* LIGAND DATABASE FILE (OPLS2005)
*
001      61    62    113    177     335
    1     0 S   NP   _N1_     1    28.73227    93.92118   -21.19623
    2     1 S   H    _HN1     2     1.02779    90.10446   -71.71046
    3     1 S   H    _H1_     3     1.02961    96.18974    36.72548
    4     1 S   H    _H2_     4     1.02838    25.78014   153.69177
    5     1 S   CT   _CA1     5     1.50106   136.17611   165.03425
    6     5 S   HC   _HA1     6     1.09568   105.28272    53.94769
    7     5 S   CO3  _C1_     7     1.53838   112.32617   -66.40249
    8     7 S   O2Z  _O11     8     1.26361   115.01748   -44.73918
    9     7 S   O2Z  _O12     9     1.26234   114.93652   134.52114
   10     5 S   CT   _CB1    10     1.53098   107.44809   171.96168
   11    10 S   HC   HB11    11     1.09817   109.49573   -49.76969
   12    10 S   HC   HB12    12     1.09830   110.35690    66.82753
   13    10 S   CT   _CG1    13     1.53007   112.62174  -170.88307
   14    13 S   HC   HG11    14     1.09512   110.36694   -59.07954
   15    13 S   HC   HG12    15     1.09626   110.15957    59.97096
   16    13 S   C    _CD1    16     1.51796   112.08918  -179.93147
   17    16 S   O    _OE1    17     1.22737   123.10806   -14.48219
   18    16 S   N    _N2_    18     1.38592   111.79312   166.39450
   19    18 S   H    _HN2    19     1.01591   119.04719     0.90244
   20    18 S   CT1  _CA2    20     1.46219   123.38878  -179.03146
   21    20 S   HC   _HA2    21     1.09738   109.36767   -14.52542
   22    20 S   C    _C2_    22     1.53422   108.20720  -130.15229
   23    22 S   O    _O2_    23     1.23009   122.28216  -145.19338
   24    20 S   CT   _CB2    32     1.53555   111.45523   107.66364
   25    24 S   HC   HB21    33     1.09364   109.50222    55.09160
   26    24 S   HC   HB22    34     1.09464   109.95469   173.51656
   27    22 S   N    _N3_    24     1.38520   113.32493    42.15328
   28    27 S   H    _HN3    25     1.01528   118.93238    -0.49575
   29    24 S   S    _SG2    35     1.83000   111.48096   -67.37507
   30    27 S   CT   _CA3    26     1.45450   123.39245   175.06120
   31    30 S   HC   HA31    27     1.09527   109.16453    25.66939
   32    30 S   HC   HA32    28     1.09493   107.13534   142.67374
   33    29 S   CT   _C12    36     1.88111   102.08781   161.66366
   34    30 S   CO3  _C3_    29     1.52937   113.18437   -97.75011
   35    34 S   O2Z  _O31    30     1.26397   115.44232   -43.26605
   36    34 S   O2Z  _O32    31     1.26360   114.95377   137.66760
   37    33 S   CM   _C5_    37     1.51476   105.22680   167.21463
   38    37 S   CM   _C4_    38     1.34282   120.80248    99.98859
   39    38 S   HC   _H16    39     1.08475   123.22079   179.20328
   40    37 S   CO4  _C6_    53     1.48188   121.82049   -82.38387
   41    40 S   O    _O33    54     1.22717   122.28701   169.64071
   42    38 S   NE   _N11    40     1.36829   124.56759    -0.32746
   43    42 S   H    _H27    41     1.01566   117.12723  -176.24871
   44    40 S   OS   _O14    55     1.35583   116.94857   -11.54832
   45    42 S   CT   _C11    42     1.45324   124.20775    -1.40165
   46    45 S   HC   _H23    43     1.09831   107.24992   139.75164
   47    44 S   CT   _C9_    56     1.44192   124.84054     5.22315
   48    47 S   HC   _H20    57     1.09539   106.89599  -145.70637
   49    47 S   HC   _H21    58     1.09410   107.89343    99.94296
   50    33 S   CT   _C10    44     1.57375   109.26422   -72.94035
   51    50 S   HC   _H22    45     1.09665   110.53142    46.41139
   52    45 S   CT   _C13    49     1.52617   109.50820  -105.38097
   53    52 S   HC   _H24    50     1.09286   112.75998    52.42663
   54    52 S   HC   _H25    51     1.09625   110.00771   -66.05102
   55    52 S   HC   _H26    52     1.09417   110.98229   174.94282
