* LIGAND DATABASE FILE (OPLS2005)
*
001      73    76    143    228     416
    1     0 S   NP   _N1_     1    28.68244    95.84596   -23.56231
    2     1 S   H    _HN1     2     1.02786   106.46788   -92.88501
    3     1 S   H    _H1_     3     1.02949    75.03842    12.25585
    4     1 S   H    _H2_     4     1.02828    34.65800   169.31483
    5     1 S   CT   _CA1     5     1.50114   135.99918   116.30463
    6     5 S   HC   _HA1     6     1.09573   105.18459    88.30054
    7     5 S   CO3  _C1_     7     1.53784   112.48320   -31.91668
    8     7 S   O2Z  _O11     8     1.26372   115.00541   -42.01492
    9     7 S   O2Z  _O12     9     1.26241   114.94683   137.10446
   10     5 S   CT   _CB1    10     1.53078   107.41917  -153.71710
   11    10 S   HC   HB11    11     1.09833   109.35387   -49.65625
   12    10 S   HC   HB12    12     1.09812   110.45425    66.95034
   13    10 S   CT   _CG1    13     1.52992   112.61460  -170.63091
   14    13 S   HC   HG11    14     1.09579   110.64443   -66.17548
   15    13 S   HC   HG12    15     1.09672   109.76668    53.05460
   16    13 S   C    _CD1    16     1.51805   112.20993   173.50348
   17    16 S   O    _OE1    17     1.22732   123.27723     7.86260
   18    16 S   N    _N2_    18     1.38655   111.67403  -172.21427
   19    18 S   H    _HN2    19     1.01579   118.93655     1.65446
   20    18 S   CT1  _CA2    20     1.46202   123.39855   177.10795
   21    20 S   HC   _HA2    21     1.09738   109.33119     3.23948
   22    20 S   C    _C2_    22     1.53584   108.79179  -112.17844
   23    22 S   O    _O2_    23     1.23056   122.25079  -149.51218
   24    20 S   CT   _CB2    32     1.53288   111.48729   125.22166
   25    24 S   HC   HB21    33     1.09530   110.05673    55.35943
   26    24 S   HC   HB22    34     1.09508   110.25279   174.59394
   27    22 S   N    _N3_    24     1.38329   113.75913    38.07651
   28    27 S   H    _HN3    25     1.01573   119.57641    -3.48307
   29    24 S   S    _SG2    35     1.82907   111.42948   -65.83800
   30    27 S   CT   _CA3    26     1.45286   123.24473   177.05045
   31    30 S   HC   HA31    27     1.09549   107.53456   -63.88096
   32    30 S   HC   HA32    28     1.09555   107.96029    52.55950
   33    29 S   CT   _C15    36     1.87566    99.45791   178.81024
   34    33 S   HC   _H3_    37     1.08614   102.71902    38.52779
   35    30 S   CO3  _C3_    29     1.52968   114.06032   174.52360
   36    35 S   O2Z  _O31    30     1.26382   116.06935    -1.03741
   37    35 S   O2Z  _O32    31     1.26429   114.42457   179.01404
   38    33 S   C3T  _C14    38     1.53440   104.25766   -76.68208
   39    38 S   HC   _H31    39     1.08350   115.15801   -13.54834
   40    33 S   CT   _C16    59     1.56793   112.34900   154.26548
   41    38 S   C3T  _C10    40     1.53689   121.28595   137.72520
   42    41 S   HC   _H27    41     1.08396   117.19443  -148.23054
   43    40 S   CT   _C18    60     1.54223   112.73046   -43.81394
   44    43 S   HC   _H36    61     1.09508   112.14211    69.16663
   45    43 S   HC   _H37    62     1.09416   111.82130   -53.46968
   46    43 S   HC   _H38    63     1.09667   110.74175  -174.49925
   47    40 S   OH   _O21    64     1.44325   106.10212    72.19625
   48    47 S   HO   _H39    65     0.97243   108.28566  -173.67225
   49    41 S   CM   _C5_    42     1.45537   117.85353    -4.21621
   50    38 S   O3T  _O20    73     1.42724   118.29680  -154.57277
   51    49 S   CM   _C4_    43     1.33279   126.03417    90.24303
   52    51 S   HC   _H23    44     1.08128   124.13998    12.33764
   53    51 S   CT   _C9_    45     1.47323   110.32741  -148.98699
   54    53 S   HC   _H26    46     1.09397   111.65821  -139.44899
   55    53 S   CT   _C12    47     1.55086   111.52130    92.21718
   56    55 S   HC   _H29    48     1.09624   110.02379   -85.67687
   57    53 S   OS   _O18    70     1.43578   102.38164   -22.76952
   58    55 S   CT   _C11    49     1.53321   112.13847   156.65104
   59    58 S   HC   _H28    50     1.09671   111.22655   -46.52672
   60    49 S   CO4  _C6_    71     1.47505   127.18596   -73.64147
   61    60 S   O    _O16    72     1.21821   125.44991   -18.83381
   62    58 S   CO4  _C7_    51     1.50832   101.48774  -160.56932
