* LIGAND DATABASE FILE (OPLS2005)
*
001      73    76    145    236     423
    1     0 S   NP   _N1_     1    28.68306    95.87039   -23.84037
    2     1 S   H    _HN1     2     1.02827    31.58051   164.66277
    3     1 S   H    _H1_     3     1.02793   109.56780  -102.81163
    4     1 S   H    _H2_     4     1.02948    76.96105     2.31638
    5     1 S   CT   _CA1     5     1.50124   131.93534   108.18485
    6     5 S   HC   _HA1     6     1.09574   105.16641    87.10741
    7     5 S   CO3  _C1_     7     1.53773   112.44046   -33.10160
    8     7 S   O2Z  _O11     8     1.26375   115.00800   -43.05984
    9     7 S   O2Z  _O12     9     1.26235   114.94302   135.94579
   10     5 S   CT   _CB1    10     1.53060   107.40322  -154.93560
   11    10 S   HC   HB11    11     1.09840   109.33812   -49.43231
   12    10 S   HC   HB12    12     1.09810   110.47668    67.16473
   13    10 S   CT   _CG1    13     1.53015   112.63075  -170.36736
   14    13 S   HC   HG11    14     1.09571   110.71282   -66.97618
   15    13 S   HC   HG12    15     1.09670   109.71320    52.26937
   16    13 S   C    _CD1    16     1.51813   112.02329   172.74380
   17    16 S   O    _OE1    17     1.22755   123.18815    11.36105
   18    16 S   N    _N2_    18     1.38638   111.80909  -168.61952
   19    18 S   H    _HN2    19     1.01576   119.03948     1.04829
   20    18 S   CT1  _CA2    20     1.46220   123.40820   176.95972
   21    20 S   HC   _HA2    21     1.09745   109.23138     8.18748
   22    20 S   C    _C2_    22     1.53708   109.11478  -107.34022
   23    22 S   O    _O2_    23     1.23096   122.20902  -150.45309
   24    20 S   CT   _CB2    32     1.53369   111.61894   130.07792
   25    24 S   HC   HB21    33     1.09517   109.79102    56.36974
   26    24 S   HC   HB22    34     1.09332   109.93112   174.86977
   27    22 S   N    _N3_    24     1.38300   113.95292    37.10672
   28    27 S   H    _HN3    25     1.01535   119.60546    -3.32013
   29    24 S   S    _SG2    35     1.82932   111.32620   -64.22340
   30    27 S   CT   _CA3    26     1.45278   123.28616   177.15862
   31    30 S   HC   HA31    27     1.09547   107.52105   -64.64553
   32    30 S   HC   HA32    28     1.09556   107.98875    51.81172
   33    29 S   CT   _C15    36     1.90050   100.75511  -162.42563
   34    30 S   CO3  _C3_    29     1.52973   114.04241   173.81572
   35    34 S   O2Z  _O31    30     1.26384   116.07986    -0.11703
   36    34 S   O2Z  _O32    31     1.26424   114.41788   179.94065
   37    33 S   C3T  _C12    37     1.53467   102.98433  -170.02610
   38    37 S   HC   _H30    38     1.07833   118.21358    82.61355
   39    33 S   CT   _C18    70     1.59691   110.16801   -53.75341
   40    39 S   OM   _O16    71     1.32984   111.80820   -53.46030
   41    39 S   HC   _H37    72     1.09050   105.36192  -178.79813
   42    39 S   HC   _H38    73     1.09722   106.37785    73.98426
   43    37 S   C3T  _C11    39     1.48027   110.90489  -132.42048
   44    43 S   HC   _H29    40     1.07744   122.15117  -144.04207
   45    43 S   CT   _C14    41     1.50463   112.42673     4.73623
   46    37 S   O3T  _O19    69     1.43534   117.29265   -67.52169
   47    45 S   CT   _C8_    42     1.54580   112.46401  -119.88117
   48    47 S   HC   _H26    43     1.09574   112.56946   -65.03037
   49    33 S   CT   _C13    52     1.66371   114.09056    79.12725