   56    33 S   CT   _C8_    59     1.53855   110.89809    51.96575
   57    56 S   HC   _H18    60     1.09541   112.13307   -64.37082
   58    56 S   HC   _H19    61     1.09838   109.54425   178.17137
   59    50 S   CO4  _C7_    46     1.52445   111.07399   161.88827
   60    59 S   O    _O13    47     1.22766   123.14549  -112.21621
   61    59 S   HC   _H17    48     1.10398   116.30652    66.60660
  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
  21   2   1   1  15  11   4   8   2  10   4   6  11   7   6   4
   3  11   5   4   2   1   1   3   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    50    56    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    45    50    51    59    40    47    56    57    58  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    45    46    50    51    59    60    61    52    40    41    44    47    48    49    56    57    58  
   35    36  
   36  
    0  
   38    39    42    43    45    50    51    59    40    41    44    47    56    57    58  
   39    42    43    45    46    50    52    40    41    44    56  
   42    43    45    40  
   41    44    47    48    49    56    42    50  
   44    47  
   43    45    46    50    51    59    52    53    54    55  
   45    46    50    52  
   47    48    49    56    57    58  
   46    50    51    59    60    61    52    53    54    55    56  
   50    51    59    52    53    54    55  
   48    49    56    57    58    50  
   49    56    57    58  
   56    57    58  
   51    59    60    61    52    53    54    55    56    57    58  
   59    60    61    52    56  
   53    54    55    59  
   54    55  
   55  
    0  
   57    58    59  
   58  
    0  
   60    61  
   61  
    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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760  -0.097000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.2500   0.1700  -0.607000   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   44   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   45   3.5000   0.0660   0.175300   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   49   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   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   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   61   2.4200   0.0150   0.000000   1.3810   1.2100   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    50   268.000  1.529
   33    56   268.000  1.529
   37    38   549.000  1.340
   37    40   320.000  1.462
   38    39   340.000  1.080
   38    42   425.000  1.378
   42    43   434.000  1.010
   42    45   382.000  1.448
   45    46   340.000  1.090
   45    50   268.000  1.529
   45    52   268.000  1.529
   50    51   340.000  1.090
   50    59   317.000  1.522
   59    60   570.000  1.229
   59    61   340.000  1.090
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
   40    41   570.000  1.229
   40    44   214.000  1.327
   44    47   320.000  1.410
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    56   268.000  1.529
   56    57   340.000  1.090
   56    58   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    50    75.00000  111.63000
   29    33    56    75.00000  111.63000
   33    37    38    70.00000  124.00000
   33    37    40    65.00000  116.34900
   33    50    45    58.35000  112.70000
   33    50    51    37.50000  110.70000
   33    50    59    63.00000  111.10000
   33    56    47    58.35000  112.70000
   33    56    57    37.50000  110.70000
   33    56    58    37.50000  110.70000
   37    38    39    35.00000  120.00000
   37    38    42    70.00000  124.03900
   37    40    41    80.00000  123.72100
   37    40    44    90.00000  111.29400
   38    42    43    35.00000  114.50000
   38    42    45    50.00000  121.00000
