* LIGAND DATABASE FILE (OPLS2005)
*
001      71    71    129    194     381
    1     0 S   NP   _N1_     1    28.86466    96.71978   -25.19487
    2     1 S   H    _HN1     2     1.02791   114.73816   -90.96038
    3     1 S   H    _H1_     3     1.02948    70.49585    10.86125
    4     1 S   H    _H2_     4     1.02829    37.00994  -178.11290
    5     1 S   CT   _CA1     5     1.50115   129.74204   111.63887
    6     5 S   HC   _HA1     6     1.09574   105.18199    96.54813
    7     5 S   CO3  _C1_     7     1.53771   112.44933   -23.67519
    8     7 S   O2Z  _O11     8     1.26371   115.00923   -43.15160
    9     7 S   O2Z  _O12     9     1.26236   114.93571   135.92491
   10     5 S   CT   _CB1    10     1.53070   107.41727  -145.49330
   11    10 S   HC   HB11    11     1.09837   109.33529   -49.73633
   12    10 S   HC   HB12    12     1.09811   110.47150    66.85627
   13    10 S   CT   _CG1    13     1.53010   112.62783  -170.69824
   14    13 S   HC   HG11    14     1.09576   110.68003   -66.55376
   15    13 S   HC   HG12    15     1.09671   109.74461    52.69066
   16    13 S   C    _CD1    16     1.51806   112.10594   173.13990
   17    16 S   O    _OE1    17     1.22747   123.23677     9.49099
   18    16 S   N    _N2_    18     1.38655   111.76638  -170.54996
   19    18 S   H    _HN2    19     1.01585   118.98575     1.22844
   20    18 S   CT1  _CA2    20     1.46187   123.34231   176.85427
   21    20 S   HC   _HA2    21     1.09746   109.29252     5.20029
   22    20 S   C    _C2_    22     1.53613   108.85653  -110.23839
   23    22 S   O    _O2_    23     1.23073   122.24684  -149.22618
   24    20 S   CT   _CB2    32     1.53252   111.68509   127.13065
   25    24 S   HC   HB21    33     1.09604   110.23618    56.73861
   26    24 S   HC   HB22    34     1.09563   110.08841   175.24342
   27    22 S   N    _N3_    24     1.38310   113.81174    38.30825
   28    27 S   H    _HN3    25     1.01562   119.59871    -3.37284
   29    24 S   S    _SG2    35     1.82675   111.47225   -64.37245
   30    27 S   CT   _CA3    26     1.45285   123.26911   177.11330
   31    30 S   HC   HA31    27     1.09548   107.51702   -64.58845
   32    30 S   HC   HA32    28     1.09556   107.99075    51.86836
   33    29 S   CM   _C7_    36     1.75942    99.65787  -169.64550
   34    30 S   CO3  _C3_    29     1.52971   114.03709   173.85892
   35    34 S   O2Z  _O31    30     1.26382   116.06082    -0.62464
   36    34 S   O2Z  _O32    31     1.26421   114.42332   179.43664
   37    33 S   CM   _C8_    37     1.36880   124.44797   100.46763
   38    33 S   CM   _C6_    64     1.45802   110.31240   -81.27953
   39    38 S   HC   _H7_    65     1.09085   114.20302    78.42182
   40    37 S   CT   _C13    38     1.58366   123.82099    10.58091
   41    38 S   CMA  _C5_    66     1.35429   127.56152   -98.31319
   42    41 S   OM   _O35    67     1.26345   128.67165   178.21567
   43    40 S   CT   _C12    39     1.55557   111.09744   164.70391
   44    43 S   HC   _H10    40     1.09934   110.06578   -66.92397
   45    43 S   HC   _H11    41     1.09972   110.59963   178.90890
   46    40 S   CT   _C14    56     1.54548   111.42838   -74.77876
   47    46 S   HC   _H12    57     1.09651   110.93858  -168.32676
   48    46 S   HC   _H13    58     1.09290   112.48616    72.77426
   49    46 S   HC   _H14    59     1.09450   112.08848   -48.09527
   50    40 S   CT   _C15    60     1.55329   113.14337    48.69772
   51    50 S   HC   _H15    61     1.09735   111.20537   161.45233
   52    50 S   HC   _H16    62     1.09595   111.22705    42.03203
   53    50 S   HC   _H17    63     1.09159   113.41905   -80.63334
   54    41 S   CT   _C4_    68     1.52060   120.81432    -1.49933
   55    54 S   HC   _H4_    69     1.09809   111.14368   123.05964
   56    54 S   HC   _H5_    70     1.09393   113.52116     3.55903
   57    54 S   HC   _H6_    71     1.09777   110.85531  -116.38605
   58    43 S   CT   _C11    42     1.51911   114.15123    57.26578
   59    58 S   HC   _H3_    43     1.09616   110.54984    83.47364
   60    58 S   CT   _C10    44     1.52231   112.64997   -38.55529
   61    60 S   HC   _H8_    45     1.09828   109.08167   101.35666
   62    60 S   HC   _H9_    46     1.09834   108.15260  -143.20039
