
   32    30 S   HC   HA32    28     1.09556   107.85120    54.79820
   33    29 S   OS   _O34    36     1.66769    98.29758   148.15231
   34    30 S   CO3  _C3_    29     1.52957   114.11723   176.70753
   35    34 S   O2Z  _O31    30     1.26376   116.10841    -0.46436
   36    34 S   O2Z  _O32    31     1.26437   114.41012   179.53103
   37    33 S   CT   _C7_    37     1.45398   119.17246  -109.03032
   38    37 S   CM   _C12    38     1.52262   111.68318    46.97375
   39    38 S   HC   _H15    39     1.08764   117.33709   -81.96799
   40    37 S   CT   _C5_    54     1.57141   108.93351   -76.22376
   41    40 S   HC   _H6_    55     1.09885   107.77026    62.03820
   42    38 S   CM   _C11    40     1.34217   124.84783    99.00435
   43    42 S   HC   _H14    41     1.08972   117.78389   177.81206
   44    40 S   CT   _C4_    56     1.53566   114.23477  -179.94405
   45    44 S   HC   _H3_    57     1.09389   112.05870    66.40354
   46    44 S   HC   _H4_    58     1.09398   111.77841   -55.42596
   47    44 S   HC   _H5_    59     1.09601   110.19393  -174.31221
   48    40 S   CT   _C6_    60     1.53611   112.91279   -54.50940
   49    48 S   HC   _H7_    61     1.09458   111.69117   -67.20943
   50    48 S   HC   _H8_    62     1.09578   110.36651   173.37096
   51    48 S   HC   _H9_    63     1.09414   111.61476    54.19460
   52    42 S   CT   _C10    42     1.50963   123.85373    -1.63063
   53    52 S   OM   _O33    43     1.32012   108.12661  -130.45056
   54    52 S   CT   _C9_    44     1.54820   111.69582   -11.11438
   55    54 S   HC   _H12    45     1.10095   111.54196   -79.76975
   56    54 S   HC   _H13    46     1.09921   110.66511   162.93624
   57    52 S   CT   _C13    50     1.53978   109.04080   111.83142
   58    57 S   HC   _H16    51     1.09825   111.90291   179.45968
   59    57 S   HC   _H17    52     1.09900   112.23241    59.04614
   60    57 S   HC   _H18    53     1.09674   111.39644   -60.63917
   61    37 S   CT   _C8_    47     1.55426   104.09374   165.14783
   62    61 S   HC   _H10    48     1.09456   111.54541   164.34347
   63    61 S   HC   _H11    49     1.09723   110.11832    45.62001
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   6   3   2   7   4   5   5   4   3
  12   2   1   1  21  14   5  14   9  11   4   8   3   2   1   4
   2   1   1  11   8   9   5   4   4   2   1   1   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    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    61    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    54    61    62    63    40    41    44    48  
   35    36  
   36  
    0  
   38    39    42    43    52    54    55    56    61    62    63    40    41    44    45    46    47    48    49    50    51  
   39    42    43    52    53    54    61    62    63    57    40    41    44    48  
   42    43    52    61    40  
   41    44    45    46    47    48    49    50    51    42    54    61    62    63  
   44    45    46    47    48    49    50    51    61  
   43    52    53    54    55    56    61    57    58    59    60  
   52    53    54    57  
   45    46    47    48    49    50    51    61  
   46    47    48  
   47    48  
   48  
   49    50    51    61  
   50    51  
   51  
    0  
   53    54    55    56    61    62    63    57    58    59    60  
   54    55    56    61    57    58    59    60  
   55    56    61    62    63    57    58    59    60  
   56    61    62    63    57  
   61    62    63    57  
   58    59    60    61  
   59    60  
   60  
    0  
   62    63  
   63  
    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   0.047500   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   2.9000   0.1400  -0.415000   1.5900   1.4000   0.020110767  -0.896042159
   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   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   54   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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   655.000  1.490
