* LIGAND DATABASE FILE (OPLS2005)
*
001      61    61    110    157     315
    1     0 S   NP   _N1_     1    28.75865    95.52714   -24.54756
    2     1 S   H    _HN1     2     1.02829    32.90928  -178.53153
    3     1 S   H    _H1_     3     1.02787   112.26405   -89.78571
    4     1 S   H    _H2_     4     1.02949    74.94436    14.24426
    5     1 S   CT   _CA1     5     1.50110   130.23347   118.45863
    6     5 S   HC   _HA1     6     1.09573   105.19296    90.42096
    7     5 S   CO3  _C1_     7     1.53789   112.46751   -29.81313
    8     7 S   O2Z  _O11     8     1.26371   115.00812   -42.47490
    9     7 S   O2Z  _O12     9     1.26240   114.94714   136.65911
   10     5 S   CT   _CB1    10     1.53079   107.42467  -151.59196
   11    10 S   HC   HB11    11     1.09833   109.37668   -49.65849
   12    10 S   HC   HB12    12     1.09812   110.44905    66.95442
   13    10 S   CT   _CG1    13     1.52987   112.59900  -170.63145
   14    13 S   HC   HG11    14     1.09585   110.63641   -65.67133
   15    13 S   HC   HG12    15     1.09671   109.78394    53.55779
   16    13 S   C    _CD1    16     1.51798   112.22966   174.02119
   17    16 S   O    _OE1    17     1.22729   123.29838     7.10194
   18    16 S   N    _N2_    18     1.38626   111.65396  -173.01792
   19    18 S   H    _HN2    19     1.01587   118.95879     1.61955
   20    18 S   CT1  _CA2    20     1.46229   123.46096   177.75912
   21    20 S   HC   _HA2    21     1.09734   109.36291     3.07122
   22    20 S   C    _C2_    22     1.53556   108.76186  -112.43224
   23    22 S   O    _O2_    23     1.23060   122.27420  -149.18101
   24    20 S   CT   _CB2    32     1.53224   111.36873   125.07173
   25    24 S   HC   HB21    33     1.09654   110.00278    55.81894
   26    24 S   HC   HB22    34     1.09549   110.53414   174.47600
   27    22 S   N    _N3_    24     1.38329   113.74550    38.37342
   28    27 S   H    _HN3    25     1.01578   119.57356    -3.45037
   29    24 S   S    _SG2    35     1.82694   111.42610   -65.52880
   30    27 S   CT   _CA3    26     1.45283   123.23375   177.08026
   31    30 S   HC   HA31    27     1.09549   107.51930   -64.43507
   32    30 S   HC   HA32    28     1.09556   107.97952    52.00825
   33    29 S   CM   _C6_    36     1.74844    99.07175   171.49742
   34    30 S   CO3  _C3_    29     1.52962   114.06495   173.99942
   35    34 S   O2Z  _O31    30     1.26378   116.06497    -0.58047
   36    34 S   O2Z  _O32    31     1.26425   114.41557   179.47848
   37    33 S   CM   _C5_    37     1.35642   123.43718   -91.94625
   38    37 S   CT   _C9_    38     1.55638   120.49192  -177.41949
   39    38 S   OM   _O34    39     1.32477   107.21490  -116.29067
   40    37 S   CT   _C4_    58     1.52315   123.47340     0.85707
   41    40 S   HC   _H4_    59     1.09474   111.09129   130.33469
   42    40 S   HC   _H5_    60     1.09242   113.97965    11.05042
   43    40 S   HC   _H6_    61     1.09411   110.48284  -109.40699
   44    38 S   OS   _O33    40     1.44343   112.85378     4.61117
   45    38 S   CT   _C10    54     1.55778   112.07457   124.07412
   46    45 S   Br   Br1_    55     1.97808   113.12534   179.91607
   47    45 S   Br   Br2_    56     1.97522   111.19051   -57.93036
   48    45 S   HC   _H9_    57     1.09585   113.60048    60.72560
   49    44 S   CT   _C8_    41     1.42834   115.60863   -38.70291
   50    49 S   HC   _H3_    42     1.09655   108.23166   -55.06304
   51    33 S   CT   _C7_    43     1.50896   115.43704    89.10318
   52    51 S   HC   _H7_    44     1.09739   111.01061   -36.94967
