* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    133    205     388
    1     0 S   NP   _N1_     1    28.67882    96.51992   -23.24487
    2     1 S   H    _HN1     2     1.02949    71.15626    13.15249
    3     1 S   H    _H1_     3     1.02828    39.27806   168.30112
    4     1 S   H    _H2_     4     1.02788   104.92381   -91.54372
    5     1 S   CT   _CA1     5     1.50117   139.38165   112.81676
    6     5 S   HC   _HA1     6     1.09574   105.18240    93.15965
    7     5 S   CO3  _C1_     7     1.53782   112.48340   -27.06335
    8     7 S   O2Z  _O11     8     1.26374   115.00375   -42.05109
    9     7 S   O2Z  _O12     9     1.26241   114.94771   137.05384
   10     5 S   CT   _CB1    10     1.53073   107.41570  -148.85301
   11    10 S   HC   HB11    11     1.09836   109.35399   -49.57235
   12    10 S   HC   HB12    12     1.09812   110.45634    67.03346
   13    10 S   CT   _CG1    13     1.52997   112.61779  -170.53664
   14    13 S   HC   HG11    14     1.09577   110.66609   -66.35557
   15    13 S   HC   HG12    15     1.09672   109.75144    52.88243
   16    13 S   C    _CD1    16     1.51802   112.16192   173.34324
   17    16 S   O    _OE1    17     1.22738   123.25896     8.84831
   18    16 S   N    _N2_    18     1.38659   111.71695  -171.23198
   19    18 S   H    _HN2    19     1.01575   118.93891     1.56798
   20    18 S   CT1  _CA2    20     1.46199   123.37246   176.96681
   21    20 S   HC   _HA2    21     1.09739   109.35903     4.43447
   22    20 S   C    _C2_    22     1.53609   108.58475  -111.02284
   23    22 S   O    _O2_    23     1.23065   122.30005  -147.54719
   24    20 S   CT   _CB2    32     1.53375   111.71778   126.44445
   25    24 S   HC   HB21    33     1.09558   109.92669    56.22748
   26    24 S   HC   HB22    34     1.09356   109.82165   174.74737
   27    22 S   N    _N3_    24     1.38331   113.74093    39.84821
   28    27 S   H    _HN3    25     1.01570   119.61793    -3.15436
   29    24 S   S    _SG2    35     1.83071   111.38330   -64.10381
   30    27 S   CT   _CA3    26     1.45289   123.23452   177.21934
   31    30 S   HC   HA31    27     1.09548   107.49338   -65.07633
   32    30 S   HC   HA32    28     1.09556   108.00760    51.36983
   33    29 S   CT   _C11    36     1.86466   101.18618  -164.04292
   34    30 S   CO3  _C3_    29     1.52968   114.07295   173.37952
   35    34 S   O2Z  _O31    30     1.26379   116.08137    -0.69239
   36    34 S   O2Z  _O32    31     1.26430   114.41336   179.37442
   37    33 S   CO4  _C18    37     1.52070   104.55586  -168.16908
   38    37 S   O    _O34    38     1.22362   125.78125    64.52475
   39    33 S   CT   _C12    57     1.55815   110.84686   -49.60856
   40    39 S   HC   _H9_    58     1.09844   108.78868    80.93302
   41    39 S   HC   _H10    59     1.09884   109.51859   -34.64519
   42    37 S   OS   _O35    39     1.36292   111.00689  -117.11378
   43    42 S   CT   _C9_    40     1.42861   110.77488    10.76988
   44    43 S   HC   _H3_    41     1.09776   105.14967    97.05291
   45    43 S   C5BC _C8_    42     1.51041   112.36135  -146.02440
   46    33 S   CT   _C10    68     1.54664   113.11605    80.36816
   47    46 S   HC   _H4_    69     1.08930   111.92467  -137.86320
   48    45 S   C5BC _C5_    43     1.44420   123.65994  -121.49512
   49    46 S   OH   _O36    70     1.42591   114.28427   -19.00507
   50    49 S   HO   _H19    71     0.97301   107.71582   178.73948
   51    48 S   C5A  _C6_    44     1.37501   106.21230   179.51543