   33    37   320.000  1.410
   37    38   317.000  1.510
   37    61   268.000  1.529
   37    40   268.000  1.529
   38    39   340.000  1.080
   38    42   549.000  1.340
   42    43   340.000  1.080
   42    52   317.000  1.510
   52    53   570.000  1.307
   52    54   268.000  1.529
   52    57   268.000  1.529
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   40    41   340.000  1.090
   40    44   268.000  1.529
   40    48   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   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   110.00000  101.00000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37   100.00000  113.00000
   33    37    38    85.00000  110.90400
   33    37    61    50.00000  109.50000
   33    37    40    50.00000  109.50000
   37    38    39    35.00000  117.00000
   37    38    42    70.00000  124.00000
   37    61    54    58.35000  112.70000
   37    61    62    37.50000  110.70000
   37    61    63    37.50000  110.70000
   37    40    41    37.50000  110.70000
   37    40    44    58.35000  112.70000
   37    40    48    58.35000  112.70000
   38    42    43    35.00000  120.00000
   38    42    52    70.00000  124.00000
   42    38    39    35.00000  120.00000
   42    52    53    85.00000  110.90400
   42    52    54    70.00000  112.02700
   42    52    57    70.00000  112.02700
   52    42    43    35.00000  117.00000
   52    54    55    37.50000  110.70000
   52    54    56    37.50000  110.70000
   52    54    61    58.35000  112.70000
   52    57    58    37.50000  110.70000
   52    57    59    37.50000  110.70000
   52    57    60    37.50000  110.70000
   54    52    53    50.00000  109.50000
   54    61    62    37.50000  110.70000
   54    61    63    37.50000  110.70000
   56    54    55    33.00000  107.80000
   61    37    38    70.00000  112.02700
   61    54    55    37.50000  110.70000
   61    54    56    37.50000  110.70000
   63    61    62    33.00000  107.80000
   57    52    53    50.00000  109.50000
   57    52    54    58.35000  112.70000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   40    37    38    70.00000  112.02700
   40    37    61    58.35000  112.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    47    37.50000  110.70000
   40    48    49    37.50000  110.70000
   40    48    50    37.50000  110.70000
   40    48    51    37.50000  110.70000
   44    40    41    37.50000  110.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   48    40    41    37.50000  110.70000
   48    40    44    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    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   0.00000  1.0 1.0
   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  -2.50000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   0.37500  1.0 3.0
   29    33    37    61   0.37500  1.0 3.0
   29    33    37    40   0.37500  1.0 3.0
   33    37    38    39   0.00000  1.0 1.0
   33    37    38    42   0.39000  1.0 1.0
   33    37    38    42  -0.05800 -1.0 2.0
   33    37    38    42  -0.55150  1.0 3.0
   33    37    61    54   0.62750  1.0 1.0
   33    37    61    54  -0.30950 -1.0 2.0
   33    37    61    54   0.27300  1.0 3.0
   33    37    61    62   0.23400  1.0 3.0
   33    37    61    63   0.23400  1.0 3.0
   33    37    40    41   0.23400  1.0 3.0
   33    37    40    44   0.62750  1.0 1.0
   33    37    40    44  -0.30950 -1.0 2.0
   33    37    40    44   0.27300  1.0 3.0
   33    37    40    48   0.62750  1.0 1.0
   33    37    40    48  -0.30950 -1.0 2.0
   33    37    40    48   0.27300  1.0 3.0
   37    38    42    43   7.00000 -1.0 2.0
   37    38    42    52   7.00000 -1.0 2.0
   37    40    44    45   0.15000  1.0 3.0
   37    40    44    46   0.15000  1.0 3.0
   37    40    44    47   0.15000  1.0 3.0
   37    40    48    49   0.15000  1.0 3.0
   37    40    48    50   0.15000  1.0 3.0
   37    40    48    51   0.15000  1.0 3.0
   38    37    61    54   0.34400  1.0 1.0
