* LIGAND DATABASE FILE (OPLS2005)
*
001      72    73    134    199     389
    1     0 S   NP   _N1_     1    28.07606    96.48729   -24.07570
    2     1 S   H    _HN1     2     1.02777   111.32118  -108.30508
    3     1 S   H    _H1_     3     1.02957    76.34158    -3.66805
    4     1 S   H    _H2_     4     1.02835    31.67692   161.96292
    5     1 S   CT   _CA1     5     1.50156   130.43659   101.64120
    6     5 S   HC   _HA1     6     1.09575   105.18057    88.42452
    7     5 S   CO3  _C1_     7     1.53756   112.29068   -31.71675
    8     7 S   O2Z  _O11     8     1.26372   114.97955   -44.53734
    9     7 S   O2Z  _O12     9     1.26221   114.91495   134.33367
   10     5 S   CT   _CB1    10     1.53070   107.39799  -153.70323
   11    10 S   HC   HB11    11     1.09834   109.26823   -50.12174
   12    10 S   HC   HB12    12     1.09814   110.45884    66.40107
   13    10 S   CT   _CG1    13     1.53059   112.74238  -171.15238
   14    13 S   HC   HG11    14     1.09585   110.58214   -66.00690
   15    13 S   HC   HG12    15     1.09660   109.85755    53.24200
   16    13 S   C    _CD1    16     1.51862   112.11740   173.57978
   17    16 S   O    _OE1    17     1.22783   123.21504     4.97847
   18    16 S   N    _N2_    18     1.38576   111.90487  -175.05537
   19    18 S   H    _HN2    19     1.01571   119.14205     3.36290
   20    18 S   CT1  _CA2    20     1.45811   122.63219   177.08819
   21    20 S   HC   _HA2    21     1.09743   108.83200    26.87540
   22    20 S   C    _C2_    22     1.52999   107.07756   -90.07622
   23    22 S   O    _O2_    23     1.22969   123.10415   -26.55862
   24    20 S   CT   _CB2    32     1.53328   112.44606   150.13169
   25    24 S   HC   HB21    33     1.09244   109.76407    55.02418
   26    24 S   HC   HB22    34     1.09416   109.31898   173.60147
   27    22 S   N    _N3_    24     1.38507   112.50554   156.18117
   28    27 S   H    _HN3    25     1.01652   120.34509    -2.19767
   29    24 S   S    _SG2    35     1.82509   110.86409   -66.82250
   30    27 S   CT   _CA3    26     1.45352   122.53880   178.52873
   31    30 S   HC   HA31    27     1.09564   107.85583   -55.10979
   32    30 S   HC   HA32    28     1.09560   107.58112    61.24776
   33    29 S   CT   _C15    36     1.90136   103.01656   170.95258
   34    30 S   CO3  _C3_    29     1.52900   114.27018  -176.99547
   35    34 S   O2Z  _O31    30     1.26344   116.03873     1.15165
   36    34 S   O2Z  _O32    31     1.26433   114.42027  -178.89979
   37    33 S   CM   _C8_    37     1.51243   106.60681   -88.82188
   38    33 S   CT   _C11    58     1.55474   112.35522    38.68015
   39    38 S   HC   _H23    59     1.09505   111.12070   -58.01205
   40    38 S   HC   _H24    60     1.09743   107.92051  -173.21485
   41    37 S   CMA  _C9_    38     1.35313   111.39062   -89.41812
   42    41 S   OM   _O16    39     1.26288   128.30914   178.74820
   43    37 S   CT   _C18    69     1.49789   122.19997    91.23898
   44    43 S   HC   _H36    70     1.09198   111.00802   -65.68188
   45    43 S   HC   _H37    71     1.09473   112.40879   174.53076
   46    43 S   HC   _H38    72     1.09412   110.72525    55.20702
   47    41 S   OS   _O17    40     1.42523   109.41365    -0.31153
   48    33 S   CT   _C14    41     1.56318   105.91044   167.50991
   49    48 S   HC   _H29    42     1.09590   111.53099   -35.66342
   50    48 S   CT   _C13    43     1.55971   120.83567  -164.90193
   51    50 S   HC   _H27    44     1.09894   107.27948   -46.58905
   52    50 S   HC   _H28    45     1.09950   108.60425  -158.76939
   53    50 S   CM   _C6_    46     1.51969   120.29890    77.78767
   54    53 S   CM   _C4_    47     1.35027   122.65684    32.15235
   55    54 S   HC   _H19    48     1.08802   118.89211     7.55328
   56    53 S   CT   _C16    65     1.50761   112.95006  -143.97749
   57    56 S   HC   _H30    66     1.09583   109.64601   -55.26019
   58    56 S   HC   _H31    67     1.09139   113.78621  -174.36647
   59    56 S   HC   _H32    68     1.09461   110.44836    63.78985
   60    54 S   CT   _C10    49     1.51565   126.29335  -159.01717
   61    60 S   HC   _H21    50     1.09617   109.11836  -142.60088
   62    60 S   HC   _H22    51     1.09327   112.11882   -25.47856
   63    60 S   CT   _C12    52     1.55566   110.96787    96.74419