   53    51 S   HC   _H8_    45     1.09754   107.52340    80.19457
   54    49 S   CM   _C11    46     1.52048   108.74107  -174.30044
   55    54 S   CM   _C12    47     1.34256   124.01887   137.30680
   56    55 S   Cl   Cl1_    48     1.71310   126.04495     1.29815
   57    55 S   HC   _H10    49     1.08298   123.16059  -179.70792
   58    54 S   CT   _C13    50     1.50866   116.81138   -42.53573
   59    58 S   HC   _H11    51     1.09407   110.81837   -57.24812
   60    58 S   HC   _H12    52     1.09472   110.65946    63.31368
   61    58 S   HC   _H13    53     1.09562   112.08380  -176.98370
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   8   5   4   3
  15   2   1   1  15  14   7   6   2   1   1  12   4   2   1   1
  12   6   5   2   1   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    51    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    49    51    52    53    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    44    49    50    51    52    53    54    45    40    41    42    43  
   35    36  
   36  
    0  
   38    39    44    49    51    52    53    45    46    47    48    40    41    42    43  
   39    44    49    50    51    54    45    46    47    48    40    41    42    43  
   44    49    45    46    47    48    40  
   41    42    43    44    45    51  
   42    43  
   43  
    0  
   49    50    51    52    53    54    55    58    45    46    47    48  
   46    47    48    49  
   47    48  
   48  
    0  
   50    51    52    53    54    55    56    57    58    59    60    61  
   51    52    53    54    55    58  
   52    53    54    55    58  
   53    54  
   54  
   55    56    57    58    59    60    61  
   56    57    58    59    60    61  
   57    58  
   58  
   59    60    61  
   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  -0.175000   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   3.5500   0.0760   0.007500   2.0020   1.7750   0.023028004  -0.852763146
   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  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660   0.491500   1.9750   1.7500   0.005000000  -0.741685710
   39   3.1500   0.2500  -1.222500   1.7825   1.5750   0.001000000  -0.126889456
   40   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   45   3.5000   0.0660   0.000300   1.9750   1.7500   0.005000000  -0.741685710
   46   3.4700   0.4700  -0.102000   2.8000   2.5000   0.001000000  -0.686339560
   47   3.4700   0.4700  -0.102000   2.8000   2.5000   0.001000000  -0.686339560
   48   2.5000   0.0300   0.203700   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5500   0.0760   0.005000   2.0020   1.7750   0.023028004  -0.852763146
   56   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
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   240.000  1.763
   33    37   549.000  1.340
   33    51   317.000  1.510
   37    38   317.000  1.510
   37    40   317.000  1.510
   38    39   570.000  1.307
   38    44   320.000  1.410
   38    45   268.000  1.529
   44    49   320.000  1.410
   49    50   340.000  1.090
   49    51   268.000  1.529
   49    54   317.000  1.510
   51    52   340.000  1.090
   51    53   340.000  1.090
   54    55   549.000  1.340
   54    58   317.000  1.510
   55    56   300.000  1.725
   55    57   340.000  1.080
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   45    46   245.000  1.990
   45    47   245.000  1.990
   45    48   340.000  1.090
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   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    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    65.00000  122.11800