   52    51 S   HA   _H8_    45     1.08060   133.52355  -179.90309
   53    48 S   CT   _C4_    64     1.48468   127.77616    -0.39614
   54    53 S   HC   _H5_    65     1.09469   110.51201   -57.71009
   55    53 S   HC   _H6_    66     1.09461   110.46228    62.51982
   56    53 S   HC   _H7_    67     1.09494   111.33731  -177.57158
   57    51 S   OA   _O33    46     1.34802   110.86710     0.23739
   58    45 S   C5A  _C7_    47     1.39771   131.14062    58.14009
   59    58 S   CT   _C16    48     1.50150   137.86049     2.40037
   60    59 S   HC   _H14    49     1.09905   107.14732   107.22481
   61    59 S   HC   _H15    50     1.09853   108.85266  -139.97090
   62    59 S   CM   _C15    51     1.50808   117.07836   -16.50222
   63    62 S   CM   _C14    52     1.34644   118.52716    92.63529
   64    63 S   HC   _H13    53     1.09025   118.00571     7.36564
   65    62 S   CT   _C17    60     1.50363   115.22988   -84.65197
   66    65 S   HC   _H16    61     1.09551   109.52205   -65.66740
   67    65 S   HC   _H17    62     1.09149   113.58444   174.72088
   68    65 S   HC   _H18    63     1.09405   111.01934    53.16811
   69    63 S   CT   _C13    54     1.49424   127.84322  -163.86178
   70    69 S   HC   _H11    55     1.09686   108.44423  -129.17384
   71    69 S   HC   _H12    56     1.09273   112.52321   -12.66593
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  12   5   4   3
  17   2   1   1  12   4  13   6   5   8  12   6  16   6   2   9
   1   1   8   3   5   2   1   1   5   6  10   4   3   9   8   4
   4   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    46    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    43    69    39    40    41    46    47    49  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    44    45    63    69    70    71    39    40    41    46    47    49    50  
   35    36  
   36  
    0  
   38    42    43    44    45    69    39    40    41    46    47    49  
   42    43    39    46  
   40    41    46    47    49    42    43    62    63    64    69    70    71  
   41    46    63    69    70    71  
   46    63    69    70    71  
   43    44    45    48    58    46    47    49  
   44    45    48    51    57    58    59    53    46    47    49    50  
   45    48    58    46    47    49  
   48    51    52    57    58    59    60    61    62    53    54    55    56    46    47    49  
   47    49    50    48    58    69  
   49    50  
   51    52    57    58    59    53    54    55    56  
   50  
    0  
   52    57    58    59    53    54    55    56  
   57    58    53  
   54    55    56    57    58  
   55    56  
   56  
    0  
   58    59    60    61    62  
   59    60    61    62    63    65  
   60    61    62    63    64    69    65    66    67    68  
   61    62    63    65  
   62    63    65  
   63    64    69    70    71    65    66    67    68  
   64    69    70    71    65    66    67    68  
   69    70    71    65  
   66    67    68    69  
   67    68  
   68  
    0  
   70    71  
   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  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   43   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   45   3.5500   0.0760  -0.143000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   49   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   50   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   51   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   58   3.5500   0.0700   0.008000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   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   222.000  1.810