   50    45 S   OH   _O20    67     1.43268   105.83679   124.16293
   51    50 S   HO   _H39    68     0.97243   108.17332    52.92379
   52    47 S   CO4  _C4_    44     1.50886   109.97980    57.63088
   53    52 S   O    _O17    45     1.21966   126.51117   -89.23028
   54    49 S   CT   _C17    53     1.56458   111.31644    10.79011
   55    54 S   HC   _H34    54     1.09484   112.40847    55.72780
   56    54 S   HC   _H35    55     1.09408   111.99731   -66.80866
   57    54 S   HC   _H36    56     1.09736   111.05758   175.49463
   58    52 S   OS   _O18    46     1.37321   108.23423    89.41108
   59    58 S   CT   _C10    47     1.43716   108.12949     0.79229
   60    59 S   HC   _H28    48     1.09525   107.87040   148.22585
   61    59 S   CT   _C7_    49     1.53600   110.35092   -91.05550
   62    61 S   HC   _H24    50     1.09627   106.51896  -173.03725
   63    61 S   HC   _H25    51     1.09129   109.06435   -62.04894
   64    47 S   CT   _C9_    57     1.53766   114.92476   167.43571
   65    64 S   HC   _H27    58     1.10411   106.77328  -179.88986
   66    64 S   CM   _C6_    59     1.51460   122.37837    60.86269
   67    66 S   CM   _C5_    60     1.34308   123.11919    29.56579
   68    67 S   HC   _H22    61     1.08545   121.43005   176.76517
   69    67 S   HC   _H23    62     1.08352   122.09261    -1.42106
   70    66 S   CT   _C16    63     1.50660   117.26504  -157.87302
   71    70 S   HC   _H31    64     1.09510   110.24308   -49.15242
   72    70 S   HC   _H32    65     1.09239   111.30770    71.52664
   73    70 S   HC   _H33    66     1.09568   112.13511  -168.41969
  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  13   5   4   3
  21   2   1   1  14   6   9   3   2   1  12   5  20   3  16   9
  14   5   1   8   3   7   3   2   1   8   9   6   5   2   1   9
   3   7   6   2   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    49    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    45    61    49    54    46    39    40    41    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    43    44    45    47    59    61    62    63    49    54    55    56    57    50    46    39    40    41    42  
   35    36  
   36  
    0  
   38    43    44    45    47    61    49    54    50    46    39    40    41    42  
   43    44    45    49    46    39  
   40    41    42    43    45    46    49    54    61  
   41    42    49  
   42    49  
   49  
   44    45    47    48    52    61    49    54    64    50    51    46  
   45    47    49    50    46  
   47    48    52    53    58    59    61    62    63    49    54    55    56    57    64    65    66    50    51    46  
   47    49    50  
   48    52    53    58    59    60    61    49    54    64    65    66    67    70    50    51  
   52    53    58    59    49    64    65    66    50  
   54    55    56    57    64    50    51    52    58    59    60    61    62    63  
   51    52    54    61    64  
    0  
   53    58    59    60    61    64    65    66  
   58    59    64  
   55    56    57    59    61    62    63  
   56    57    61  
   57    61  
   61  
   59    60    61    62    63    64    65    66  
   60    61    62    63    64    65    66    67    70  
   61    62    63    64    65    66  
   62    63    64    65    66  
   63    64  
   64  
   65    66    67    68    69    70    71    72    73  
   66    67    70  
   67    68    69    70    71    72    73  
