* LIGAND DATABASE FILE (OPLS2005)
*
001      69    69    119    170     339
    1     0 S   NP   _N1_     1    28.92475    96.60401   -20.75798
    2     1 S   H    _HN1     2     1.02829    45.30472   159.44681
    3     1 S   H    _H1_     3     1.02778    86.37272   -80.81394
    4     1 S   H    _H2_     4     1.02955    77.09924    28.96908
    5     1 S   CT   _CA1     5     1.50126   154.94137   139.69581
    6     5 S   HC   _HA1     6     1.09568   105.21392    74.06748
    7     5 S   CO3  _C1_     7     1.53819   112.48100   -46.15623
    8     7 S   O2Z  _O11     8     1.26373   115.02187   -40.07805
    9     7 S   O2Z  _O12     9     1.26237   115.01561   139.25773
   10     5 S   CT   _CB1    10     1.53122   107.42019  -167.88065
   11    10 S   HC   HB11    11     1.09820   109.44945   -48.99014
   12    10 S   HC   HB12    12     1.09820   110.38016    67.65595
   13    10 S   CT   _CG1    13     1.52954   112.61773  -170.02679
   14    13 S   HC   HG11    14     1.09571   110.46754   -63.19513
   15    13 S   HC   HG12    15     1.09660   109.97027    55.96236
   16    13 S   C    _CD1    16     1.51819   112.44979   176.32225
   17    16 S   O    _OE1    17     1.22699   123.39474    -2.79736
   18    16 S   N    _N2_    18     1.38583   111.43315   177.33010
   19    18 S   H    _HN2    19     1.01564   118.77884     1.43258
   20    18 S   CT1  _CA2    20     1.46259   123.65966  -179.86012
   21    20 S   HC   _HA2    21     1.09702   109.41597    -8.26370
   22    20 S   C    _C2_    22     1.53446   108.88349  -124.27764
   23    22 S   O    _O2_    23     1.23057   122.20204  -152.52336
   24    20 S   CT   _CB2    32     1.53313   111.05396   113.94759
   25    24 S   HC   HB21    33     1.09552   109.32685    55.94456
   26    24 S   HC   HB22    34     1.09502   110.91309   174.51023
   27    22 S   N    _N3_    24     1.38257   113.78418    34.51278
   28    27 S   H    _HN3    25     1.01636   119.49223    -2.80896
   29    24 S   S    _SG2    35     1.82912   111.61498   -65.70092
   30    27 S   CT   _CA3    26     1.45267   123.11051   177.95598
   31    30 S   HC   HA31    27     1.09546   107.52043   -64.96707
   32    30 S   HC   HA32    28     1.09567   107.95905    51.46583
   33    29 S   CT   _C18    36     1.83867    99.64204   146.01212
   34    33 S   HC   _H3_    37     1.09636   107.32776   -48.20929
   35    30 S   CO3  _C3_    29     1.52922   114.10745   173.45471
   36    35 S   O2Z  _O31    30     1.26367   116.05152     0.16669
   37    35 S   O2Z  _O32    31     1.26427   114.41280  -179.78150
   38    33 S   C5A  _C9_    38     1.49136   109.89090    70.55280
   39    33 S   CT   _C17    60     1.53499   110.22904  -166.21963
   40    39 S   HC   _H33    61     1.09812   110.98038   -59.54175
   41    39 S   HC   _H34    62     1.09777   110.61772  -177.11805
   42    38 S   C5BC _C7_    39     1.37982   134.20341    78.47667
   43    42 S   HA   _H22    40     1.08087   126.29084     0.44850
   44    39 S   CO4  _C13    63     1.51239   113.78403    62.26593
   45    44 S   O    _O17    64     1.22465   123.42555  -126.86169
   46    42 S   C5BC _C6_    41     1.41478   106.44863  -179.22368
   47    46 S   HA   _H21    42     1.08113   127.25619   179.78420
   48    44 S   OS   _O19    65     1.36257   110.69408    54.83870
   49    46 S   C5A  _C8_    43     1.38029   106.64194     0.29074
   50    48 S   CT   _C15    66     1.43104   115.20801  -178.92662
   51    50 S   HC   _H28    67     1.09320   108.12201   173.79945
   52    50 S   HC   _H29    68     1.09409   110.43721    55.07149
   53    50 S   HC   _H30    69     1.09390   110.03859   -67.45728
   54    38 S   OA   _O18    44     1.36468   115.96799  -100.73201
   55    49 S   CO4  _C12    45     1.44007   131.08456   179.35715
   56    55 S   O    _O16    46     1.22594   123.58864     1.77762
   57    55 S   CZ   _C5_    47     1.44904   118.98590  -177.95254
   58    57 S   CZ   _C4_    48     1.20110   179.61285   134.32118
   59    58 S   CM   _C10    49     1.41993   179.31529    64.33668
   60    59 S   HC   _H23    50     1.08622   117.15517    18.18637
   61    59 S   CM   _C11    51     1.34053   124.07929  -161.89680
   62    61 S   HC   _H24    52     1.08908   117.19093   179.80021
   63    61 S   CT   _C16    53     1.50247   127.39841     0.41825
   64    63 S   HC   _H31    54     1.09471   112.02958     5.87276