   63    58 S   OH   _O33    54     1.42781   108.91099  -159.78469
   64    63 S   HO   _H18    55     0.97254   107.50796   -56.80691
   65    37 S   CT   _C9_    47     1.56882   123.03235  -169.34065
   66    65 S   CT   _C16    48     1.54393   118.41237    20.19780
   67    66 S   HC   _H19    49     1.09785   110.85246   167.65113
   68    66 S   HC   _H20    50     1.09477   112.09334    47.95805
   69    66 S   HC   _H21    51     1.09226   112.35589   -77.15352
   70    65 S   OH   _O34    52     1.43271   107.58321  -100.54668
   71    70 S   HO   _H22    53     0.97228   107.98964  -171.83735
  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   7   5   4   3
  14   2   1   1  26   9   3  18   5   4  18   7   6   9   3   2
   1   5   2   1   1   3   2   1   1   9   6  11   5   4   2   1
   6   5   3   2   1   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    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    65    38    39    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    43    60    65    66    70    46    50    38    39    41    42    54  
   35    36  
   36  
    0  
   40    43    44    45    58    60    61    62    65    66    67    68    69    70    71    46    47    48    49    50    51    52    53    38    39    41  
   39    41    42    54    55    56    57    40    65  
   41    42    54  
   43    44    45    58    59    60    65    66    70    63    46    47    48    49    50    51    52    53  
   42    54    55    56    57  
   54    55    56    57  
   44    45    58    59    60    61    62    65    63    64    46    47    48    49    50    51    52    53  
   45    58    59    60    63    46    50  
   58    59    60    63    46    50  
   47    48    49    50    51    52    53    58    65  
   48    49    50  
   49    50  
   50  
   51    52    53    58    65  
   52    53  
   53  
    0  
   55    56    57  
   56    57  
   57  
    0  
   59    60    61    62    65    66    70    63    64  
   60    61    62    65    63    64  
   61    62    65    66    67    68    69    70    71    63    64  
   62    65    66    70    63  
   65    66    70    63  
   64    65  
    0  
   66    67    68    69    70    71  
   67    68    69    70    71  
   68    69    70  
   69    70  
   70  
   71  
    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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   66   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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    38   380.000  1.444
   37    40   317.000  1.510
   37    65   317.000  1.510
   40    43   268.000  1.529
   40    46   268.000  1.529
   40    50   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    58   268.000  1.529
   58    59   340.000  1.090
   58    60   268.000  1.529
   58    63   320.000  1.410
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    65   268.000  1.529
   65    66   268.000  1.529
   65    70   320.000  1.410
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   70    71   553.000  0.945
   63    64   553.000  0.945
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   38    39   340.000  1.080
   38    41   465.000  1.376
   41    42   745.000  1.250
   41    54   270.000  1.512
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   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    38    65.00000  122.11800
   33    37    40    70.00000  124.00000
   33    37    65    70.00000  124.00000
   33    38    39    35.00000  120.00000
   33    38    41    70.00000  117.34000
   37    40    43    70.00000  112.02700
   37    40    46    70.00000  112.02700
   37    40    50    70.00000  112.02700
   37    65    60    70.00000  112.02700
   37    65    66    70.00000  112.02700
   37    65    70    90.00000  110.39200
   40    43    44    37.50000  110.70000
   40    43    45    37.50000  110.70000
   40    43    58    58.35000  112.70000
   40    46    47    37.50000  110.70000
   40    46    48    37.50000  110.70000
   40    46    49    37.50000  110.70000
   40    50    51    37.50000  110.70000
   40    50    52    37.50000  110.70000
   40    50    53    37.50000  110.70000
   43    58    59    37.50000  110.70000
   43    58    60    58.35000  112.70000