   68    69    70    71    72    73  
   69    70  
   70  
   71    72    73  
   72    73  
   73  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   4.2000   0.3000  -0.140000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   41   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   47   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   49   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   54   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   59   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.4200   0.0150   0.030000   1.3810   1.2100   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
   64   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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
   73   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   275.000  1.510
   33    49   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.088
   37    43   260.000  1.509
   37    46   335.000  1.432
   43    44   340.000  1.088
   43    45   275.000  1.510
   43    46   335.000  1.432
   45    47   268.000  1.529
   45    49   268.000  1.529
   45    50   320.000  1.410
   47    48   340.000  1.090
   47    52   317.000  1.522
   47    64   268.000  1.529
   52    53   570.000  1.229
   52    58   214.000  1.327
   58    59   320.000  1.410
   59    60   340.000  1.090
   59    61   268.000  1.529
   59    64   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    49   268.000  1.529
   49    54   268.000  1.529
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   64    65   340.000  1.090
   64    66   317.000  1.510
   66    67   549.000  1.340
   66    70   317.000  1.510
   67    68   340.000  1.080
   67    69   340.000  1.080
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   50    51   553.000  0.945
   39    40   570.000  1.307
   39    41   340.000  1.090
   39    42   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  111.63000
   29    33    49    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    40.00000  115.04500
   33    37    43    60.00000  120.94000
   33    37    46    80.00000  116.47100
   33    49    45    58.35000  112.70000
   33    49    61    58.35000  112.70000
   33    49    54    58.35000  112.70000
   33    39    40    50.00000  109.50000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   37    43    44    37.50000  117.20000
   37    43    45    60.00000  120.94000
   37    43    46    15.00000   60.43100
   37    46    43    15.00000   59.14900
   43    37    38    37.50000  117.20000
   43    45    47    70.00000  112.37300
   43    45    49    70.00000  112.37300
   43    45    50    50.00000  109.50000
   45    43    44    40.00000  115.04500
   45    47    48    37.50000  110.70000
   45    47    52    63.00000  111.10000
   45    47    64    58.35000  112.70000
   45    49    61    58.35000  112.70000
   45    49    54    58.35000  112.70000
   45    50    51    55.00000  108.50000
   47    52    53    80.00000  120.40000
   47    52    58    81.00000  111.40000
   47    64    59    58.35000  112.70000
   47    64    65    37.50000  110.70000
   47    64    66    70.00000  112.02700
   52    47    48    35.00000  109.50000
   52    58    59    83.00000  116.90000
   58    52    53    83.00000  123.40000
   58    59    60    35.00000  109.50000
   58    59    61    50.00000  109.50000
   58    59    64    50.00000  109.50000