   64    63 S   HC   _H25    53     1.09623   110.06563  -166.68169
   65    63 S   HC   _H26    54     1.09822   108.99643    77.51446
   66    63 S   CM   _C7_    55     1.52170   110.99642   -43.91584
   67    66 S   CM   _C5_    56     1.34921   117.62511    84.77558
   68    67 S   HC   _H20    57     1.08907   117.09019    12.94264
   69    66 S   CT   _C17    61     1.49986   116.30054   -85.83985
   70    69 S   HC   _H33    62     1.09524   109.59165   -65.25926
   71    69 S   HC   _H34    63     1.09365   112.69412   175.63498
   72    69 S   HC   _H35    64     1.09320   111.13829    54.04168
  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
  20   2   1   1  14  13   5   4   9   3   5   2   1   1   6   8
   4  10   4   3  10  12   5   4   2   1   1   8   5   4   9   4
   3   6   5   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    48    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    47    48    49    50    67    38    39    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    47    48    49    50    51    52    53    66    67    68    38    39    40    43    44    45    46  
   35    36  
   36  
    0  
   41    42    47    48    49    50    67    38    39    40    43    44    45    46  
   39    40    69    43    41    47    48    49    50    63    66    67    68  
   40    48    66    67    68  
   48    66    67    68  
   42    47    48    49    50    43    44    45    46  
   47    48    43  
   44    45    46    47    48  
   45    46  
   46  
    0  
   48    49    50    51    52    53  
   49    50    51    52    53    54    67    56  
   50    51    52    53  
   51    52    53    54    55    60    56    57    58    59  
   52    53    54    56  
   53    54    56  
   54    55    60    61    62    63    56    57    58    59  
   55    60    61    62    63    64    65    66    56    57    58    59  
   60    61    62    63    56  
   57    58    59    60  
   58    59  
   59  
    0  
   61    62    63    64    65    66    67    69  
   62    63    64    65    66  
   63    64    65    66  
   64    65    66    67    68    69    70    71    72  
   65    66    67    69  
   66    67    69  
   67    68    69    70    71    72  
   68    69    70    71    72  
   69  
   70    71    72  
   71    72  
   72  
    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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   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   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   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  -0.120000   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   67   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   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   222.000  1.810
   33    37   317.000  1.510
   33    48   268.000  1.529
   33    38   268.000  1.529
   37    41   465.000  1.376
   37    43   317.000  1.510
   41    42   745.000  1.250
   41    47   440.000  1.360
   47    48   320.000  1.410
   48    49   340.000  1.090
   48    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   317.000  1.510
   53    54   549.000  1.340
   53    56   317.000  1.510
   54    55   340.000  1.080
   54    60   317.000  1.510
   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   340.000  1.090
   63    66   317.000  1.510
   66    67   549.000  1.340
   66    69   317.000  1.510
   67    68   340.000  1.080
   67    38   317.000  1.510
   38    39   340.000  1.090
   38    40   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   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    48    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    41    70.00000  124.00000
   33    37    43    65.00000  117.92700
   33    48    47    50.00000  109.50000
   33    48    49    37.50000  110.70000
   33    48    50    58.35000  112.70000
   33    38    67    70.00000  112.02700
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   37    41    42    65.00000  137.10300
   37    41    47    80.00000  120.01400
   37    43    44    35.00000  109.50000
   37    43    45    35.00000  109.50000
   37    43    46    35.00000  109.50000
   41    47    48    90.00000  111.18400
   47    41    42    65.00000  121.00000
   47    48    49    35.00000  109.50000
   47    48    50    50.00000  109.50000
   48    33    37    70.00000  112.02700
