* LIGAND DATABASE FILE (OPLS2005)
*
001      70    72    129    206     382
    1     0 S   NP   _N1_     1    29.27247    93.25928   -25.27536
    2     1 S   H    _HN1     2     1.02788   115.94551  -102.83478
    3     1 S   H    _H1_     3     1.02952    91.98042     8.71654
    4     1 S   H    _H2_     4     1.02828    15.23650  -163.76121
    5     1 S   CT   _CA1     5     1.50113   115.84267   122.55952
    6     5 S   HC   _HA1     6     1.09575   105.20006    74.87472
    7     5 S   CO3  _C1_     7     1.53789   112.45721   -45.36895
    8     7 S   O2Z  _O11     8     1.26374   115.00390   -42.63438
    9     7 S   O2Z  _O12     9     1.26242   114.93998   136.48622
   10     5 S   CT   _CB1    10     1.53073   107.41365  -167.14155
   11    10 S   HC   HB11    11     1.09835   109.37000   -49.72734
   12    10 S   HC   HB12    12     1.09816   110.44368    66.87588
   13    10 S   CT   _CG1    13     1.52992   112.61682  -170.71041
   14    13 S   HC   HG11    14     1.09584   110.62152   -65.53538
   15    13 S   HC   HG12    15     1.09668   109.80582    53.70995
   16    13 S   C    _CD1    16     1.51793   112.20498   174.15709
   17    16 S   O    _OE1    17     1.22733   123.25025     6.44844
   18    16 S   N    _N2_    18     1.38625   111.67935  -173.64535
   19    18 S   H    _HN2    19     1.01564   118.96544     1.79668
   20    18 S   CT1  _CA2    20     1.46270   123.43508   177.79824
   21    20 S   HC   _HA2    21     1.09734   109.50183     3.13525
   22    20 S   C    _C2_    22     1.53475   107.63333  -112.39872
   23    22 S   O    _O2_    23     1.22999   122.62421  -140.17162
   24    20 S   CT   _CB2    32     1.53335   111.76933   125.24646
   25    24 S   HC   HB21    33     1.09536   110.00124    58.26882
   26    24 S   HC   HB22    34     1.09390   109.59038   177.05530
   27    22 S   N    _N3_    24     1.38457   113.38405    46.30449
   28    27 S   H    _HN3    25     1.01583   119.58365    -2.13607
   29    24 S   S    _SG2    35     1.82906   111.32255   -62.06125
   30    27 S   CT   _CA3    26     1.45278   123.14108   177.68895
   31    30 S   HC   HA31    27     1.09548   107.39925   -67.50851
   32    30 S   HC   HA32    28     1.09558   108.11324    48.93724
   33    29 S   CT   _C5_    36     1.85892   101.00657  -164.08582
   34    30 S   CO3  _C3_    29     1.52956   114.13218   171.03021
   35    34 S   O2Z  _O31    30     1.26372   116.12062    -0.72172
   36    34 S   O2Z  _O32    31     1.26443   114.40690   179.37411
   37    33 S   CT   _C6_    37     1.56028   111.35202   177.34878
   38    37 S   HC   _H3_    38     1.10136   108.40972   171.99004
   39    33 S   OS   _O35    60     1.44872   112.59070    54.12063
   40    33 S   CT   _C4_    67     1.53844   108.29503   -60.84984
   41    40 S   HC   _H5_    68     1.09619   111.57891    71.74820
   42    40 S   HC   _H6_    69     1.09405   113.25565   -50.74573
   43    40 S   HC   _H7_    70     1.09694   110.30266  -171.84108
   44    37 S   CO4  _C15    39     1.53330   114.37686    55.60591
   45    44 S   O    _O33    40     1.22986   121.12268    63.36029
   46    44 S   CA   _C14    41     1.48961   119.69470  -117.33540
   47    46 S   CA   _C9_    42     1.40252   119.04895    -7.72753
   48    47 S   CA   _C10    43     1.40336   119.46688  -179.55854
   49    48 S   HA   _H9_    44     1.08805   120.69452  -179.96574
   50    47 S   CM   _C8_    52     1.46031   121.66480     0.51358