   63    62 S   O    _O17    52     1.22077   126.22034  -160.43557
   64    58 S   CT   _C17    66     1.51938   113.61149    78.79609
   65    64 S   HC   _H33    67     1.09558   111.51280    57.28775
   66    64 S   HC   _H34    68     1.09401   111.17469   -63.75679
   67    64 S   HC   _H35    69     1.09541   110.61587   176.49820
   68    62 S   OS   _O19    53     1.36790   109.49770    20.85477
   69    55 S   CT   _C13    54     1.52931   117.87670    39.88816
   70    69 S   HC   _H30    55     1.09946   109.38048    46.92807
   71    69 S   CT   _C8_    56     1.55225   121.39363   -77.65732
   72    71 S   HC   _H24    57     1.09050   109.53375    79.57829
   73    71 S   HC   _H25    58     1.10218   104.85645  -171.37395
  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  10   5   4   3
  18   8   2   1   1  11   5  15   9   4   9   4   3   2   5   1
   9   2  10   5  14   6  17   9   4  11   8   1   1   9   3   5
   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    71    40    43    47    50  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    49    69    71    72    73    40    43    44    45    46    47    48    50  
   38    39    41    71    40    43    47    50  
   36    37  
   37  
    0  
   39    41    42    49    51    71    40    43    47    60    50  
   41    42    49    40    50  
   43    44    45    46    47    48    50    41    55    68    69    70    71    72    73  
   42    49    51    52    53    57    60    61    50  
   49    51    60    50  
   44    45    46    47    48    69    71    72    73  
   45    46    47    71  
   46    47    71  
   47    71  
   48    69    71    72    73  
   71  
   51    52    53    54    55    57    60    61    50  
   51    60  
   52    53    54    55    56    58    69    57    60    61  
   53    54    55    57    60  
   54    55    56    58    59    62    68    69    70    71    64    57    60    61  
   55    56    58    69    57    60  
   56    58    59    62    63    68    69    70    71    72    73    64    65    66    67    57    60  
   58    59    62    68    69    70    71    64    57  
   60    61    58    69  
   59    62    63    68    69    70    71    64    65    66    67  
   62    63    68    69    64    65    66    67  
   61  
    0  
   63    68    69    70    71    64    65    66    67  
   68    69    64  
   65    66    67    68    69  
   66    67  
   67  
    0  
   69    70    71    72    73  
   70    71    72    73  
   71    72    73  
   72    73  
   73  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   51   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   58   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   62   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   64   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   69   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    34   340.000  1.090
   33    38   275.000  1.510
   33    40   268.000  1.529
   38    39   340.000  1.088
   38    41   260.000  1.509
   38    50   335.000  1.432
   41    42   340.000  1.088
   41    49   305.000  1.480
   41    50   335.000  1.432
   49    51   549.000  1.340
   49    60   320.000  1.462
   51    52   340.000  1.080
   51    53   317.000  1.510
   53    54   340.000  1.090
   53    55   268.000  1.529
   53    57   320.000  1.410
   55    56   340.000  1.090
   55    58   268.000  1.529
   55    69   268.000  1.529
   58    59   340.000  1.090
   58    62   317.000  1.522
   58    64   268.000  1.529
   62    63   570.000  1.229
   62    68   214.000  1.327
   68    69   320.000  1.410
   69    70   340.000  1.090
   69    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    40   268.000  1.529
   40    43   268.000  1.529
   40    47   320.000  1.410
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   47    48   553.000  0.945
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   57    60   214.000  1.327
   60    61   570.000  1.229
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    38    39    40.00000  115.04500
   33    38    41    60.00000  120.94000
   33    38    50    80.00000  116.47100
   33    40    71    58.35000  112.70000
   33    40    43    58.35000  112.70000
   33    40    47    50.00000  109.50000