   29    33    51    65.00000  117.37300
   33    37    38    70.00000  124.00000
   33    37    40    70.00000  124.00000
   33    51    49    70.00000  112.02700
   33    51    52    35.00000  109.50000
   33    51    53    35.00000  109.50000
   37    38    39    85.00000  110.90400
   37    38    44    85.00000  110.90400
   37    38    45    70.00000  112.02700
   37    40    41    35.00000  109.50000
   37    40    42    35.00000  109.50000
   37    40    43    35.00000  109.50000
   38    44    49    60.00000  109.50000
   38    45    46    70.00000  109.17700
   38    45    47    70.00000  109.17700
   38    45    48    37.50000  110.70000
   44    38    39   110.00000  112.65000
   44    49    50    35.00000  109.50000
   44    49    51    50.00000  109.50000
   44    49    54    85.00000  110.90400
   49    51    52    37.50000  110.70000
   49    51    53    37.50000  110.70000
   49    54    55    70.00000  124.00000
   49    54    58    65.00000  117.92700
   51    33    37    70.00000  124.00000
   51    49    50    37.50000  110.70000
   53    51    52    33.00000  107.80000
   54    49    50    35.00000  109.50000
   54    49    51    70.00000  112.02700
   54    55    56    75.00000  121.50000
   54    55    57    35.00000  120.00000
   54    58    59    35.00000  109.50000
   54    58    60    35.00000  109.50000
   54    58    61    35.00000  109.50000
   57    55    56    60.00000  114.00000
   58    54    55    70.00000  124.00000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   45    38    39    50.00000  109.50000
   45    38    44    50.00000  109.50000
   47    45    46    75.00000  111.64500
   48    45    46    51.00000  107.60000
   48    45    47    51.00000  107.60000
   40    37    38    65.00000  117.92700
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    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   0.00000  1.0 1.0
   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   1.00000 -1.0 2.0
   24    29    33    51   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   7.00000 -1.0 2.0
   29    33    37    40   7.00000 -1.0 2.0
   29    33    51    49   0.09700  1.0 1.0
   29    33    51    49   0.15600 -1.0 2.0
   29    33    51    49  -0.50800  1.0 3.0
   29    33    51    52   0.00000  1.0 1.0
   29    33    51    53   0.00000  1.0 1.0
   33    37    38    39   0.39000  1.0 1.0
   33    37    38    39  -0.05800 -1.0 2.0
   33    37    38    39  -0.55150  1.0 3.0
   33    37    38    44   0.39000  1.0 1.0
   33    37    38    44  -0.05800 -1.0 2.0
   33    37    38    44  -0.55150  1.0 3.0
   33    37    38    45   0.09850  1.0 1.0
   33    37    38    45   0.15250 -1.0 2.0
   33    37    38    45  -0.50650  1.0 3.0
   33    37    40    41   0.00000  1.0 1.0
   33    37    40    42   0.00000  1.0 1.0
   33    37    40    43   0.00000  1.0 1.0
   37    33    51    49   0.09850  1.0 1.0
   37    33    51    49   0.15250 -1.0 2.0
   37    33    51    49  -0.50650  1.0 3.0
   37    33    51    52   0.00000  1.0 1.0
   37    33    51    53   0.00000  1.0 1.0
   37    38   -44    49  -0.77900  1.0 1.0
   37    38   -44    49  -0.36900 -1.0 2.0
   37    38   -44    49   0.40400  1.0 3.0
   37    38    45    46   0.56750  1.0 1.0
   37    38    45    46  -0.07550 -1.0 2.0
   37    38    45    46   0.20000  1.0 3.0
   37    38    45    47   0.56750  1.0 1.0
   37    38    45    47  -0.07550 -1.0 2.0
   37    38    45    47   0.20000  1.0 3.0
   37    38    45    48   0.15000  1.0 3.0
   38    37    40    41   0.34800  1.0 3.0
