* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    141    214     404
    1     0 S   NP   _N1_     1    29.15028    92.73357   -22.83934
    2     1 S   H    _HN1     2     1.02785   100.42528   -68.76479
    3     1 S   H    _H1_     3     1.02985    97.89737    41.60700
    4     1 S   H    _H2_     4     1.02830    15.09844   169.89791
    5     1 S   CT   _CA1     5     1.50202   125.77710   163.73617
    6     5 S   HC   _HA1     6     1.09572   105.26687    60.37135
    7     5 S   CO3  _C1_     7     1.53781   112.34474   -59.82276
    8     7 S   O2Z  _O11     8     1.26357   115.00691   -42.03457
    9     7 S   O2Z  _O12     9     1.26245   114.92930   137.10437
   10     5 S   CT   _CB1    10     1.53014   107.31659   178.22040
   11    10 S   HC   HB11    11     1.09805   109.12999   -51.07675
   12    10 S   HC   HB12    12     1.09823   110.33145    65.32122
   13    10 S   CT   _CG1    13     1.53069   113.10451  -172.58243
   14    13 S   HC   HG11    14     1.09547   110.12200   -61.95826
   15    13 S   HC   HG12    15     1.09585   110.50905    57.31721
   16    13 S   C    _CD1    16     1.51767   111.29516   176.90775
   17    16 S   O    _OE1    17     1.22799   122.73184   -27.69986
   18    16 S   N    _N2_    18     1.38509   112.46725   153.32004
   19    18 S   H    _HN2    19     1.01567   119.41879     1.82478
   20    18 S   CT1  _CA2    20     1.46133   122.82971  -175.75573
   21    20 S   HC   _HA2    21     1.09594   109.13329   -15.59237
   22    20 S   C    _C2_    22     1.53331   108.74878  -130.99630
   23    22 S   O    _O2_    23     1.23015   122.22099  -147.07749
   24    20 S   CT   _CB2    32     1.53525   111.64927   106.46099
   25    24 S   HC   HB21    33     1.09658   109.48277    63.25777
   26    24 S   HC   HB22    34     1.09568   111.00526  -179.37913
   27    22 S   N    _N3_    24     1.38509   113.34478    40.49251
   28    27 S   H    _HN3    25     1.01532   118.88836    -0.71189
   29    24 S   S    _SG2    35     1.82777   114.38456   -56.14281
   30    27 S   CT   _CA3    26     1.45429   123.34503   174.65727
   31    30 S   HC   HA31    27     1.09531   109.07143    27.38454
   32    30 S   HC   HA32    28     1.09488   107.16453   144.40417
   33    29 S   CT   _C18    36     1.82286    99.87099   -73.09838
   34    33 S   HC   _H3_    37     1.09461   108.34868   -66.17112
   35    33 S   HC   _H4_    38     1.09237   110.34493    50.96057
   36    30 S   CO3  _C3_    29     1.52953   113.24674   -95.94072
   37    36 S   O2Z  _O31    30     1.26392   115.49821   -41.77395
   38    36 S   O2Z  _O32    31     1.26368   114.91514   139.14832
   39    33 S   CM   _C6_    39     1.50107   109.42529   172.02981
   40    39 S   CMA  _C7_    40     1.34953   127.52520    98.72882
   41    40 S   OM   _O16    41     1.26287   128.05317     1.39128
   42    40 S   OS   _O17    42     1.41940   109.64683  -178.52674
   43    42 S   CT   _C13    43     1.44574   106.81063    13.50008
   44    43 S   HC   _H30    44     1.08813   104.71583  -141.95029
   45    39 S   CT   _C12    45     1.50158   120.60407   -82.26352
   46    45 S   HC   _H29    46     1.09484   110.71784    46.79392
   47    43 S   C3T  _C14    63     1.51151   108.80372   100.71562
   48    47 S   HC   _H31    64     1.08348   112.93754   -28.63807
   49    45 S   CT   _C11    47     1.55244   111.68829   -75.44194
   50    49 S   HC   _H27    48     1.09716   109.60520    43.18190
   51    49 S   HC   _H28    49     1.09797   110.08089   -72.75019
   52    69 S   O3T  _O18    65     1.43072   115.73298    23.94014
   53    49 S   CT   _C9_    50     1.54486   114.90541   162.96069
   54    53 S   HC   _H23    51     1.09704   108.66895   -63.63072
   55    53 S   HC   _H24    52     1.09723   109.16188  -178.03367