   48    50    51    37.50000  110.70000
   48    50    52    37.50000  110.70000
   48    50    53    70.00000  112.02700
   50    48    49    37.50000  110.70000
   50    53    54    70.00000  124.00000
   50    53    56    65.00000  117.92700
   52    50    51    33.00000  107.80000
   53    50    51    35.00000  109.50000
   53    50    52    35.00000  109.50000
   53    54    55    35.00000  120.00000
   53    54    60    70.00000  124.00000
   53    56    57    35.00000  109.50000
   53    56    58    35.00000  109.50000
   53    56    59    35.00000  109.50000
   54    60    61    35.00000  109.50000
   54    60    62    35.00000  109.50000
   54    60    63    70.00000  112.02700
   60    54    55    35.00000  117.00000
   60    63    64    37.50000  110.70000
   60    63    65    37.50000  110.70000
   60    63    66    70.00000  112.02700
   62    60    61    33.00000  107.80000
   63    60    61    37.50000  110.70000
   63    60    62    37.50000  110.70000
   63    66    67    70.00000  124.00000
   63    66    69    65.00000  117.92700
   65    63    64    33.00000  107.80000
   66    63    64    35.00000  109.50000
   66    63    65    35.00000  109.50000
   66    67    68    35.00000  120.00000
   66    67    38    70.00000  124.00000
   66    69    70    35.00000  109.50000
   66    69    71    35.00000  109.50000
   66    69    72    35.00000  109.50000
   67    38    39    35.00000  109.50000
   67    38    40    35.00000  109.50000
   38    33    37    70.00000  112.02700
   38    33    48    58.35000  112.70000
   38    67    68    35.00000  117.00000
   40    38    39    33.00000  107.80000
   69    66    67    70.00000  124.00000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   56    53    54    70.00000  124.00000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   43    37    41    70.00000  124.00000
   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    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   0.21350  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   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    37    43   0.30250  1.0 1.0
   29    33    37    43  -0.14950 -1.0 2.0
   29    33    37    43   0.36900  1.0 3.0
   29    33    48    47   0.56750  1.0 1.0
   29    33    48    47  -0.07550 -1.0 2.0
   29    33    48    47   0.20000  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    50   0.44750  1.0 1.0
   29    33    48    50  -0.17800 -1.0 2.0
   29    33    48    50   0.20200  1.0 3.0
   29    33    38    67   0.56750  1.0 1.0
   29    33    38    67  -0.07550 -1.0 2.0
   29    33    38    67   0.20000  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37   -41    47   7.00000 -1.0 2.0
   33    37    43    44   0.34800  1.0 3.0
   33    37    43    45   0.34800  1.0 3.0
   33    37    43    46   0.34800  1.0 3.0
   33    48    50    51   0.15000  1.0 3.0
   33    48    50    52   0.15000  1.0 3.0
   33    48    50    53   0.34400  1.0 1.0
   33    48    50    53   0.09450 -1.0 2.0
   33    48    50    53   0.11100  1.0 3.0
   37    33   -48    47   0.61850  1.0 1.0
   37    33   -48    47  -0.22750 -1.0 2.0
   37    33   -48    47   0.15300  1.0 3.0
   37    33    48    49   0.15000  1.0 3.0
   37    33    48    50   0.34400  1.0 1.0
   37    33    48    50   0.09450 -1.0 2.0
   37    33    48    50   0.11100  1.0 3.0
   37    33    38    67   0.31000  1.0 1.0
   37    33    38    67   0.14700 -1.0 2.0
   37    33    38    67   0.07550  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    41   -47    48  -2.26850  1.0 1.0
   37    41   -47    48   3.39050 -1.0 2.0
   41    37    43    44   0.00000  1.0 1.0
   41    37    43    45   0.00000  1.0 1.0
   41    37    43    46   0.00000  1.0 1.0
   41    47   -48    33  -0.46850  1.0 1.0
   41    47   -48    33   0.09300 -1.0 2.0
   41    47   -48    33  -0.12850  1.0 3.0
   41    47    48    49   0.08050  1.0 3.0
   41    47    48    50  -0.46850  1.0 1.0
   41    47    48    50   0.09300 -1.0 2.0
   41    47    48    50  -0.12850  1.0 3.0
   42    41    47    48   2.00000 -1.0 2.0
   47    48    50    51   0.23400  1.0 3.0
   47    48    50    52   0.23400  1.0 3.0
   47    48    50    53   0.61850  1.0 1.0
   47    48    50    53  -0.22750 -1.0 2.0
   47    48    50    53   0.15300  1.0 3.0
   48    33   -37    41   0.09850  1.0 1.0