   38    37    61    54   0.09450 -1.0 2.0
   38    37    61    54   0.11100  1.0 3.0
   38    37    61    62   0.15000  1.0 3.0
   38    37    61    63   0.15000  1.0 3.0
   38    37    40    41   0.15000  1.0 3.0
   38    37    40    44   0.34400  1.0 1.0
   38    37    40    44   0.09450 -1.0 2.0
   38    37    40    44   0.11100  1.0 3.0
   38    37    40    48   0.34400  1.0 1.0
   38    37    40    48   0.09450 -1.0 2.0
   38    37    40    48   0.11100  1.0 3.0
   38    42    52    53   0.39000  1.0 1.0
   38    42    52    53  -0.05800 -1.0 2.0
   38    42    52    53  -0.55150  1.0 3.0
   38    42   -52    54   0.09850  1.0 1.0
   38    42   -52    54   0.15250 -1.0 2.0
   38    42   -52    54  -0.50650  1.0 3.0
   38    42    52    57   0.09850  1.0 1.0
   38    42    52    57   0.15250 -1.0 2.0
   38    42    52    57  -0.50650  1.0 3.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    52   7.00000 -1.0 2.0
   42    52    54    55   0.15000  1.0 3.0
   42    52    54    56   0.15000  1.0 3.0
   42    52    54    61   0.34400  1.0 1.0
   42    52    54    61   0.09450 -1.0 2.0
   42    52    54    61   0.11100  1.0 3.0
   42    52    57    58   0.15000  1.0 3.0
   42    52    57    59   0.15000  1.0 3.0
   42    52    57    60   0.15000  1.0 3.0
   43    42    52    53   0.00000  1.0 1.0
   43    42    52    54   0.00000  1.0 1.0
   43    42    52    57   0.00000  1.0 1.0
   52    54   -61    37   0.56750  1.0 1.0
   52    54   -61    37  -0.07550 -1.0 2.0
   52    54   -61    37   0.20000  1.0 3.0
   52    54    61    62   0.15000  1.0 3.0
   52    54    61    63   0.15000  1.0 3.0
   53    52    54    55   0.23400  1.0 3.0
   53    52    54    56   0.23400  1.0 3.0
   53    52    54    61   0.62750  1.0 1.0
   53    52    54    61  -0.30950 -1.0 2.0
   53    52    54    61   0.27300  1.0 3.0
   53    52    57    58   0.23400  1.0 3.0
   53    52    57    59   0.23400  1.0 3.0
   53    52    57    60   0.23400  1.0 3.0
   54    52    57    58   0.15000  1.0 3.0
   54    52    57    59   0.15000  1.0 3.0
   54    52    57    60   0.15000  1.0 3.0
   55    54    61    37   0.15000  1.0 3.0
   55    54    61    62   0.15000  1.0 3.0
   55    54    61    63   0.15000  1.0 3.0
   56    54    61    37   0.15000  1.0 3.0
   56    54    61    62   0.15000  1.0 3.0
   56    54    61    63   0.15000  1.0 3.0
   61    37    38    39   0.00000  1.0 1.0
   61    37   -38    42   0.09850  1.0 1.0
   61    37   -38    42   0.15250 -1.0 2.0
   61    37   -38    42  -0.50650  1.0 3.0
   61    37    40    41   0.15000  1.0 3.0
   61    37    40    44   0.56750  1.0 1.0
   61    37    40    44  -0.07550 -1.0 2.0
   61    37    40    44   0.20000  1.0 3.0
   61    37    40    48   0.56750  1.0 1.0
   61    37    40    48  -0.07550 -1.0 2.0
   61    37    40    48   0.20000  1.0 3.0
   57    52    54    55   0.15000  1.0 3.0
   57    52    54    56   0.15000  1.0 3.0
   57    52    54    61   0.56750  1.0 1.0
   57    52    54    61  -0.07550 -1.0 2.0
   57    52    54    61   0.20000  1.0 3.0
   40    37    38    39   0.00000  1.0 1.0
   40    37    38    42   0.09850  1.0 1.0
   40    37    38    42   0.15250 -1.0 2.0
   40    37    38    42  -0.50650  1.0 3.0
   40    37    61    54   0.56750  1.0 1.0
   40    37    61    54  -0.07550 -1.0 2.0
   40    37    61    54   0.20000  1.0 3.0
   40    37    61    62   0.15000  1.0 3.0
   40    37    61    63   0.15000  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    47   0.15000  1.0 3.0
   41    40    48    49   0.15000  1.0 3.0
   41    40    48    50   0.15000  1.0 3.0
   41    40    48    51   0.15000  1.0 3.0
   44    40    48    49   0.15000  1.0 3.0
   44    40    48    50   0.15000  1.0 3.0
   44    40    48    51   0.15000  1.0 3.0
   48    40    44    45   0.15000  1.0 3.0
   48    40    44    46   0.15000  1.0 3.0
   48    40    44    47   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
   37    39    38    42   1.10000 -1.0 2.0
   52    43    42    38   1.10000 -1.0 2.0
END