   38    37    40    42   0.34800  1.0 3.0
   38    37    40    43   0.34800  1.0 3.0
   38    44    49    50   0.37050  1.0 3.0
   38    44    49    51   0.06250  1.0 1.0
   38    44    49    51  -0.01100 -1.0 2.0
   38    44    49    51   0.28050  1.0 3.0
   38    44    49    54  -0.77900  1.0 1.0
   38    44    49    54  -0.36900 -1.0 2.0
   38    44    49    54   0.40400  1.0 3.0
   39    38    44    49  -0.11650  1.0 1.0
   39    38    44    49  -1.14850 -1.0 2.0
   39    38    44    49   0.58850  1.0 3.0
   39    38    45    46   0.56750  1.0 1.0
   39    38    45    46  -0.07550 -1.0 2.0
   39    38    45    46   0.20000  1.0 3.0
   39    38    45    47   0.56750  1.0 1.0
   39    38    45    47  -0.07550 -1.0 2.0
   39    38    45    47   0.20000  1.0 3.0
   39    38    45    48   0.23400  1.0 3.0
   44    38    45    46   0.56750  1.0 1.0
   44    38    45    46  -0.07550 -1.0 2.0
   44    38    45    46   0.20000  1.0 3.0
   44    38    45    47   0.56750  1.0 1.0
   44    38    45    47  -0.07550 -1.0 2.0
   44    38    45    47   0.20000  1.0 3.0
   44    38    45    48   0.23400  1.0 3.0
   44    49   -51    33   0.61850  1.0 1.0
   44    49   -51    33  -0.22750 -1.0 2.0
   44    49   -51    33   0.15300  1.0 3.0
   44    49    51    52   0.23400  1.0 3.0
   44    49    51    53   0.23400  1.0 3.0
   44    49    54    55   0.39000  1.0 1.0
   44    49    54    55  -0.05800 -1.0 2.0
   44    49    54    55  -0.55150  1.0 3.0
   44    49    54    58   0.09700  1.0 1.0
   44    49    54    58   0.15600 -1.0 2.0
   44    49    54    58  -0.50800  1.0 3.0
   49    54    55    56   7.00000 -1.0 2.0
   49    54    55    57   7.00000 -1.0 2.0
   49    54    58    59   0.34800  1.0 3.0
   49    54    58    60   0.34800  1.0 3.0
   49    54    58    61   0.34800  1.0 3.0
   50    49    51    33   0.15000  1.0 3.0
   50    49    51    52   0.15000  1.0 3.0
   50    49    51    53   0.15000  1.0 3.0
   50    49    54    55   0.00000  1.0 1.0
   50    49    54    58   0.34800  1.0 3.0
   51    33   -37    38   7.00000 -1.0 2.0
   51    33    37    40   7.00000 -1.0 2.0
   51    49    54    55   0.09850  1.0 1.0
   51    49    54    55   0.15250 -1.0 2.0
   51    49    54    55  -0.50650  1.0 3.0
   51    49    54    58   0.46850  1.0 1.0
   51    49    54    58   0.08550 -1.0 2.0
   51    49    54    58   0.09800  1.0 3.0
   54    49    51    33   0.31000  1.0 1.0
   54    49    51    33   0.14700 -1.0 2.0
   54    49    51    33   0.07550  1.0 3.0
   54    49    51    52   0.15000  1.0 3.0
   54    49    51    53   0.15000  1.0 3.0
   55    54    58    59   0.00000  1.0 1.0
   55    54    58    60   0.00000  1.0 1.0
   55    54    58    61   0.00000  1.0 1.0
   58    54    55    56   7.00000 -1.0 2.0
   58    54    55    57   7.00000 -1.0 2.0
   45    38    44    49   0.06250  1.0 1.0
   45    38    44    49  -0.01100 -1.0 2.0
   45    38    44    49   0.28050  1.0 3.0
   40    37    38    39   0.09700  1.0 1.0
   40    37    38    39   0.15600 -1.0 2.0
   40    37    38    39  -0.50800  1.0 3.0
   40    37    38    44   0.09700  1.0 1.0
   40    37    38    44   0.15600 -1.0 2.0
   40    37    38    44  -0.50800  1.0 3.0
   40    37    38    45   0.46850  1.0 1.0
   40    37    38    45   0.08550 -1.0 2.0
   40    37    38    45   0.09800  1.0 3.0
IPHI
    8     5     7     9  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
   35    30    34    36  10.50000 -1.0 2.0
   29    51    33    37   1.10000 -1.0 2.0
   38    40    37    33   1.10000 -1.0 2.0
   49    58    54    55  15.00000 -1.0 2.0
   56    57    55    54  15.00000 -1.0 2.0
END