   42    38    39    50.00000  112.30800
   42    45    46    35.00000  109.50000
   42    45    50    80.00000  111.61500
   42    45    52    80.00000  111.61500
   45    42    43    35.00000  112.50000
   45    50    51    37.50000  110.70000
   45    50    59    63.00000  111.10000
   45    52    53    37.50000  110.70000
   45    52    54    37.50000  110.70000
   45    52    55    37.50000  110.70000
   50    33    37    70.00000  112.02700
   50    45    46    37.50000  110.70000
   50    59    60    80.00000  120.40000
   50    59    61    35.00000  115.00000
   59    50    51    35.00000  109.50000
   61    59    60    35.00000  123.00000
   52    45    46    37.50000  110.70000
   52    45    50    58.35000  112.70000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
   40    37    38    65.00000  118.96000
   40    44    47    83.00000  116.90000
   44    40    41    83.00000  123.40000
   44    47    48    35.00000  109.50000
   44    47    49    35.00000  109.50000
   44    47    56    50.00000  109.50000
   47    56    57    37.50000  110.70000
   47    56    58    37.50000  110.70000
   49    47    48    33.00000  107.80000
   56    33    37    70.00000  112.02700
   56    33    50    58.35000  112.70000
   56    47    48    37.50000  110.70000
   56    47    49    37.50000  110.70000
   58    56    57    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    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   0.21350  1.0 3.0
   24    29    33    56   0.01700  1.0 1.0
   24    29    33    56  -0.23550 -1.0 2.0
   24    29    33    56   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   0.42700  1.0 1.0
   29    33    37    38  -0.70350 -1.0 2.0
   29    33    37    38  -0.43150  1.0 3.0
   29    33    37    40   0.09700  1.0 1.0
   29    33    37    40   0.15600 -1.0 2.0
   29    33    37    40  -0.50800  1.0 3.0
   29    33    50    45   0.44750  1.0 1.0
   29    33    50    45  -0.17800 -1.0 2.0
   29    33    50    45   0.20200  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    59   0.56750  1.0 1.0
   29    33    50    59  -0.07550 -1.0 2.0
   29    33    50    59   0.20000  1.0 3.0
   29    33    56    47   0.44750  1.0 1.0
   29    33    56    47  -0.17800 -1.0 2.0
   29    33    56    47   0.20200  1.0 3.0
   29    33    56    57   0.15000  1.0 3.0
   29    33    56    58   0.15000  1.0 3.0
   33    37    38    39   7.00000 -1.0 2.0
   33    37    38    42   7.00000 -1.0 2.0
   33    37    40    41  -0.64400  1.0 1.0
   33    37    40    41   0.26850 -1.0 2.0
   33    37    40    44  -0.15000  1.0 1.0
   33    37    40    44   0.89550 -1.0 2.0
   33    37    40    44  -0.06900  1.0 3.0
   33    50    59    60   0.30150 -1.0 2.0
   33    50    59    61   0.74550  1.0 1.0
   33    50    59    61  -0.00500 -1.0 2.0
   37    33    50    45   0.34400  1.0 1.0
   37    33    50    45   0.09450 -1.0 2.0
   37    33    50    45   0.11100  1.0 3.0
   37    33    50    51   0.15000  1.0 3.0
   37    33    50    59  -0.98800  1.0 1.0
   37    33    50    59   0.48800 -1.0 2.0
   37    33    50    59   0.76800  1.0 3.0
   37    33    56    47   0.34400  1.0 1.0
   37    33    56    47   0.09450 -1.0 2.0
   37    33    56    47   0.11100  1.0 3.0
   37    33    56    57   0.15000  1.0 3.0
   37    33    56    58   0.15000  1.0 3.0
   37    38    42    43   1.00000 -1.0 2.0
   37    38   -42    45  -0.54700  1.0 1.0
   37    38   -42    45   1.23000 -1.0 2.0
   37    40   -44    47   2.00000 -1.0 2.0
   38    37    40    41   1.00000 -1.0 2.0
   38    37    40    44  -0.56150  1.0 1.0
   38    37    40    44   2.19150 -1.0 2.0
   38    42    45    46   0.00000  1.0 1.0
   38    42    45    50   0.25450  1.0 1.0
   38    42    45    50  -0.61700 -1.0 2.0
   38    42    45    50  -0.23550  1.0 3.0