   65    63 S   HC   _H32    55     1.09619   108.47594   123.31717
   66    63 S   CT   _C14    56     1.52081   111.10546  -116.53590
   67    66 S   HC   _H25    57     1.09528   111.35021   -57.37328
   68    66 S   HC   _H26    58     1.09346   110.23353  -176.96520
   69    66 S   HC   _H27    59     1.09524   111.10762    63.32499
  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   9   5   4   3
  13   7   2   1   1  11   8   4   3   6   4   6   2   6   3   4
   5   3   2   1   1   3   4   2   4   5   7   3   8   4   6   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    54    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    46    49    54    39    40    41    44    45    48  
   38    42    54    39    40    41    44  
   36    37  
   37  
    0  
   42    43    46    47    49    54    55    39    40    41    44  
   40    41    44    45    48    50    42    54  
   41    44    45    48  
   44    45    48  
   43    46    47    49    54    55  
   46    47    49    54  
   45    48    50    51    52    53  
   48    50  
   47    49    54    55    56    57  
   49    54    55  
   50    51    52    53  
   54    55    56    57    58  
   51    52    53  
   52    53  
   53  
    0  
   55    56    57  
   56    57    58    59  
   57    58  
   58    59    60    61  
   59    60    61    62    63  
   60    61    62    63    64    65    66  
   61    62    63  
   62    63    64    65    66    67    68    69  
   63    64    65    66  
   64    65    66    67    68    69  
   65    66    67    68    69  
   66    67    68    69  
   67    68    69  
   68    69  
   69  
    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   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700   0.008000   2.0020   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   44   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   47   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   48   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   49   3.5500   0.0700   0.008000   2.0020   1.7750   0.001000000  -0.843144165
   50   3.5000   0.0660   0.160000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   52   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   53   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   54   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   55   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   57   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   58   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   59   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   295.000  1.489
   33    39   268.000  1.529
   38    42   546.000  1.367
   38    54   340.000  1.360
   42    43   367.000  1.080
   42    46   469.000  1.424
   46    47   367.000  1.080
   46    49   546.000  1.367
   49    54   340.000  1.360
   49    55   335.000  1.450
   55    56   570.000  1.229
   55    57   335.000  1.469
   57    58   985.000  1.221
   58    59   400.000  1.423
   59    60   340.000  1.080
   59    61   549.000  1.340
   61    62   340.000  1.080
   61    63   317.000  1.510
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   317.000  1.522
   44    45   570.000  1.229
   44    48   214.000  1.327
   48    50   320.000  1.410
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    42    50.00000  133.50000
   33    38    54    80.00000  116.10000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    44    63.00000  111.10000
   38    33    34    45.00000  110.47400
   38    42    43    35.00000  125.70000
   38    42    46    70.00000  107.30000
   38    54    49    70.00000  106.50000
   42    46    47    35.00000  127.50000
   42    46    49    70.00000  107.30000
   46    42    43    35.00000  127.50000
   46    49    54    70.00000  110.60000
   46    49    55    55.00000  130.80000
   49    46    47    35.00000  125.70000
   49    55    56    80.00000  122.40000
   49    55    57    65.00000  113.97000
   54    38    42    70.00000  110.60000
   55    49    54    80.00000  119.06000
   55    57    58    30.00000  178.16600
   57    55    56    80.00000  120.41200
   57    58    59    30.00000  178.29000
   58    59    60    40.00000  117.14900
   58    59    61    65.00000  121.28400
   59    61    62    35.00000  120.00000
   59    61    63    70.00000  124.00000
   61    59    60    35.00000  120.00000
   61    63    64    35.00000  109.50000
   61    63    65    35.00000  109.50000