   56    53 S   CM   _C5_    53     1.51109   113.86548    59.65388
   57    56 S   CM   _C4_    54     1.34606   118.95028   -95.69104
   58    57 S   HC   _H20    55     1.08798   117.82304    -5.25203
   59    56 S   CT   _C16    70     1.50244   115.98396    80.00909
   60    59 S   HC   _H32    71     1.09419   110.81669   -58.62542
   61    59 S   HC   _H33    72     1.09315   112.93428  -179.48376
   62    59 S   HC   _H34    73     1.09511   109.87514    60.94215
   63    57 S   CT   _C8_    56     1.50052   127.28909   164.68749
   64    63 S   HC   _H21    57     1.09600   109.92222    52.20338
   65    63 S   HC   _H22    58     1.09712   108.46559   167.73613
   66    63 S   CT   _C10    59     1.53920   113.02902   -70.81408
   67    66 S   HC   _H25    60     1.09506   110.64135    61.51851
   68    66 S   HC   _H26    61     1.09838   106.77028   174.44826
   69    66 S   C3T  _C15    62     1.51998   116.40217   -64.78672
   70    69 S   CT   _C17    66     1.49963   115.98699  -111.52478
   71    70 S   HC   _H35    67     1.09530   111.93189   176.50997
   72    70 S   HC   _H36    68     1.09491   110.46457    56.37137
   73    70 S   HC   _H37    69     1.09463   110.22221   -63.45242
  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   6   5   4   3
  10   4   3   2   1   1  12   8   3   9  13   7  12   5  12   4
   8   5   4   9  10   4   3  10  12   5   4   2   1   1   7   5
   4   7   3   2   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    45  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    45    46    49  
   35    39    40    45  
   39    40    45  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    49    50    51    53    47  
   41    42    43    44    45    46    49    47  
   42    43    45  
   43    44    45    46    49    69    47    48    52  
   44    45    46    49    50    51    53    66    69    47    48    52    70  
   45    46    49    69    47    48    52  
   46    49    50    51    53    54    55    56    69    47    48    52  
   49    50    51    53    47  
   48    52    70    71    72    73    49    63    66    67    68    69  
   52    70    66    69  
   50    51    53    54    55    56    57    59  
   51    53    54    55    56  
   53    54    55    56  
   70    71    72    73    63    66    67    68    69  
   54    55    56    57    58    63    59    60    61    62  
   55    56    57    59  
   56    57    59  
   57    58    63    64    65    66    59    60    61    62  
   58    63    64    65    66    67    68    69    59    60    61    62  
   63    64    65    66    59  
   60    61    62    63  
   61    62  
   62  
    0  
   64    65    66    67    68    69    70  
   65    66    67    68    69  
   66    67    68    69  
   67    68    69    70    71    72    73  
   68    69    70  
   69    70  
   70    71    72    73  
   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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   2.8500   0.1400  -0.685000   1.7660   1.5600   0.020110767  -0.896042159
   43   3.5000   0.0660   0.186500   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.099700   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.9000   0.1400  -0.352400   1.7660   1.5600   0.020110767  -0.896042159
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   57   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   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   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   317.000  1.510
   39    40   465.000  1.376
   39    45   317.000  1.510
   40    41   745.000  1.250
   40    42   440.000  1.360
   42    43   320.000  1.410
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    47   275.000  1.510
   45    46   340.000  1.090