   33    37   317.000  1.522
   33    39   268.000  1.529
   33    46   268.000  1.529
   37    38   570.000  1.229
   37    42   214.000  1.327
   42    43   320.000  1.410
   43    44   340.000  1.090
   43    45   285.000  1.502
   43    46   268.000  1.529
   45    48   469.000  1.424
   45    58   546.000  1.367
   48    51   546.000  1.367
   48    53   285.000  1.502
   51    52   367.000  1.080
   51    57   340.000  1.360
   57    58   340.000  1.360
   58    59   295.000  1.489
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   317.000  1.510
   62    63   549.000  1.340
   62    65   317.000  1.510
   63    64   340.000  1.080
   63    69   317.000  1.510
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    39   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   46    47   340.000  1.090
   46    49   320.000  1.410
   49    50   553.000  0.945
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  110.18000
   29    33    39    75.00000  111.63000
   29    33    46    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    42    81.00000  111.40000
   33    39    69    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    46    43    58.35000  112.70000
   33    46    47    37.50000  110.70000
   33    46    49    50.00000  109.50000
   37    42    43    83.00000  116.90000
   42    37    38    83.00000  123.40000
   42    43    44    35.00000  109.50000
   42    43    45    85.00000  111.85700
   42    43    46    50.00000  109.50000
   43    45    48    60.00000  130.00000
   43    45    58    60.00000  130.00000
   43    46    47    37.50000  110.70000
   43    46    49    50.00000  109.50000
   45    43    44    35.00000  109.50000
   45    48    51    70.00000  107.30000
   45    48    53    60.00000  130.00000
   45    58    57    70.00000  110.60000
   45    58    59    50.00000  133.50000
   48    51    52    35.00000  132.10000
   48    51    57    70.00000  110.60000
   48    53    54    35.00000  109.50000
   48    53    55    35.00000  109.50000
   48    53    56    35.00000  109.50000
   51    57    58    70.00000  106.50000
   57    51    52    35.00000  113.40000
   57    58    59    80.00000  116.10000
   58    45    48    70.00000  107.30000
   58    59    60    45.00000  110.47400
   58    59    61    45.00000  110.47400
   58    59    62    70.00000  112.40000
   59    62    63    70.00000  124.00000
   59    62    65    65.00000  117.92700
   61    59    60    33.00000  107.80000
   62    59    60    35.00000  109.50000
   62    59    61    35.00000  109.50000
   62    63    64    35.00000  120.00000
   62    63    69    70.00000  124.00000
   62    65    66    35.00000  109.50000
   62    65    67    35.00000  109.50000
   62    65    68    35.00000  109.50000
   63    69    70    35.00000  109.50000
   63    69    71    35.00000  109.50000
   63    69    39    70.00000  112.02700
   69    63    64    35.00000  117.00000
   69    39    40    37.50000  110.70000
   69    39    41    37.50000  110.70000
   71    69    70    33.00000  107.80000
   39    33    37    63.00000  111.10000
   39    69    70    37.50000  110.70000
   39    69    71    37.50000  110.70000
   41    39    40    33.00000  107.80000
   65    62    63    70.00000  124.00000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   53    48    51    60.00000  130.00000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   46    33    37    63.00000  111.10000
   46    33    39    58.35000  112.70000