   61    63    66    70.00000  112.02700
   63    61    62    35.00000  117.00000
   63    66    67    37.50000  110.70000
   63    66    68    37.50000  110.70000
   63    66    69    37.50000  110.70000
   65    63    64    33.00000  107.80000
   66    63    64    37.50000  110.70000
   66    63    65    37.50000  110.70000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  113.44400
   39    44    45    80.00000  120.40000
   39    44    48    81.00000  111.40000
   41    39    40    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    41    35.00000  109.50000
   44    48    50    83.00000  116.90000
   48    44    45    83.00000  123.40000
   48    50    51    35.00000  109.50000
   48    50    52    35.00000  109.50000
   48    50    53    35.00000  109.50000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    42  -0.16000  1.0 1.0
   29    33    38    42  -0.03200 -1.0 2.0
   29    33    38    42   0.04500  1.0 3.0
   29    33    38    54   0.04300 -1.0 2.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    42    43   3.62500 -1.0 2.0
   33    38    42    46   3.62500 -1.0 2.0
   33    38    54    49   3.62500 -1.0 2.0
   33    39    44    45   0.30150 -1.0 2.0
   33    39    44    48   0.36750  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    54   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    44  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    41   0.43200  1.0 3.0
   38    33    39    44   0.56750  1.0 1.0
   38    33    39    44  -0.07550 -1.0 2.0
   38    33    39    44   0.20000  1.0 3.0
   38    42    46    47   3.62500 -1.0 2.0
   38    42   -46    49   3.62500 -1.0 2.0
   42    38   -54    49   3.62500 -1.0 2.0
   42    46   -49    54   3.62500 -1.0 2.0
   42    46    49    55   3.62500 -1.0 2.0
   43    42    46    47   3.62500 -1.0 2.0
   43    42    46    49   3.62500 -1.0 2.0
   46    49   -54    38   3.62500 -1.0 2.0
   46    49    55    56   1.05000 -1.0 2.0
   46    49    55    57   0.56600 -1.0 2.0
   47    46    49    54   3.62500 -1.0 2.0
   47    46    49    55   3.62500 -1.0 2.0
   49    55    57    58   0.00000  1.0 1.0
   54    38    42    43   3.62500 -1.0 2.0
   54    38   -42    46   3.62500 -1.0 2.0
   54    49    55    56   1.05000 -1.0 2.0
   54    49    55    57   0.56600 -1.0 2.0
   55    49    54    38   3.62500 -1.0 2.0
   55    57    58    59   0.00000  1.0 1.0
   56    55    57    58   0.00000  1.0 1.0
   57    58    59    60   0.00000  1.0 1.0
   57    58    59    61   0.00000  1.0 1.0
   58    59    61    62   7.00000 -1.0 2.0
   58    59    61    63   7.00000 -1.0 2.0
   59    61    63    64   0.00000  1.0 1.0
   59    61    63    65   0.00000  1.0 1.0
   59    61    63    66   0.09850  1.0 1.0
   59    61    63    66   0.15250 -1.0 2.0
   59    61    63    66  -0.50650  1.0 3.0
   60    59    61    62   7.00000 -1.0 2.0
   60    59    61    63   7.00000 -1.0 2.0
   61    63    66    67   0.15000  1.0 3.0
   61    63    66    68   0.15000  1.0 3.0
   61    63    66    69   0.15000  1.0 3.0
   62    61    63    64   0.33100  1.0 3.0
   62    61    63    65   0.33100  1.0 3.0
   62    61    63    66   0.00000  1.0 1.0
   64    63    66    67   0.15000  1.0 3.0
   64    63    66    68   0.15000  1.0 3.0
   64    63    66    69   0.15000  1.0 3.0
   65    63    66    67   0.15000  1.0 3.0
   65    63    66    68   0.15000  1.0 3.0
   65    63    66    69   0.15000  1.0 3.0
   39    33    38    42   0.04150 -1.0 2.0
   39    33    38    54   0.38650  1.0 1.0
   39    33    38    54  -0.24750 -1.0 2.0
   39    33    38    54   0.76750  1.0 3.0
   39    44    48    50   1.63150  1.0 1.0
   39    44    48    50   2.92000 -1.0 2.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    48   0.00000  1.0 1.0
   41    39    44    45   0.00000  1.0 1.0
   41    39    44    48   0.00000  1.0 1.0
   44    48    50    51   0.08050  1.0 3.0
   44    48    50    52   0.08050  1.0 3.0
   44    48    50    53   0.08050  1.0 3.0
   45    44    48    50   3.00000 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    35    36  10.50000 -1.0 2.0
   42    54    38    33   4.00000 -1.0 2.0
   46    43    42    38   1.10000 -1.0 2.0
   49    47    46    42   1.10000 -1.0 2.0
   55    54    49    46   4.00000 -1.0 2.0
   49    57    55    56  10.50000 -1.0 2.0
   58    60    59    61  15.00000 -1.0 2.0
   63    62    61    59  15.00000 -1.0 2.0
   39    48    44    45  10.50000 -1.0 2.0
END