   45    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   317.000  1.510
   56    57   549.000  1.340
   56    59   317.000  1.510
   57    58   340.000  1.080
   57    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   275.000  1.510
   69    47   260.000  1.509
   69    52   335.000  1.432
   69    70   275.000  1.510
   47    48   340.000  1.088
   47    52   335.000  1.432
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  112.20000
   33    39    40    70.00000  124.00000
   33    39    45    65.00000  117.92700
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    42    80.00000  120.01400
   39    45    43    70.00000  112.02700
   39    45    46    35.00000  109.50000
   39    45    49    70.00000  112.02700
   40    42    43    90.00000  111.18400
   42    40    41    65.00000  121.00000
   42    43    44    35.00000  109.50000
   42    43    45    50.00000  109.50000
   42    43    47    50.00000  109.50000
   43    45    46    37.50000  110.70000
   43    45    49    58.35000  112.70000
   43    47    69    60.00000  120.94000
   43    47    48    40.00000  115.04500
   43    47    52    80.00000  116.47100
   45    39    40    70.00000  124.00000
   45    43    44    37.50000  110.70000
   45    49    50    37.50000  110.70000
   45    49    51    37.50000  110.70000
   45    49    53    58.35000  112.70000
   49    45    46    37.50000  110.70000
   49    53    54    37.50000  110.70000
   49    53    55    37.50000  110.70000
   49    53    56    70.00000  112.02700
   51    49    50    33.00000  107.80000
   53    49    50    37.50000  110.70000
   53    49    51    37.50000  110.70000
   53    56    57    70.00000  124.00000
   53    56    59    65.00000  117.92700
   55    53    54    33.00000  107.80000
   56    53    54    35.00000  109.50000
   56    53    55    35.00000  109.50000
   56    57    58    35.00000  120.00000
   56    57    63    70.00000  124.00000
   56    59    60    35.00000  109.50000
   56    59    61    35.00000  109.50000
   56    59    62    35.00000  109.50000
   57    63    64    35.00000  109.50000
   57    63    65    35.00000  109.50000
   57    63    66    70.00000  112.02700
   63    57    58    35.00000  117.00000
   63    66    67    37.50000  110.70000
   63    66    68    37.50000  110.70000
   63    66    69    70.00000  112.37300
   65    63    64    33.00000  107.80000
   66    63    64    37.50000  110.70000
   66    63    65    37.50000  110.70000
   66    69    47    60.00000  120.94000
   66    69    52    80.00000  116.47100
   66    69    70    58.35000  112.70000
   68    66    67    33.00000  107.80000
   69    66    67    45.00000  109.38400
   69    66    68    45.00000  109.38400
   69    47    48    37.50000  117.20000
   69    47    52    15.00000   60.43100
   69    52    47    15.00000   59.14900
   69    70    71    45.00000  109.38400
   69    70    72    45.00000  109.38400
   69    70    73    45.00000  109.38400
   47    43    44    45.00000  109.38400
   47    43    45    70.00000  112.37300
   52    69    47    15.00000   60.43100
   52    47    48    50.00000  114.27700
   70    69    47    60.00000  120.94000
   70    69    52    80.00000  116.47100
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   59    56    57    70.00000  124.00000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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    39    40   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    45   0.30250  1.0 1.0
   29    33    39    45  -0.14950 -1.0 2.0
   29    33    39    45   0.36900  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    42   7.00000 -1.0 2.0
   33    39    45    43   0.46850  1.0 1.0
   33    39    45    43   0.08550 -1.0 2.0
   33    39    45    43   0.09800  1.0 3.0