   59    61    62    37.50000  110.70000
   59    61    63    37.50000  110.70000
   59    61    49    58.35000  112.70000
   59    64    65    37.50000  110.70000
   59    64    66    70.00000  112.02700
   61    59    60    37.50000  110.70000
   61    49    54    58.35000  112.70000
   63    61    62    33.00000  107.80000
   49    33    37    70.00000  112.37300
   49    45    47    58.35000  112.70000
   49    61    62    37.50000  110.70000
   49    61    63    37.50000  110.70000
   49    54    55    37.50000  110.70000
   49    54    56    37.50000  110.70000
   49    54    57    37.50000  110.70000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   64    47    48    37.50000  110.70000
   64    47    52    63.00000  111.10000
   64    59    60    37.50000  110.70000
   64    59    61    58.35000  112.70000
   64    66    67    70.00000  124.00000
   64    66    70    65.00000  117.92700
   66    64    65    35.00000  109.50000
   66    67    68    35.00000  120.00000
   66    67    69    35.00000  120.00000
   66    70    71    35.00000  109.50000
   66    70    72    35.00000  109.50000
   66    70    73    35.00000  109.50000
   69    67    68    35.00000  117.00000
   70    66    67    70.00000  124.00000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   50    45    47    50.00000  109.50000
   50    45    49    50.00000  109.50000
   46    37    38    50.00000  114.27700
   46    37    43    15.00000   60.43100
   46    43    44    50.00000  114.27700
   46    43    45    80.00000  116.47100
   39    33    37    70.00000  112.37300
   39    33    49    58.35000  112.70000
   41    39    40    45.00000  125.66300
   42    39    40    45.00000  125.66300
   42    39    41    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  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    37    38   0.15000  1.0 3.0
   29    33    37    43   0.44750  1.0 1.0
   29    33    37    43  -0.17800 -1.0 2.0
   29    33    37    43   0.20200  1.0 3.0
   29    33    37    46   0.56750  1.0 1.0
   29    33    37    46  -0.07550 -1.0 2.0
   29    33    37    46   0.20000  1.0 3.0
   29    33    49    45   0.44750  1.0 1.0
   29    33    49    45  -0.17800 -1.0 2.0
   29    33    49    45   0.20200  1.0 3.0
   29    33    49    61   0.44750  1.0 1.0
   29    33    49    61  -0.17800 -1.0 2.0
   29    33    49    61   0.20200  1.0 3.0
   29    33    49    54   0.44750  1.0 1.0
   29    33    49    54  -0.17800 -1.0 2.0
   29    33    49    54   0.20200  1.0 3.0
   29    33    39    40   0.56750  1.0 1.0
   29    33    39    40  -0.07550 -1.0 2.0
   29    33    39    40   0.20000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.15000  1.0 3.0
   33    37    43    44   0.15000  1.0 3.0
   33    37   -43    45   0.56750  1.0 1.0
   33    37   -43    45  -0.07550 -1.0 2.0
   33    37   -43    45   0.20000  1.0 3.0
   33    37   -43    46   0.02550  1.0 1.0
   33    37   -43    46  -0.02600 -1.0 2.0
   33    37   -43    46   1.20400  1.0 3.0
   33    37   -46    43   0.06250  1.0 1.0
   33    37   -46    43  -0.01100 -1.0 2.0
   33    37   -46    43   0.28050  1.0 3.0
   33    49    54    55   0.15000  1.0 3.0
   33    49    54    56   0.15000  1.0 3.0
   33    49    54    57   0.15000  1.0 3.0
   37    33   -49    45   0.47050  1.0 1.0
   37    33   -49    45   0.03900 -1.0 2.0
   37    33   -49    45   0.20100  1.0 3.0
   37    33    49    61   0.47050  1.0 1.0