   51    50 S   HC   _H8_    53     1.08567   118.19404  -177.87680
   52    48 S   CA   _C11    45     1.39445   120.65734    -0.15702
   53    52 S   HA   _H10    46     1.08627   120.02660  -179.84298
   54    37 S   CM   _C7_    54     1.50720   110.04956   -73.74324
   55    52 S   CA   _C12    47     1.39107   119.92878     0.08847
   56    55 S   HA   _H11    48     1.08677   119.71067  -179.91607
   57    54 S   CT   _C16    55     1.50328   113.02861   -54.20546
   58    57 S   HC   _H13    56     1.09620   111.68988   177.81269
   59    57 S   HC   _H14    57     1.09739   108.43533   -63.97668
   60    46 S   CA   _C13    49     1.40450   121.55226   172.66695
   61    57 S   CT   _C17    58     1.53201   108.52393    56.09151
   62    61 S   HC   _H4_    59     1.09606   109.71164    64.37530
   63    60 S   OH   _O34    50     1.36903   123.51823    -0.52377
   64    63 S   HO   _H12    51     0.97374   108.80725     1.25959
   65    61 S   CT   _C18    61     1.52906   110.25815  -174.62746
   66    65 S   HC   _H15    62     1.09744   109.84496    69.01425
   67    65 S   HC   _H16    63     1.09673   110.30707   -49.67900
   68    65 S   CO3  _C19    64     1.53213   113.29628  -169.16033
   69    68 S   O2Z  _O37    65     1.26436   114.53622  -140.54437
   70    68 S   O2Z  _O36    66     1.26239   116.05888    40.88249
  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  11   5   4   3
  16   2   1   1  18   8  15   6   2   1   1  10   4  12  11   9
   4   8   2   5   3   6   4   2   8   4   3   2   7   4   1   1
   5   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    44    54    61    39    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    44    45    46    50    54    57    61    62    39    65    40    41    42    43  
   35    36  
   36  
    0  
   38    44    45    46    47    60    50    51    54    57    58    59    61    39    40    41    42    43  
   44    45    46    50    54    57    39    40  
   65    66    67    68    40    41    42    43    44    54    57    58    59    61    62  
   41    42    43    44    54    61  
   42    43  
   43  
    0  
   45    46    47    48    55    60    63    50    54    57  
   46    47    60    54  
   47    48    49    52    55    56    60    63    64    50    51    54  
   48    49    52    53    55    60    63    50    51    54    57  
   49    52    53    55    56    60    50    51    54  
   52    53    55    50  
   51    54    57    58    59    61    52    60  
   54    57  
   53    55    56    60    63  
   55    56    60  
   57    58    59    61    62    65  
   56    60    63    64  
   60    63  
   58    59    61    62    65    66    67    68  
   59    61    62    65  
   61    62    65  
   63    64  
   62    65    66    67    68    69    70  
   65    66    67    68  
   64  
    0  
   66    67    68    69    70  
   67    68    69    70  
   68    69    70  
   69    70  
   70  
    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  -0.316400   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   0.348900   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   68   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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   268.000  1.529
   33    39   320.000  1.410
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    44   317.000  1.522
   37    54   317.000  1.510
   44    45   570.000  1.229
   44    46   310.000  1.470
   46    47   469.000  1.400
   46    60   469.000  1.400