   43    58    63    50.00000  109.50000
   45    43    44    33.00000  107.80000
   58    43    44    37.50000  110.70000
   58    43    45    37.50000  110.70000
   58    60    61    37.50000  110.70000
   58    60    62    37.50000  110.70000
   58    60    65    58.35000  112.70000
   58    63    64    55.00000  108.50000
   60    58    59    37.50000  110.70000
   60    65    66    58.35000  112.70000
   60    65    70    50.00000  109.50000
   62    60    61    33.00000  107.80000
   65    37    40    65.00000  117.92700
   65    60    61    37.50000  110.70000
   65    60    62    37.50000  110.70000
   65    66    67    37.50000  110.70000
   65    66    68    37.50000  110.70000
   65    66    69    37.50000  110.70000
   65    70    71    55.00000  108.50000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   70    65    66    50.00000  109.50000
   63    58    59    35.00000  109.50000
   63    58    60    50.00000  109.50000
   46    40    43    58.35000  112.70000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    33.00000  107.80000
   50    40    43    58.35000  112.70000
   50    40    46    58.35000  112.70000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
   38    33    37    70.00000  123.01800
   38    41    42    65.00000  137.10300
   38    41    54    65.00000  122.18000
   41    38    39    40.00000  120.50800
   41    54    55    45.00000  110.52000
   41    54    56    45.00000  110.52000
   41    54    57    45.00000  110.52000
   54    41    42    85.00000  112.85300
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    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    38   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    40   7.00000 -1.0 2.0
   29    33    37    65   7.00000 -1.0 2.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    41  -0.18600  1.0 3.0
   33    37    40    43   0.09850  1.0 1.0
   33    37    40    43   0.15250 -1.0 2.0
   33    37    40    43  -0.50650  1.0 3.0
   33    37    40    46   0.09850  1.0 1.0
   33    37    40    46   0.15250 -1.0 2.0
   33    37    40    46  -0.50650  1.0 3.0
   33    37    40    50   0.09850  1.0 1.0
   33    37    40    50   0.15250 -1.0 2.0
   33    37    40    50  -0.50650  1.0 3.0
   33    37    65    60   0.09850  1.0 1.0
   33    37    65    60   0.15250 -1.0 2.0
   33    37    65    60  -0.50650  1.0 3.0
   33    37    65    66   0.09850  1.0 1.0
   33    37    65    66   0.15250 -1.0 2.0
   33    37    65    66  -0.50650  1.0 3.0
   33    37    65    70   0.67800  1.0 1.0
   33    37    65    70   0.47050 -1.0 2.0
   33    37    65    70  -0.62500  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    54   7.00000 -1.0 2.0
   37    33    38    39  -0.18600  1.0 3.0
   37    33    38    41   0.28850  1.0 1.0
   37    33    38    41   2.61350 -1.0 2.0
   37    33    38    41   0.78400  1.0 3.0
   37    40    43    44   0.15000  1.0 3.0
   37    40    43    45   0.15000  1.0 3.0
   37    40    43    58   0.34400  1.0 1.0
   37    40    43    58   0.09450 -1.0 2.0
   37    40    43    58   0.11100  1.0 3.0
   37    40    46    47   0.15000  1.0 3.0
   37    40    46    48   0.15000  1.0 3.0
   37    40    46    49   0.15000  1.0 3.0
   37    40    50    51   0.15000  1.0 3.0
   37    40    50    52   0.15000  1.0 3.0
   37    40    50    53   0.15000  1.0 3.0
   37    65    66    67   0.15000  1.0 3.0
   37    65    66    68   0.15000  1.0 3.0
   37    65    66    69   0.15000  1.0 3.0
   37    65    70    71  -0.07800  1.0 1.0
   37    65    70    71  -0.21500 -1.0 2.0
   37    65    70    71  -0.03150  1.0 3.0
   40    37    65    60   0.46850  1.0 1.0
   40    37    65    60   0.08550 -1.0 2.0
   40    37    65    60   0.09800  1.0 3.0
   40    37    65    66   0.46850  1.0 1.0
   40    37    65    66   0.08550 -1.0 2.0
   40    37    65    66   0.09800  1.0 3.0
   40    37    65    70   0.18000  1.0 1.0
   40    37    65    70   0.16450 -1.0 2.0
   40    37    65    70   0.04450  1.0 3.0
   40    43    58    59   0.15000  1.0 3.0
   40    43   -58    60   0.56750  1.0 1.0
   40    43   -58    60  -0.07550 -1.0 2.0
   40    43   -58    60   0.20000  1.0 3.0
   40    43    58    63   0.86500  1.0 1.0
   40    43    58    63  -0.17500 -1.0 2.0
   40    43    58    63   0.20800  1.0 3.0