   46    43    44    37.50000  110.70000
   46    43    45    70.00000  112.17500
   46    49    50    55.00000  108.50000
   49    46    47    35.00000  109.50000
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   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   24    29    33    46   0.01700  1.0 1.0
   24    29    33    46  -0.23550 -1.0 2.0
   24    29    33    46   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   0.30150 -1.0 2.0
   29    33    37    42   0.40000  1.0 3.0
   29    33    39    69   0.44750  1.0 1.0
   29    33    39    69  -0.17800 -1.0 2.0
   29    33    39    69   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    46    43   0.44750  1.0 1.0
   29    33    46    43  -0.17800 -1.0 2.0
   29    33    46    43   0.20200  1.0 3.0
   29    33    46    47   0.15000  1.0 3.0
   29    33    46    49   0.56750  1.0 1.0
   29    33    46    49  -0.07550 -1.0 2.0
   29    33    46    49   0.20000  1.0 3.0
   33    37   -42    43   1.63150  1.0 1.0
   33    37   -42    43   2.92000 -1.0 2.0
   33    46    49    50  -0.11600  1.0 1.0
   33    46    49    50  -0.09450 -1.0 2.0
   33    46    49    50   0.21250  1.0 3.0
   37    33    39    69  -0.95700  1.0 1.0
   37    33    39    69  -0.18200 -1.0 2.0
   37    33    39    69   0.29450  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    41  -0.11250  1.0 3.0
   37    33   -46    43  -0.95700  1.0 1.0
   37    33   -46    43  -0.18200 -1.0 2.0
   37    33   -46    43   0.29450  1.0 3.0
   37    33    46    47  -0.11250  1.0 3.0
   37    33    46    49  -0.09450  1.0 1.0
   37    33    46    49  -1.12950 -1.0 2.0
   37    33    46    49   0.54000  1.0 3.0
   37    42    43    44   0.08050  1.0 3.0
   37    42    43    45  -0.43900 -1.0 2.0
   37    42    43    45   0.14100  1.0 3.0
   37    42   -43    46  -0.25900  1.0 1.0
   37    42   -43    46  -0.47000 -1.0 2.0
   37    42   -43    46   0.11750  1.0 3.0
   38    37    42    43   3.00000 -1.0 2.0
   42    43    45    48   0.64500  1.0 1.0
   42    43    45    48   0.14800 -1.0 2.0
   42    43    45    48   0.20650  1.0 3.0
   42    43    45    58   0.64500  1.0 1.0
   42    43    45    58   0.14800 -1.0 2.0
   42    43    45    58   0.20650  1.0 3.0
   42    43   -46    33   0.62750  1.0 1.0
   42    43   -46    33  -0.30950 -1.0 2.0
   42    43   -46    33   0.27300  1.0 3.0
   42    43    46    47   0.23400  1.0 3.0
   42    43    46    49   3.69350  1.0 1.0
   42    43    46    49  -1.82950 -1.0 2.0
   43    45    48    51   3.62500 -1.0 2.0
   43    45    48    53   3.62500 -1.0 2.0
   43    45    58    57   3.62500 -1.0 2.0
   43    45    58    59   3.62500 -1.0 2.0
   43    46    49    50  -0.11600  1.0 1.0
   43    46    49    50  -0.09450 -1.0 2.0
   43    46    49    50   0.21250  1.0 3.0
   44    43    45    48   0.00000  1.0 1.0
   44    43    45    58   0.00000  1.0 1.0
   44    43    46    33   0.15000  1.0 3.0
   44    43    46    47   0.15000  1.0 3.0
   44    43    46    49   0.23400  1.0 3.0
   45    43    46    33  -0.03700  1.0 1.0
   45    43    46    33   0.37200 -1.0 2.0
   45    43    46    33  -0.47300  1.0 3.0
   45    43    46    47   0.43200  1.0 3.0
   45    43    46    49   1.13150  1.0 1.0
   45    43    46    49  -1.01400 -1.0 2.0
   45    48    51    52   3.62500 -1.0 2.0
   45    48   -51    57   3.62500 -1.0 2.0
   45    48    53    54   0.00000  1.0 1.0
   45    48    53    55   0.00000  1.0 1.0
   45    48    53    56   0.00000  1.0 1.0
   45    58    59    60   0.00000  1.0 1.0
   45    58    59    61   0.00000  1.0 1.0