   47    48   469.000  1.400
   47    50   320.000  1.460
   48    49   367.000  1.080
   48    52   469.000  1.400
   52    53   367.000  1.080
   52    55   469.000  1.400
   55    56   367.000  1.080
   55    60   469.000  1.400
   60    63   450.000  1.364
   63    64   553.000  0.945
   50    51   340.000  1.080
   50    54   549.000  1.340
   54    57   317.000  1.510
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    61   268.000  1.529
   61    62   340.000  1.090
   61    39   320.000  1.410
   61    65   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   317.000  1.522
   68    69   656.000  1.250
   68    70   656.000  1.250
   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    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    39    85.00000  114.68000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    44    63.00000  111.10000
   33    37    54    70.00000  112.02700
   33    39    61    60.00000  109.50000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    80.00000  120.40000
   37    44    46    65.00000  115.47100
   37    54    50    70.00000  124.00000
   37    54    57    65.00000  117.92700
   44    37    38    35.00000  109.50000
   44    46    47    60.00000  119.52600
   44    46    60    60.00000  119.52600
   46    44    45    75.00000  123.78400
   46    47    48    63.00000  120.00000
   46    47    50    60.00000  120.93500
   46    60    55    63.00000  120.00000
   46    60    63    70.00000  120.00000
   47    48    49    35.00000  120.00000
   47    48    52    63.00000  120.00000
   47    50    51    40.00000  117.26300
   47    50    54    60.00000  123.20500
   48    52    53    35.00000  120.00000
   48    52    55    63.00000  120.00000
   52    48    49    35.00000  120.00000
   52    55    56    35.00000  120.00000
   52    55    60    63.00000  120.00000
   55    52    53    35.00000  120.00000
   55    60    63    70.00000  120.00000
   60    46    47    63.00000  120.00000
   60    55    56    35.00000  120.00000
   60    63    64    35.00000  113.00000
   50    47    48    60.00000  120.93500
   50    54    57    70.00000  124.00000
   54    37    38    35.00000  109.50000
   54    37    44    70.00000  109.06800
   54    50    51    35.00000  120.00000
   54    57    58    35.00000  109.50000
   54    57    59    35.00000  109.50000
   54    57    61    70.00000  112.02700
   57    61    62    37.50000  110.70000
   57    61    39    50.00000  109.50000
   57    61    65    58.35000  112.70000
   59    57    58    33.00000  107.80000
   61    57    58    37.50000  110.70000
   61    57    59    37.50000  110.70000
   61    65    66    37.50000  110.70000
   61    65    67    37.50000  110.70000
   61    65    68    70.00000  109.69300
   39    33    37    50.00000  109.50000
   39    61    62    35.00000  109.50000
   65    61    62    37.50000  110.70000
   65    61    39    50.00000  109.50000
   65    68    69    70.00000  117.00000
   65    68    70    70.00000  117.00000
   67    65    66    33.00000  107.80000
   68    65    66    35.00000  109.50000
   68    65    67    35.00000  109.50000
   70    68    69    80.00000  126.00000
   40    33    37    58.35000  112.70000
   40    33    39    50.00000  109.50000
   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   0.01700  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    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    44   0.56750  1.0 1.0
   29    33    37    44  -0.07550 -1.0 2.0