   48    33   -37    41   0.15250 -1.0 2.0
   48    33   -37    41  -0.50650  1.0 3.0
   48    33    37    43   0.46850  1.0 1.0
   48    33    37    43   0.08550 -1.0 2.0
   48    33    37    43   0.09800  1.0 3.0
   48    33    38    67   0.34400  1.0 1.0
   48    33    38    67   0.09450 -1.0 2.0
   48    33    38    67   0.11100  1.0 3.0
   48    33    38    39   0.15000  1.0 3.0
   48    33    38    40   0.15000  1.0 3.0
   48    50    53    54   0.09850  1.0 1.0
   48    50    53    54   0.15250 -1.0 2.0
   48    50    53    54  -0.50650  1.0 3.0
   48    50    53    56   0.46850  1.0 1.0
   48    50    53    56   0.08550 -1.0 2.0
   48    50    53    56   0.09800  1.0 3.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    52   0.15000  1.0 3.0
   49    48    50    53   0.15000  1.0 3.0
   50    53    54    55   7.00000 -1.0 2.0
   50    53    54    60   7.00000 -1.0 2.0
   50    53    56    57   0.34800  1.0 3.0
   50    53    56    58   0.34800  1.0 3.0
   50    53    56    59   0.34800  1.0 3.0
   51    50    53    54   0.00000  1.0 1.0
   51    50    53    56   0.34800  1.0 3.0
   52    50    53    54   0.00000  1.0 1.0
   52    50    53    56   0.34800  1.0 3.0
   53    54    60    61   0.00000  1.0 1.0
   53    54    60    62   0.00000  1.0 1.0
   53    54    60    63   0.09850  1.0 1.0
   53    54    60    63   0.15250 -1.0 2.0
   53    54    60    63  -0.50650  1.0 3.0
   54    53    56    57   0.00000  1.0 1.0
   54    53    56    58   0.00000  1.0 1.0
   54    53    56    59   0.00000  1.0 1.0
   54    60    63    64   0.15000  1.0 3.0
   54    60    63    65   0.15000  1.0 3.0
   54    60    63    66   0.31000  1.0 1.0
   54    60    63    66   0.14700 -1.0 2.0
   54    60    63    66   0.07550  1.0 3.0
   55    54    60    61   0.33100  1.0 3.0
   55    54    60    62   0.33100  1.0 3.0
   55    54    60    63   0.00000  1.0 1.0
   60    63    66    67   0.09850  1.0 1.0
   60    63    66    67   0.15250 -1.0 2.0
   60    63    66    67  -0.50650  1.0 3.0
   60    63    66    69   0.46850  1.0 1.0
   60    63    66    69   0.08550 -1.0 2.0
   60    63    66    69   0.09800  1.0 3.0
   61    60    63    64   0.15000  1.0 3.0
   61    60    63    65   0.15000  1.0 3.0
   61    60    63    66   0.15000  1.0 3.0
   62    60    63    64   0.15000  1.0 3.0
   62    60    63    65   0.15000  1.0 3.0
   62    60    63    66   0.15000  1.0 3.0
   63    66    67    68   7.00000 -1.0 2.0
   63    66    67    38   7.00000 -1.0 2.0
   63    66    69    70   0.34800  1.0 3.0
   63    66    69    71   0.34800  1.0 3.0
   63    66    69    72   0.34800  1.0 3.0
   64    63    66    67   0.00000  1.0 1.0
   64    63    66    69   0.34800  1.0 3.0
   65    63    66    67   0.00000  1.0 1.0
   65    63    66    69   0.34800  1.0 3.0
   66    67    38    33   0.09850  1.0 1.0
   66    67    38    33   0.15250 -1.0 2.0
   66    67    38    33  -0.50650  1.0 3.0
   66    67    38    39   0.00000  1.0 1.0
   66    67    38    40   0.00000  1.0 1.0
   67    66    69    70   0.00000  1.0 1.0
   67    66    69    71   0.00000  1.0 1.0
   67    66    69    72   0.00000  1.0 1.0
   68    67    38    33   0.00000  1.0 1.0
   68    67    38    39   0.33100  1.0 3.0
   68    67    38    40   0.33100  1.0 3.0
   38    33    37    41   0.09850  1.0 1.0
   38    33    37    41   0.15250 -1.0 2.0
   38    33    37    41  -0.50650  1.0 3.0
   38    33    37    43   0.46850  1.0 1.0
   38    33    37    43   0.08550 -1.0 2.0
   38    33    37    43   0.09800  1.0 3.0
   38    33    48    47   0.62750  1.0 1.0
   38    33    48    47  -0.30950 -1.0 2.0
   38    33    48    47   0.27300  1.0 3.0
   38    33    48    49   0.15000  1.0 3.0
   38    33    48    50   0.56750  1.0 1.0
   38    33    48    50  -0.07550 -1.0 2.0
   38    33    48    50   0.20000  1.0 3.0
   69    66    67    68   7.00000 -1.0 2.0
   69    66    67    38   7.00000 -1.0 2.0
   56    53    54    55   7.00000 -1.0 2.0
   56    53    54    60   7.00000 -1.0 2.0
   43    37    41    42   7.00000 -1.0 2.0
   43    37    41    47   7.00000 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    43    37    41   1.10000 -1.0 2.0
   42    47    41    37   1.10000 -1.0 2.0
   50    56    53    54   1.10000 -1.0 2.0
   60    55    54    53   1.10000 -1.0 2.0
   63    69    66    67   1.10000 -1.0 2.0
   38    68    67    66   1.10000 -1.0 2.0
END