   33    39    45    46   0.34800  1.0 3.0
   33    39    45    49   0.46850  1.0 1.0
   33    39    45    49   0.08550 -1.0 2.0
   33    39    45    49   0.09800  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    45   0.34800  1.0 3.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    45   0.34800  1.0 3.0
   39    40   -42    43  -2.26850  1.0 1.0
   39    40   -42    43   3.39050 -1.0 2.0
   39    45    49    50   0.15000  1.0 3.0
   39    45    49    51   0.15000  1.0 3.0
   39    45    49    53   0.34400  1.0 1.0
   39    45    49    53   0.09450 -1.0 2.0
   39    45    49    53   0.11100  1.0 3.0
   40    39   -45    43   0.09850  1.0 1.0
   40    39   -45    43   0.15250 -1.0 2.0
   40    39   -45    43  -0.50650  1.0 3.0
   40    39    45    46   0.00000  1.0 1.0
   40    39    45    49   0.09850  1.0 1.0
   40    39    45    49   0.15250 -1.0 2.0
   40    39    45    49  -0.50650  1.0 3.0
   40    42    43    44   0.08050  1.0 3.0
   40    42   -43    45  -0.46850  1.0 1.0
   40    42   -43    45   0.09300 -1.0 2.0
   40    42   -43    45  -0.12850  1.0 3.0
   40    42    43    47  -0.46850  1.0 1.0
   40    42    43    47   0.09300 -1.0 2.0
   40    42    43    47  -0.12850  1.0 3.0
   41    40    42    43   2.00000 -1.0 2.0
   42    43   -45    39   0.61850  1.0 1.0
   42    43   -45    39  -0.22750 -1.0 2.0
   42    43   -45    39   0.15300  1.0 3.0
   42    43    45    46   0.23400  1.0 3.0
   42    43    45    49   0.62750  1.0 1.0
   42    43    45    49  -0.30950 -1.0 2.0
   42    43    45    49   0.27300  1.0 3.0
   42    43    47    69  -0.26800  1.0 1.0
   42    43    47    69   0.69150 -1.0 2.0
   42    43    47    69  -0.48750  1.0 3.0
   42    43    47    48   0.23400  1.0 3.0
   42    43    47    52   1.11900  1.0 1.0
   42    43    47    52  -1.16350 -1.0 2.0
   42    43    47    52  -0.34150  1.0 3.0
   43    45    49    50   0.15000  1.0 3.0
   43    45    49    51   0.15000  1.0 3.0
   43    45    49    53   0.56750  1.0 1.0
   43    45    49    53  -0.07550 -1.0 2.0
   43    45    49    53   0.20000  1.0 3.0
   43    47   -52    69   0.06250  1.0 1.0
   43    47   -52    69  -0.01100 -1.0 2.0
   43    47   -52    69   0.28050  1.0 3.0
   44    43    45    39   0.15000  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    49   0.15000  1.0 3.0
   44    43    47    69   0.15000  1.0 3.0
   44    43    47    48   0.15000  1.0 3.0
   44    43    47    52   0.23400  1.0 3.0
   45    39    40    41   7.00000 -1.0 2.0
   45    39   -40    42   7.00000 -1.0 2.0
   45    43    47    69   0.07850  1.0 1.0
   45    43    47    69  -0.03950 -1.0 2.0
   45    43    47    69   0.67350  1.0 3.0
   45    43    47    48   0.15000  1.0 3.0
   45    43    47    52   0.02550  1.0 1.0
   45    43    47    52  -0.02600 -1.0 2.0
   45    43    47    52   1.20400  1.0 3.0
   45    49    53    54   0.15000  1.0 3.0
   45    49    53    55   0.15000  1.0 3.0
   45    49    53    56   0.34400  1.0 1.0
   45    49    53    56   0.09450 -1.0 2.0
   45    49    53    56   0.11100  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    51   0.15000  1.0 3.0
   46    45    49    53   0.15000  1.0 3.0
   49    53    56    57   0.09850  1.0 1.0
   49    53    56    57   0.15250 -1.0 2.0
   49    53    56    57  -0.50650  1.0 3.0
   49    53    56    59   0.46850  1.0 1.0
   49    53    56    59   0.08550 -1.0 2.0
   49    53    56    59   0.09800  1.0 3.0
   50    49    53    54   0.15000  1.0 3.0
   50    49    53    55   0.15000  1.0 3.0
   50    49    53    56   0.15000  1.0 3.0
   51    49    53    54   0.15000  1.0 3.0
   51    49    53    55   0.15000  1.0 3.0
   51    49    53    56   0.15000  1.0 3.0
   53    56    57    58   7.00000 -1.0 2.0
   53    56    57    63   7.00000 -1.0 2.0