   29    33    37    44   0.20000  1.0 3.0
   29    33    37    54   0.56750  1.0 1.0
   29    33    37    54  -0.07550 -1.0 2.0
   29    33    37    54   0.20000  1.0 3.0
   29    33    39    61   0.14700  1.0 1.0
   29    33    39    61  -1.16150 -1.0 2.0
   29    33    39    61   0.48700  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    43   0.15000  1.0 3.0
   33    37    44    45   0.30150 -1.0 2.0
   33    37    44    46   0.05850 -1.0 2.0
   33    37    44    46   0.17250  1.0 3.0
   33    37    54    50   0.09850  1.0 1.0
   33    37    54    50   0.15250 -1.0 2.0
   33    37    54    50  -0.50650  1.0 3.0
   33    37    54    57   0.46850  1.0 1.0
   33    37    54    57   0.08550 -1.0 2.0
   33    37    54    57   0.09800  1.0 3.0
   37    33    39    61   0.06250  1.0 1.0
   37    33    39    61  -0.01100 -1.0 2.0
   37    33    39    61   0.28050  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    43   0.15000  1.0 3.0
   37    44    46    47   2.26350  1.0 1.0
   37    44    46    47   0.76750 -1.0 2.0
   37    44    46    47   0.22500  1.0 3.0
   37    44    46    60   2.26350  1.0 1.0
   37    44    46    60   0.76750 -1.0 2.0
   37    44    46    60   0.22500  1.0 3.0
   37    54    57    58   0.34800  1.0 3.0
   37    54    57    59   0.34800  1.0 3.0
   37    54   -57    61   0.46850  1.0 1.0
   37    54   -57    61   0.08550 -1.0 2.0
   37    54   -57    61   0.09800  1.0 3.0
   38    37    44    45   0.00000  1.0 1.0
   38    37    44    46   0.00000  1.0 1.0
   38    37    54    50   0.00000  1.0 1.0
   38    37    54    57   0.34800  1.0 3.0
   44    37    54    50  -0.51250  1.0 1.0
   44    37    54    50  -0.88800 -1.0 2.0
   44    37    54    50   0.08850  1.0 3.0
   44    37    54    57   0.17250  1.0 1.0
   44    37    54    57  -0.04100 -1.0 2.0
   44    37    54    57  -0.33850  1.0 3.0
   44    46    47    48   3.62500 -1.0 2.0
   44    46   -47    50   3.62500 -1.0 2.0
   44    46    60    55   3.62500 -1.0 2.0
   44    46    60    63   3.62500 -1.0 2.0
   45    44    46    47   1.05000 -1.0 2.0
   45    44    46    60   1.05000 -1.0 2.0
   46    47    48    49   3.62500 -1.0 2.0
   46    47    48    52   3.62500 -1.0 2.0
   46    47    50    51   0.56550  1.0 3.0
   46    47    50    54   0.15800  1.0 1.0
   46    47    50    54   1.85350 -1.0 2.0
   46    47    50    54  -0.48700  1.0 3.0
   46    60    63    64   0.84100 -1.0 2.0
   47    46    60    55   3.62500 -1.0 2.0
   47    46    60    63   3.62500 -1.0 2.0
   47    48    52    53   3.62500 -1.0 2.0
   47    48   -52    55   3.62500 -1.0 2.0
   47    50   -54    37   7.00000 -1.0 2.0
   47    50    54    57   7.00000 -1.0 2.0
   48    47    50    51   0.56550  1.0 3.0
   48    47    50    54   0.15800  1.0 1.0
   48    47    50    54   1.85350 -1.0 2.0
   48    47    50    54  -0.48700  1.0 3.0
   48    52    55    56   3.62500 -1.0 2.0
   48    52    55    60   3.62500 -1.0 2.0
   49    48    52    53   3.62500 -1.0 2.0
   49    48    52    55   3.62500 -1.0 2.0
   52    55   -60    46   3.62500 -1.0 2.0
   52    55    60    63   3.62500 -1.0 2.0
   53    52    55    56   3.62500 -1.0 2.0
   53    52    55    60   3.62500 -1.0 2.0
   55    60    63    64   0.84100 -1.0 2.0
   56    55    60    46   3.62500 -1.0 2.0
   56    55    60    63   3.62500 -1.0 2.0
   60    46   -47    48   3.62500 -1.0 2.0
   60    46    47    50   3.62500 -1.0 2.0
   50    47    48    49   3.62500 -1.0 2.0
   50    47    48    52   3.62500 -1.0 2.0