   45    58    59    62   0.18050 -1.0 2.0
   48    45   -58    57   3.62500 -1.0 2.0
   48    45    58    59   3.62500 -1.0 2.0
   48    51   -57    58   3.62500 -1.0 2.0
   51    48    53    54   0.00000  1.0 1.0
   51    48    53    55   0.00000  1.0 1.0
   51    48    53    56   0.00000  1.0 1.0
   51    57   -58    45   3.62500 -1.0 2.0
   51    57    58    59   3.62500 -1.0 2.0
   52    51    57    58   3.62500 -1.0 2.0
   57    58    59    60   0.00000  1.0 1.0
   57    58    59    61   0.00000  1.0 1.0
   57    58    59    62   0.04300 -1.0 2.0
   58    45   -48    51   3.62500 -1.0 2.0
   58    45    48    53   3.62500 -1.0 2.0
   58    59    62    63   1.44450  1.0 1.0
   58    59    62    63   0.06600 -1.0 2.0
   58    59    62    63   0.29250  1.0 3.0
   58    59    62    65   0.09700  1.0 1.0
   58    59    62    65   0.15600 -1.0 2.0
   58    59    62    65  -0.50800  1.0 3.0
   59    62    63    64   7.00000 -1.0 2.0
   59    62    63    69   7.00000 -1.0 2.0
   59    62    65    66   0.34800  1.0 3.0
   59    62    65    67   0.34800  1.0 3.0
   59    62    65    68   0.34800  1.0 3.0
   60    59    62    63   0.00000  1.0 1.0
   60    59    62    65   0.34800  1.0 3.0
   61    59    62    63   0.00000  1.0 1.0
   61    59    62    65   0.34800  1.0 3.0
   62    63    69    70   0.00000  1.0 1.0
   62    63    69    71   0.00000  1.0 1.0
   62    63    69    39   0.09850  1.0 1.0
   62    63    69    39   0.15250 -1.0 2.0
   62    63    69    39  -0.50650  1.0 3.0
   63    62    65    66   0.00000  1.0 1.0
   63    62    65    67   0.00000  1.0 1.0
   63    62    65    68   0.00000  1.0 1.0
   63    69    39    33   0.34400  1.0 1.0
   63    69    39    33   0.09450 -1.0 2.0
   63    69    39    33   0.11100  1.0 3.0
   63    69    39    40   0.15000  1.0 3.0
   63    69    39    41   0.15000  1.0 3.0
   64    63    69    70   0.33100  1.0 3.0
   64    63    69    71   0.33100  1.0 3.0
   64    63    69    39   0.00000  1.0 1.0
   70    69    39    33   0.15000  1.0 3.0
   70    69    39    40   0.15000  1.0 3.0
   70    69    39    41   0.15000  1.0 3.0
   71    69    39    33   0.15000  1.0 3.0
   71    69    39    40   0.15000  1.0 3.0
   71    69    39    41   0.15000  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    42   0.36750  1.0 3.0
   39    33    46    43   0.56750  1.0 1.0
   39    33    46    43  -0.07550 -1.0 2.0
   39    33    46    43   0.20000  1.0 3.0
   39    33    46    47   0.15000  1.0 3.0
   39    33    46    49   0.86500  1.0 1.0
   39    33    46    49  -0.17500 -1.0 2.0
   39    33    46    49   0.20800  1.0 3.0
   65    62    63    64   7.00000 -1.0 2.0
   65    62    63    69   7.00000 -1.0 2.0
   53    48    51    52   3.62500 -1.0 2.0
   53    48    51    57   3.62500 -1.0 2.0
   46    33    37    38   0.30150 -1.0 2.0
   46    33   -37    42   0.36750  1.0 3.0
   46    33    39    69   0.56750  1.0 1.0
   46    33    39    69  -0.07550 -1.0 2.0
   46    33    39    69   0.20000  1.0 3.0
   46    33    39    40   0.15000  1.0 3.0
   46    33    39    41   0.15000  1.0 3.0
   46    43    45    48   0.04150 -1.0 2.0
   46    43    45    58   0.04150 -1.0 2.0
   47    46    49    50   0.19450  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
   33    42    37    38  10.50000 -1.0 2.0
   48    58    45    43   4.00000 -1.0 2.0
   51    53    48    45   4.00000 -1.0 2.0
   57    52    51    48   1.10000 -1.0 2.0
   57    59    58    45   4.00000 -1.0 2.0
   59    65    62    63   1.10000 -1.0 2.0
   69    64    63    62   1.10000 -1.0 2.0
END