   43    40    46    47   0.15000  1.0 3.0
   43    40    46    48   0.15000  1.0 3.0
   43    40    46    49   0.15000  1.0 3.0
   43    40    50    51   0.15000  1.0 3.0
   43    40    50    52   0.15000  1.0 3.0
   43    40    50    53   0.15000  1.0 3.0
   43    58    60    61   0.15000  1.0 3.0
   43    58    60    62   0.15000  1.0 3.0
   43    58    60    65   0.56750  1.0 1.0
   43    58    60    65  -0.07550 -1.0 2.0
   43    58    60    65   0.20000  1.0 3.0
   43    58    63    64  -0.11600  1.0 1.0
   43    58    63    64  -0.09450 -1.0 2.0
   43    58    63    64   0.21250  1.0 3.0
   44    43    58    59   0.15000  1.0 3.0
   44    43    58    60   0.15000  1.0 3.0
   44    43    58    63   0.23400  1.0 3.0
   45    43    58    59   0.15000  1.0 3.0
   45    43    58    60   0.15000  1.0 3.0
   45    43    58    63   0.23400  1.0 3.0
   58    60   -65    37   0.34400  1.0 1.0
   58    60   -65    37   0.09450 -1.0 2.0
   58    60   -65    37   0.11100  1.0 3.0
   58    60    65    66   0.56750  1.0 1.0
   58    60    65    66  -0.07550 -1.0 2.0
   58    60    65    66   0.20000  1.0 3.0
   58    60    65    70   0.86500  1.0 1.0
   58    60    65    70  -0.17500 -1.0 2.0
   58    60    65    70   0.20800  1.0 3.0
   59    58    60    61   0.15000  1.0 3.0
   59    58    60    62   0.15000  1.0 3.0
   59    58    60    65   0.15000  1.0 3.0
   59    58    63    64   0.19450  1.0 3.0
   60    58    63    64  -0.11600  1.0 1.0
   60    58    63    64  -0.09450 -1.0 2.0
   60    58    63    64   0.21250  1.0 3.0
   60    65    66    67   0.15000  1.0 3.0
   60    65    66    68   0.15000  1.0 3.0
   60    65    66    69   0.15000  1.0 3.0
   60    65    70    71  -0.11600  1.0 1.0
   60    65    70    71  -0.09450 -1.0 2.0
   60    65    70    71   0.21250  1.0 3.0
   61    60    65    37   0.15000  1.0 3.0
   61    60    65    66   0.15000  1.0 3.0
   61    60    65    70   0.23400  1.0 3.0
   62    60    65    37   0.15000  1.0 3.0
   62    60    65    66   0.15000  1.0 3.0
   62    60    65    70   0.23400  1.0 3.0
   65    37   -40    43   0.46850  1.0 1.0
   65    37   -40    43   0.08550 -1.0 2.0
   65    37   -40    43   0.09800  1.0 3.0
   65    37    40    46   0.46850  1.0 1.0
   65    37    40    46   0.08550 -1.0 2.0
   65    37    40    46   0.09800  1.0 3.0
   65    37    40    50   0.46850  1.0 1.0
   65    37    40    50   0.08550 -1.0 2.0
   65    37    40    50   0.09800  1.0 3.0
   66    65    70    71  -0.11600  1.0 1.0
   66    65    70    71  -0.09450 -1.0 2.0
   66    65    70    71   0.21250  1.0 3.0
   70    65    66    67   0.23400  1.0 3.0
   70    65    66    68   0.23400  1.0 3.0
   70    65    66    69   0.23400  1.0 3.0
   63    58    60    61   0.23400  1.0 3.0
   63    58    60    62   0.23400  1.0 3.0
   63    58    60    65   0.86500  1.0 1.0
   63    58    60    65  -0.17500 -1.0 2.0
   63    58    60    65   0.20800  1.0 3.0
   46    40    43    44   0.15000  1.0 3.0
   46    40    43    45   0.15000  1.0 3.0
   46    40    43    58   0.56750  1.0 1.0
   46    40    43    58  -0.07550 -1.0 2.0
   46    40    43    58   0.20000  1.0 3.0
   46    40    50    51   0.15000  1.0 3.0
   46    40    50    52   0.15000  1.0 3.0
   46    40    50    53   0.15000  1.0 3.0
   50    40    43    44   0.15000  1.0 3.0
   50    40    43    45   0.15000  1.0 3.0
   50    40    43    58   0.56750  1.0 1.0
   50    40    43    58  -0.07550 -1.0 2.0
   50    40    43    58   0.20000  1.0 3.0
   50    40    46    47   0.15000  1.0 3.0
   50    40    46    48   0.15000  1.0 3.0
   50    40    46    49   0.15000  1.0 3.0
   38    33    37    40   7.00000 -1.0 2.0
   38    33    37    65   7.00000 -1.0 2.0
   38    41    54    55   0.00000  1.0 1.0
   38    41    54    56   0.00000  1.0 1.0
   38    41    54    57   0.00000  1.0 1.0
   39    38    41    42   7.00000 -1.0 2.0
   39    38    41    54   7.00000 -1.0 2.0
   42    41    54    55   0.00000  1.0 1.0
   42    41    54    56   0.00000  1.0 1.0
   42    41    54    57   0.00000  1.0 1.0
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    38    33    37   1.10000 -1.0 2.0
   40    65    37    33   1.10000 -1.0 2.0
   33    39    38    41  15.00000 -1.0 2.0
   54    42    41    38  15.00000 -1.0 2.0
END