   38    42    45    52   0.25450  1.0 1.0
   38    42    45    52  -0.61700 -1.0 2.0
   38    42    45    52  -0.23550  1.0 3.0
   39    38    42    43   1.00000 -1.0 2.0
   39    38    42    45   0.00000  1.0 1.0
   42    45   -50    33   1.26750  1.0 1.0
   42    45   -50    33  -0.00950 -1.0 2.0
   42    45   -50    33   0.30600  1.0 3.0
   42    45    50    51   0.22950  1.0 3.0
   42    45    50    59  -2.10200  1.0 1.0
   42    45    50    59  -0.31600 -1.0 2.0
   42    45    50    59   0.13050  1.0 3.0
   42    45    52    53   0.22950  1.0 3.0
   42    45    52    54   0.22950  1.0 3.0
   42    45    52    55   0.22950  1.0 3.0
   43    42    45    46   0.00000  1.0 1.0
   43    42    45    50   0.00000  1.0 1.0
   43    42    45    52   0.00000  1.0 1.0
   45    50    59    60   0.30150 -1.0 2.0
   45    50    59    61   0.74550  1.0 1.0
   45    50    59    61  -0.00500 -1.0 2.0
   46    45    50    33   0.15000  1.0 3.0
   46    45    50    51   0.15000  1.0 3.0
   46    45    50    59  -0.11250  1.0 3.0
   46    45    52    53   0.15000  1.0 3.0
   46    45    52    54   0.15000  1.0 3.0
   46    45    52    55   0.15000  1.0 3.0
   50    33   -37    38   0.09850  1.0 1.0
   50    33   -37    38   0.15250 -1.0 2.0
   50    33   -37    38  -0.50650  1.0 3.0
   50    33    37    40   0.09700  1.0 1.0
   50    33    37    40   0.15600 -1.0 2.0
   50    33    37    40  -0.50800  1.0 3.0
   50    33    56    47   0.56750  1.0 1.0
   50    33    56    47  -0.07550 -1.0 2.0
   50    33    56    47   0.20000  1.0 3.0
   50    33    56    57   0.15000  1.0 3.0
   50    33    56    58   0.15000  1.0 3.0
   50    45    52    53   0.15000  1.0 3.0
   50    45    52    54   0.15000  1.0 3.0
   50    45    52    55   0.15000  1.0 3.0
   51    50    59    60   0.00000  1.0 1.0
   51    50    59    61   0.00000  1.0 1.0
   52    45    50    33   0.56750  1.0 1.0
   52    45    50    33  -0.07550 -1.0 2.0
   52    45    50    33   0.20000  1.0 3.0
   52    45    50    51   0.15000  1.0 3.0
   52    45    50    59  -0.95700  1.0 1.0
   52    45    50    59  -0.18200 -1.0 2.0
   52    45    50    59   0.29450  1.0 3.0
   40    37    38    39   7.00000 -1.0 2.0
   40    37    38    42   7.00000 -1.0 2.0
   40    44    47    48   0.08050  1.0 3.0
   40    44    47    49   0.08050  1.0 3.0
   40    44    47    56  -0.25900  1.0 1.0
   40    44    47    56  -0.47000 -1.0 2.0
   40    44    47    56   0.11750  1.0 3.0
   41    40    44    47   3.00000 -1.0 2.0
   44    47   -56    33   0.62750  1.0 1.0
   44    47   -56    33  -0.30950 -1.0 2.0
   44    47   -56    33   0.27300  1.0 3.0
   44    47    56    57   0.23400  1.0 3.0
   44    47    56    58   0.23400  1.0 3.0
   48    47    56    33   0.15000  1.0 3.0
   48    47    56    57   0.15000  1.0 3.0
   48    47    56    58   0.15000  1.0 3.0
   49    47    56    33   0.15000  1.0 3.0
   49    47    56    57   0.15000  1.0 3.0
   49    47    56    58   0.15000  1.0 3.0
   56    33    37    38   0.09850  1.0 1.0
   56    33    37    38   0.15250 -1.0 2.0
   56    33    37    38  -0.50650  1.0 3.0
   56    33   -37    40   0.09700  1.0 1.0
   56    33   -37    40   0.15600 -1.0 2.0
   56    33   -37    40  -0.50800  1.0 3.0
   56    33    50    45   0.56750  1.0 1.0
   56    33    50    45  -0.07550 -1.0 2.0
   56    33    50    45   0.20000  1.0 3.0
   56    33    50    51   0.15000  1.0 3.0
   56    33    50    59  -0.95700  1.0 1.0
   56    33    50    59  -0.18200 -1.0 2.0
   56    33    50    59   0.29450  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
   33    40    37    38   1.10000 -1.0 2.0
   42    39    38    37   1.10000 -1.0 2.0
   43    38    42    45   1.00000 -1.0 2.0
   50    61    59    60  10.50000 -1.0 2.0
   37    44    40    41  10.50000 -1.0 2.0
END