   37    33    49    61   0.03900 -1.0 2.0
   37    33    49    61   0.20100  1.0 3.0
   37    33    49    54   0.47050  1.0 1.0
   37    33    49    54   0.03900 -1.0 2.0
   37    33    49    54   0.20100  1.0 3.0
   37    33    39    40  -0.26800  1.0 1.0
   37    33    39    40   0.69150 -1.0 2.0
   37    33    39    40  -0.48750  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    42   0.15000  1.0 3.0
   37    43    45    47   0.07850  1.0 1.0
   37    43    45    47  -0.03950 -1.0 2.0
   37    43    45    47   0.67350  1.0 3.0
   37    43   -45    49   0.07850  1.0 1.0
   37    43   -45    49  -0.03950 -1.0 2.0
   37    43   -45    49   0.67350  1.0 3.0
   37    43    45    50   0.86500  1.0 1.0
   37    43    45    50  -0.17500 -1.0 2.0
   37    43    45    50   0.20800  1.0 3.0
   38    37    43    44   0.15000  1.0 3.0
   38    37    43    45   0.15000  1.0 3.0
   38    37   -43    46   0.23400  1.0 3.0
   38    37   -46    43   0.36800  1.0 3.0
   43    45    47    48   0.15000  1.0 3.0
   43    45    47    52  -0.95700  1.0 1.0
   43    45    47    52  -0.18200 -1.0 2.0
   43    45    47    52   0.29450  1.0 3.0
   43    45    47    64   0.47050  1.0 1.0
   43    45    47    64   0.03900 -1.0 2.0
   43    45    47    64   0.20100  1.0 3.0
   43    45   -49    33   0.47050  1.0 1.0
   43    45   -49    33   0.03900 -1.0 2.0
   43    45   -49    33   0.20100  1.0 3.0
   43    45    49    61   0.47050  1.0 1.0
   43    45    49    61   0.03900 -1.0 2.0
   43    45    49    61   0.20100  1.0 3.0
   43    45    49    54   0.47050  1.0 1.0
   43    45    49    54   0.03900 -1.0 2.0
   43    45    49    54   0.20100  1.0 3.0
   43    45    50    51  -0.11600  1.0 1.0
   43    45    50    51  -0.09450 -1.0 2.0
   43    45    50    51   0.21250  1.0 3.0
   44    43    45    47   0.15000  1.0 3.0
   44    43    45    49   0.15000  1.0 3.0
   44    43    45    50   0.23400  1.0 3.0
   44    43   -46    37   0.36800  1.0 3.0
   45    43   -46    37   0.06250  1.0 1.0
   45    43   -46    37  -0.01100 -1.0 2.0
   45    43   -46    37   0.28050  1.0 3.0
   45    47    52    53   0.30150 -1.0 2.0
   45    47    52    58   0.36750  1.0 3.0
   45    47    64    59   0.56750  1.0 1.0
   45    47    64    59  -0.07550 -1.0 2.0
   45    47    64    59   0.20000  1.0 3.0
   45    47    64    65   0.15000  1.0 3.0
   45    47    64    66   0.34400  1.0 1.0
   45    47    64    66   0.09450 -1.0 2.0
   45    47    64    66   0.11100  1.0 3.0
   45    49    54    55   0.15000  1.0 3.0
   45    49    54    56   0.15000  1.0 3.0
   45    49    54    57   0.15000  1.0 3.0
   47    45    49    33   0.56750  1.0 1.0
   47    45    49    33  -0.07550 -1.0 2.0
   47    45    49    33   0.20000  1.0 3.0
   47    45    49    61   0.56750  1.0 1.0
   47    45    49    61  -0.07550 -1.0 2.0
   47    45    49    61   0.20000  1.0 3.0
   47    45    49    54   0.56750  1.0 1.0
   47    45    49    54  -0.07550 -1.0 2.0
   47    45    49    54   0.20000  1.0 3.0
   47    45    50    51  -0.11600  1.0 1.0
   47    45    50    51  -0.09450 -1.0 2.0
   47    45    50    51   0.21250  1.0 3.0
   47    52   -58    59   1.63150  1.0 1.0
   47    52   -58    59   2.92000 -1.0 2.0
   47    64    66    67   0.09850  1.0 1.0
   47    64    66    67   0.15250 -1.0 2.0
   47    64    66    67  -0.50650  1.0 3.0
   47    64    66    70   0.46850  1.0 1.0
   47    64    66    70   0.08550 -1.0 2.0