   38    33    34    45.00000  109.38400
   38    41    42    37.50000  117.20000
   38    41    49    60.00000  120.58800
   38    41    50    15.00000   60.43100
   38    50    41    15.00000   59.14900
   41    38    39    37.50000  117.20000
   41    49    51    55.00000  125.06700
   41    49    60    65.00000  114.68000
   49    41    42    40.00000  112.45000
   49    51    52    35.00000  120.00000
   49    51    53    70.00000  124.00000
   49    60    57    90.00000  111.29400
   49    60    61    80.00000  123.72100
   51    53    54    35.00000  109.50000
   51    53    55    70.00000  112.02700
   51    53    57    85.00000  110.90400
   53    51    52    35.00000  117.00000
   53    55    56    37.50000  110.70000
   53    55    58    58.35000  112.70000
   53    55    69    58.35000  112.70000
   53    57    60    83.00000  116.90000
   55    53    54    37.50000  110.70000
   55    58    59    37.50000  110.70000
   55    58    62    63.00000  111.10000
   55    58    64    58.35000  112.70000
   55    69    68    50.00000  109.50000
   55    69    70    37.50000  110.70000
   55    69    71    58.35000  112.70000
   58    55    56    37.50000  110.70000
   58    62    63    80.00000  120.40000
   58    62    68    81.00000  111.40000
   58    64    65    37.50000  110.70000
   58    64    66    37.50000  110.70000
   58    64    67    37.50000  110.70000
   62    58    59    35.00000  109.50000
   62    68    69    83.00000  116.90000
   68    62    63    83.00000  123.40000
   68    69    70    35.00000  109.50000
   68    69    71    50.00000  109.50000
   69    55    56    37.50000  110.70000
   69    55    58    58.35000  112.70000
   69    71    72    37.50000  110.70000
   69    71    73    37.50000  110.70000
   69    71    40    58.35000  112.70000
   71    69    70    37.50000  110.70000
   71    40    43    58.35000  112.70000
   71    40    47    50.00000  109.50000
   73    71    72    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.37300
   40    71    72    37.50000  110.70000
   40    71    73    37.50000  110.70000
   40    43    44    37.50000  110.70000
   40    43    45    37.50000  110.70000
   40    43    46    37.50000  110.70000
   40    47    48    55.00000  108.50000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   47    40    43    50.00000  109.50000
   64    58    59    37.50000  110.70000
   64    58    62    63.00000  111.10000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   57    53    54    35.00000  109.50000
   57    53    55    50.00000  109.50000
   57    60    61    83.00000  123.40000
   60    49    51    65.00000  118.96000
   50    38    39    50.00000  114.27700
   50    38    41    15.00000   60.43100
   50    41    42    50.00000  114.27700
   50    41    49    85.00000  114.23300
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  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    38    39   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    38    50   0.56750  1.0 1.0
   29    33    38    50  -0.07550 -1.0 2.0
   29    33    38    50   0.20000  1.0 3.0
   29    33    40    71   0.44750  1.0 1.0
   29    33    40    71  -0.17800 -1.0 2.0
   29    33    40    71   0.20200  1.0 3.0
   29    33    40    43   0.44750  1.0 1.0
   29    33    40    43  -0.17800 -1.0 2.0
   29    33    40    43   0.20200  1.0 3.0
   29    33    40    47   0.56750  1.0 1.0
   29    33    40    47  -0.07550 -1.0 2.0
   29    33    40    47   0.20000  1.0 3.0
   33    38    41    42   0.15000  1.0 3.0
   33    38    41    49   0.34400  1.0 1.0
   33    38    41    49   0.09450 -1.0 2.0
   33    38    41    49   0.11100  1.0 3.0
   33    38   -41    50   0.02550  1.0 1.0
   33    38   -41    50  -0.02600 -1.0 2.0
   33    38   -41    50   1.20400  1.0 3.0
   33    38   -50    41   0.06250  1.0 1.0
   33    38   -50    41  -0.01100 -1.0 2.0
   33    38   -50    41   0.28050  1.0 3.0
   33    40    43    44   0.15000  1.0 3.0
   33    40    43    45   0.15000  1.0 3.0
   33    40    43    46   0.15000  1.0 3.0
   33    40    47    48  -0.11600  1.0 1.0
   33    40    47    48  -0.09450 -1.0 2.0
   33    40    47    48   0.21250  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    38    50   0.23400  1.0 3.0