   53    56    59    60   0.34800  1.0 3.0
   53    56    59    61   0.34800  1.0 3.0
   53    56    59    62   0.34800  1.0 3.0
   54    53    56    57   0.00000  1.0 1.0
   54    53    56    59   0.34800  1.0 3.0
   55    53    56    57   0.00000  1.0 1.0
   55    53    56    59   0.34800  1.0 3.0
   56    57    63    64   0.00000  1.0 1.0
   56    57    63    65   0.00000  1.0 1.0
   56    57    63    66   0.09850  1.0 1.0
   56    57    63    66   0.15250 -1.0 2.0
   56    57    63    66  -0.50650  1.0 3.0
   57    56    59    60   0.00000  1.0 1.0
   57    56    59    61   0.00000  1.0 1.0
   57    56    59    62   0.00000  1.0 1.0
   57    63    66    67   0.15000  1.0 3.0
   57    63    66    68   0.15000  1.0 3.0
   57    63    66    69   0.34400  1.0 1.0
   57    63    66    69   0.09450 -1.0 2.0
   57    63    66    69   0.11100  1.0 3.0
   58    57    63    64   0.33100  1.0 3.0
   58    57    63    65   0.33100  1.0 3.0
   58    57    63    66   0.00000  1.0 1.0
   63    66    69    47   0.07850  1.0 1.0
   63    66    69    47  -0.03950 -1.0 2.0
   63    66    69    47   0.67350  1.0 3.0
   63    66    69    52   0.02550  1.0 1.0
   63    66    69    52  -0.02600 -1.0 2.0
   63    66    69    52   1.20400  1.0 3.0
   63    66    69    70   0.56750  1.0 1.0
   63    66    69    70  -0.07550 -1.0 2.0
   63    66    69    70   0.20000  1.0 3.0
   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
   66    69    47    43   0.56750  1.0 1.0
   66    69    47    43  -0.07550 -1.0 2.0
   66    69    47    43   0.20000  1.0 3.0
   66    69    47    48   0.15000  1.0 3.0
   66    69   -47    52   0.02550  1.0 1.0
   66    69   -47    52  -0.02600 -1.0 2.0
   66    69   -47    52   1.20400  1.0 3.0
   66    69   -52    47   0.06250  1.0 1.0
   66    69   -52    47  -0.01100 -1.0 2.0
   66    69   -52    47   0.28050  1.0 3.0
   66    69    70    71   0.15000  1.0 3.0
   66    69    70    72   0.15000  1.0 3.0
   66    69    70    73   0.15000  1.0 3.0
   67    66    69    47   0.15000  1.0 3.0
   67    66    69    52   0.23400  1.0 3.0
   67    66    69    70   0.15000  1.0 3.0
   68    66    69    47   0.15000  1.0 3.0
   68    66    69    52   0.23400  1.0 3.0
   68    66    69    70   0.15000  1.0 3.0
   47    43    45    39   0.34400  1.0 1.0
   47    43    45    39   0.09450 -1.0 2.0
   47    43    45    39   0.11100  1.0 3.0
   47    43    45    46   0.15000  1.0 3.0
   47    43    45    49   0.47050  1.0 1.0
   47    43    45    49   0.03900 -1.0 2.0
   47    43    45    49   0.20100  1.0 3.0
   47    69    70    71   0.15000  1.0 3.0
   47    69    70    72   0.15000  1.0 3.0
   47    69    70    73   0.15000  1.0 3.0
   48    47   -52    69   0.36800  1.0 3.0
   52    69   -47    43   0.02550  1.0 1.0
   52    69   -47    43  -0.02600 -1.0 2.0
   52    69   -47    43   1.20400  1.0 3.0
   52    69   -47    48   0.23400  1.0 3.0
   52    69    70    71   0.23400  1.0 3.0
   52    69    70    72   0.23400  1.0 3.0
   52    69    70    73   0.23400  1.0 3.0
   70    69    47    43   0.56750  1.0 1.0
   70    69    47    43  -0.07550 -1.0 2.0
   70    69    47    43   0.20000  1.0 3.0
   70    69    47    48   0.15000  1.0 3.0
   70    69   -47    52   0.02550  1.0 1.0
   70    69   -47    52  -0.02600 -1.0 2.0
   70    69   -47    52   1.20400  1.0 3.0
   70    69   -52    47   0.06250  1.0 1.0
   70    69   -52    47  -0.01100 -1.0 2.0
   70    69   -52    47   0.28050  1.0 3.0
   59    56    57    58   7.00000 -1.0 2.0
   59    56    57    63   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
   38    30    36    37  10.50000 -1.0 2.0
   33    45    39    40   1.10000 -1.0 2.0
   41    42    40    39   1.10000 -1.0 2.0
   53    59    56    57   1.10000 -1.0 2.0
   63    58    57    56   1.10000 -1.0 2.0
END