   47    64    66    70   0.09800  1.0 3.0
   48    47    52    53   0.00000  1.0 1.0
   48    47    52    58   0.00000  1.0 1.0
   48    47    64    59   0.15000  1.0 3.0
   48    47    64    65   0.15000  1.0 3.0
   48    47    64    66   0.15000  1.0 3.0
   52    47   -64    59  -0.95700  1.0 1.0
   52    47   -64    59  -0.18200 -1.0 2.0
   52    47   -64    59   0.29450  1.0 3.0
   52    47    64    65  -0.11250  1.0 3.0
   52    47    64    66  -0.98800  1.0 1.0
   52    47    64    66   0.48800 -1.0 2.0
   52    47    64    66   0.76800  1.0 3.0
   52    58    59    60   0.08050  1.0 3.0
   52    58    59    61  -0.25900  1.0 1.0
   52    58    59    61  -0.47000 -1.0 2.0
   52    58    59    61   0.11750  1.0 3.0
   52    58   -59    64  -0.25900  1.0 1.0
   52    58   -59    64  -0.47000 -1.0 2.0
   52    58   -59    64   0.11750  1.0 3.0
   53    52    58    59   3.00000 -1.0 2.0
   58    59    61    62   0.23400  1.0 3.0
   58    59    61    63   0.23400  1.0 3.0
   58    59    61    49   0.62750  1.0 1.0
   58    59    61    49  -0.30950 -1.0 2.0
   58    59    61    49   0.27300  1.0 3.0
   58    59   -64    47   0.62750  1.0 1.0
   58    59   -64    47  -0.30950 -1.0 2.0
   58    59   -64    47   0.27300  1.0 3.0
   58    59    64    65   0.23400  1.0 3.0
   58    59    64    66   0.61850  1.0 1.0
   58    59    64    66  -0.22750 -1.0 2.0
   58    59    64    66   0.15300  1.0 3.0
   59    61    49    33   0.56750  1.0 1.0
   59    61    49    33  -0.07550 -1.0 2.0
   59    61    49    33   0.20000  1.0 3.0
   59    61   -49    45   0.56750  1.0 1.0
   59    61   -49    45  -0.07550 -1.0 2.0
   59    61   -49    45   0.20000  1.0 3.0
   59    61    49    54   0.56750  1.0 1.0
   59    61    49    54  -0.07550 -1.0 2.0
   59    61    49    54   0.20000  1.0 3.0
   59    64    66    67   0.09850  1.0 1.0
   59    64    66    67   0.15250 -1.0 2.0
   59    64    66    67  -0.50650  1.0 3.0
   59    64    66    70   0.46850  1.0 1.0
   59    64    66    70   0.08550 -1.0 2.0
   59    64    66    70   0.09800  1.0 3.0
   60    59    61    62   0.15000  1.0 3.0
   60    59    61    63   0.15000  1.0 3.0
   60    59    61    49   0.15000  1.0 3.0
   60    59    64    47   0.15000  1.0 3.0
   60    59    64    65   0.15000  1.0 3.0
   60    59    64    66   0.15000  1.0 3.0
   61    59   -64    47   0.56750  1.0 1.0
   61    59   -64    47  -0.07550 -1.0 2.0
   61    59   -64    47   0.20000  1.0 3.0
   61    59    64    65   0.15000  1.0 3.0
   61    59    64    66   0.34400  1.0 1.0
   61    59    64    66   0.09450 -1.0 2.0
   61    59    64    66   0.11100  1.0 3.0
   61    49    54    55   0.15000  1.0 3.0
   61    49    54    56   0.15000  1.0 3.0
   61    49    54    57   0.15000  1.0 3.0
   62    61    49    33   0.15000  1.0 3.0
   62    61    49    45   0.15000  1.0 3.0
   62    61    49    54   0.15000  1.0 3.0
   63    61    49    33   0.15000  1.0 3.0
   63    61    49    45   0.15000  1.0 3.0
   63    61    49    54   0.15000  1.0 3.0
   49    33    37    38   0.15000  1.0 3.0
   49    33   -37    43   0.07850  1.0 1.0
   49    33   -37    43  -0.03950 -1.0 2.0
   49    33   -37    43   0.67350  1.0 3.0
   49    33    37    46   0.02550  1.0 1.0
   49    33    37    46  -0.02600 -1.0 2.0
   49    33    37    46   1.20400  1.0 3.0
   49    33    39    40   0.62750  1.0 1.0
   49    33    39    40  -0.30950 -1.0 2.0
   49    33    39    40   0.27300  1.0 3.0