   50    54    57    58   0.00000  1.0 1.0
   50    54    57    59   0.00000  1.0 1.0
   50    54    57    61   0.09850  1.0 1.0
   50    54    57    61   0.15250 -1.0 2.0
   50    54    57    61  -0.50650  1.0 3.0
   51    50    54    37   7.00000 -1.0 2.0
   51    50    54    57   7.00000 -1.0 2.0
   54    37    44    45   0.30150 -1.0 2.0
   54    37   -44    46   0.65300  1.0 1.0
   54    37   -44    46  -0.03850 -1.0 2.0
   54    37   -44    46   0.33900  1.0 3.0
   54    57    61    62   0.15000  1.0 3.0
   54    57    61    39   0.61850  1.0 1.0
   54    57    61    39  -0.22750 -1.0 2.0
   54    57    61    39   0.15300  1.0 3.0
   54    57    61    65   0.34400  1.0 1.0
   54    57    61    65   0.09450 -1.0 2.0
   54    57    61    65   0.11100  1.0 3.0
   57    61   -39    33   0.06250  1.0 1.0
   57    61   -39    33  -0.01100 -1.0 2.0
   57    61   -39    33   0.28050  1.0 3.0
   57    61    65    66   0.15000  1.0 3.0
   57    61    65    67   0.15000  1.0 3.0
   57    61    65    68  -1.63150  1.0 1.0
   57    61    65    68  -0.43550 -1.0 2.0
   57    61    65    68   0.24500  1.0 3.0
   58    57    61    62   0.15000  1.0 3.0
   58    57    61    39   0.23400  1.0 3.0
   58    57    61    65   0.15000  1.0 3.0
   59    57    61    62   0.15000  1.0 3.0
   59    57    61    39   0.23400  1.0 3.0
   59    57    61    65   0.15000  1.0 3.0
   61    65    68    69   0.41150 -1.0 2.0
   61    65    68    70   0.41150 -1.0 2.0
   62    61    39    33   0.37050  1.0 3.0
   62    61    65    66   0.15000  1.0 3.0
   62    61    65    67   0.15000  1.0 3.0
   62    61    65    68  -0.11250  1.0 3.0
   39    33    37    38   0.23400  1.0 3.0
   39    33    37    44  -0.09450  1.0 1.0
   39    33    37    44  -1.12950 -1.0 2.0
   39    33    37    44   0.54000  1.0 3.0
   39    33   -37    54   0.61850  1.0 1.0
   39    33   -37    54  -0.22750 -1.0 2.0
   39    33   -37    54   0.15300  1.0 3.0
   39    33    40    41   0.23400  1.0 3.0
   39    33    40    42   0.23400  1.0 3.0
   39    33    40    43   0.23400  1.0 3.0
   39    61    65    66   0.23400  1.0 3.0
   39    61    65    67   0.23400  1.0 3.0
   39    61    65    68  -3.35100  1.0 1.0
   39    61    65    68  -0.37050 -1.0 2.0
   39    61    65    68   0.22400  1.0 3.0
   65    61    39    33   0.06250  1.0 1.0
   65    61    39    33  -0.01100 -1.0 2.0
   65    61    39    33   0.28050  1.0 3.0
   66    65    68    69   0.00000  1.0 1.0
   66    65    68    70   0.00000  1.0 1.0
   67    65    68    69   0.00000  1.0 1.0
   67    65    68    70   0.00000  1.0 1.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    44  -0.95700  1.0 1.0
   40    33    37    44  -0.18200 -1.0 2.0
   40    33    37    44   0.29450  1.0 3.0
   40    33    37    54   0.34400  1.0 1.0
   40    33    37    54   0.09450 -1.0 2.0
   40    33    37    54   0.11100  1.0 3.0
   40    33    39    61   0.06250  1.0 1.0
   40    33    39    61  -0.01100 -1.0 2.0
   40    33    39    61   0.28050  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
   37    46    44    45  10.50000 -1.0 2.0
   47    60    46    44   4.00000 -1.0 2.0
   48    50    47    46   4.00000 -1.0 2.0
   52    49    48    47   1.10000 -1.0 2.0
   55    53    52    48   1.10000 -1.0 2.0
   60    56    55    52   1.10000 -1.0 2.0
   55    63    60    46   4.00000 -1.0 2.0
   47    51    50    54   1.10000 -1.0 2.0
   37    57    54    50   1.10000 -1.0 2.0
   69    65    68    70  10.50000 -1.0 2.0
END