   49    33    39    41   0.15000  1.0 3.0
   49    33    39    42   0.15000  1.0 3.0
   49    45    47    48   0.15000  1.0 3.0
   49    45    47    52  -0.95700  1.0 1.0
   49    45    47    52  -0.18200 -1.0 2.0
   49    45    47    52   0.29450  1.0 3.0
   49    45    47    64   0.56750  1.0 1.0
   49    45    47    64  -0.07550 -1.0 2.0
   49    45    47    64   0.20000  1.0 3.0
   49    45    50    51  -0.11600  1.0 1.0
   49    45    50    51  -0.09450 -1.0 2.0
   49    45    50    51   0.21250  1.0 3.0
   64    47    52    53   0.30150 -1.0 2.0
   64    47   -52    58   0.36750  1.0 3.0
   64    59    61    62   0.15000  1.0 3.0
   64    59    61    63   0.15000  1.0 3.0
   64    59   -61    49   0.56750  1.0 1.0
   64    59   -61    49  -0.07550 -1.0 2.0
   64    59   -61    49   0.20000  1.0 3.0
   64    66    67    68   7.00000 -1.0 2.0
   64    66    67    69   7.00000 -1.0 2.0
   64    66    70    71   0.34800  1.0 3.0
   64    66    70    72   0.34800  1.0 3.0
   64    66    70    73   0.34800  1.0 3.0
   65    64    66    67   0.00000  1.0 1.0
   65    64    66    70   0.34800  1.0 3.0
   67    66    70    71   0.00000  1.0 1.0
   67    66    70    72   0.00000  1.0 1.0
   67    66    70    73   0.00000  1.0 1.0
   70    66    67    68   7.00000 -1.0 2.0
   70    66    67    69   7.00000 -1.0 2.0
   50    45    47    48   0.23400  1.0 3.0
   50    45    47    52  -0.09450  1.0 1.0
   50    45    47    52  -1.12950 -1.0 2.0
   50    45    47    52   0.54000  1.0 3.0
   50    45    47    64   0.86500  1.0 1.0
   50    45    47    64  -0.17500 -1.0 2.0
   50    45    47    64   0.20800  1.0 3.0
   50    45    49    33   0.86500  1.0 1.0
   50    45    49    33  -0.17500 -1.0 2.0
   50    45    49    33   0.20800  1.0 3.0
   50    45    49    61   0.86500  1.0 1.0
   50    45    49    61  -0.17500 -1.0 2.0
   50    45    49    61   0.20800  1.0 3.0
   50    45    49    54   0.86500  1.0 1.0
   50    45    49    54  -0.17500 -1.0 2.0
   50    45    49    54   0.20800  1.0 3.0
   46    37   -43    44   0.23400  1.0 3.0
   46    37   -43    45   0.02550  1.0 1.0
   46    37   -43    45  -0.02600 -1.0 2.0
   46    37   -43    45   1.20400  1.0 3.0
   46    43    45    47   0.02550  1.0 1.0
   46    43    45    47  -0.02600 -1.0 2.0
   46    43    45    47   1.20400  1.0 3.0
   46    43   -45    49   0.02550  1.0 1.0
   46    43   -45    49  -0.02600 -1.0 2.0
   46    43   -45    49   1.20400  1.0 3.0
   46    43    45    50   3.69350  1.0 1.0
   46    43    45    50  -1.82950 -1.0 2.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    43   0.07850  1.0 1.0
   39    33    37    43  -0.03950 -1.0 2.0
   39    33    37    43   0.67350  1.0 3.0
   39    33    37    46   0.02550  1.0 1.0
   39    33    37    46  -0.02600 -1.0 2.0
   39    33    37    46   1.20400  1.0 3.0
   39    33    49    45   0.56750  1.0 1.0
   39    33    49    45  -0.07550 -1.0 2.0
   39    33    49    45   0.20000  1.0 3.0
   39    33    49    61   0.56750  1.0 1.0
   39    33    49    61  -0.07550 -1.0 2.0
   39    33    49    61   0.20000  1.0 3.0
   39    33    49    54   0.56750  1.0 1.0
   39    33    49    54  -0.07550 -1.0 2.0
   39    33    49    54   0.20000  1.0 3.0
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
   47    58    52    53  10.50000 -1.0 2.0
   64    70    66    67  15.00000 -1.0 2.0
   68    69    67    66  15.00000 -1.0 2.0
END