   34    33    40    71   0.15000  1.0 3.0
   34    33    40    43   0.15000  1.0 3.0
   34    33    40    47   0.23400  1.0 3.0
   38    33    40    71   0.47050  1.0 1.0
   38    33    40    71   0.03900 -1.0 2.0
   38    33    40    71   0.20100  1.0 3.0
   38    33    40    43   0.47050  1.0 1.0
   38    33    40    43   0.03900 -1.0 2.0
   38    33    40    43   0.20100  1.0 3.0
   38    33    40    47   0.86500  1.0 1.0
   38    33    40    47  -0.17500 -1.0 2.0
   38    33    40    47   0.20800  1.0 3.0
   38    41    49    51   0.09850  1.0 1.0
   38    41    49    51   0.15250 -1.0 2.0
   38    41    49    51  -0.50650  1.0 3.0
   38    41    49    60   0.09700  1.0 1.0
   38    41    49    60   0.15600 -1.0 2.0
   38    41    49    60  -0.50800  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    49   0.15000  1.0 3.0
   39    38   -41    50   0.23400  1.0 3.0
   39    38   -50    41   0.36800  1.0 3.0
   41    49    51    52   7.00000 -1.0 2.0
   41    49    51    53   7.00000 -1.0 2.0
   41    49    60    57  -0.15000  1.0 1.0
   41    49    60    57   0.89550 -1.0 2.0
   41    49    60    57  -0.06900  1.0 3.0
   41    49    60    61  -0.64400  1.0 1.0
   41    49    60    61   0.26850 -1.0 2.0
   42    41    49    51   0.00000  1.0 1.0
   42    41    49    60   0.15000  1.0 3.0
   42    41   -50    38   0.36800  1.0 3.0
   49    41   -50    38  -0.77900  1.0 1.0
   49    41   -50    38  -0.36900 -1.0 2.0
   49    41   -50    38   0.40400  1.0 3.0
   49    51    53    54   0.00000  1.0 1.0
   49    51    53    55   0.09850  1.0 1.0
   49    51    53    55   0.15250 -1.0 2.0
   49    51    53    55  -0.50650  1.0 3.0
   49    51   -53    57   0.39000  1.0 1.0
   49    51   -53    57  -0.05800 -1.0 2.0
   49    51   -53    57  -0.55150  1.0 3.0
   51    49   -60    57  -0.56150  1.0 1.0
   51    49   -60    57   2.19150 -1.0 2.0
   51    49    60    61   1.00000 -1.0 2.0
   51    53    55    56   0.15000  1.0 3.0
   51    53    55    58   0.34400  1.0 1.0
   51    53    55    58   0.09450 -1.0 2.0
   51    53    55    58   0.11100  1.0 3.0
   51    53    55    69   0.34400  1.0 1.0
   51    53    55    69   0.09450 -1.0 2.0
   51    53    55    69   0.11100  1.0 3.0
   51    53   -57    60  -0.82050  1.0 1.0
   51    53   -57    60   0.00600 -1.0 2.0
   51    53   -57    60   0.04400  1.0 3.0
   52    51    53    54   0.33100  1.0 3.0
   52    51    53    55   0.00000  1.0 1.0
   52    51    53    57   0.00000  1.0 1.0
   53    55    58    59   0.15000  1.0 3.0
   53    55    58    62  -0.95700  1.0 1.0
   53    55    58    62  -0.18200 -1.0 2.0
   53    55    58    62   0.29450  1.0 3.0
   53    55    58    64   0.56750  1.0 1.0
   53    55    58    64  -0.07550 -1.0 2.0
   53    55    58    64   0.20000  1.0 3.0
   53    55    69    68   0.62750  1.0 1.0
   53    55    69    68  -0.30950 -1.0 2.0
   53    55    69    68   0.27300  1.0 3.0
   53    55    69    70   0.15000  1.0 3.0
   53    55    69    71   0.56750  1.0 1.0
   53    55    69    71  -0.07550 -1.0 2.0
   53    55    69    71   0.20000  1.0 3.0
   53    57   -60    49   2.00000 -1.0 2.0
   53    57    60    61   3.00000 -1.0 2.0
   54    53    55    56   0.15000  1.0 3.0
   54    53    55    58   0.15000  1.0 3.0
   54    53    55    69   0.15000  1.0 3.0
   54    53    57    60   0.08050  1.0 3.0
   55    53    57    60  -0.25900  1.0 1.0
   55    53    57    60  -0.47000 -1.0 2.0
   55    53    57    60   0.11750  1.0 3.0
   55    58    62    63   0.30150 -1.0 2.0
   55    58   -62    68   0.36750  1.0 3.0
   55    58    64    65   0.15000  1.0 3.0
   55    58    64    66   0.15000  1.0 3.0
   55    58    64    67   0.15000  1.0 3.0
   55    69    71    72   0.15000  1.0 3.0
   55    69    71    73   0.15000  1.0 3.0
   55    69    71    40   0.56750  1.0 1.0
   55    69    71    40  -0.07550 -1.0 2.0
   55    69    71    40   0.20000  1.0 3.0
   56    55    58    59   0.15000  1.0 3.0
   56    55    58    62  -0.11250  1.0 3.0
   56    55    58    64   0.15000  1.0 3.0
   56    55    69    68   0.23400  1.0 3.0
   56    55    69    70   0.15000  1.0 3.0
   56    55    69    71   0.15000  1.0 3.0
   58    55   -69    68   0.62750  1.0 1.0
   58    55   -69    68  -0.30950 -1.0 2.0
   58    55   -69    68   0.27300  1.0 3.0
   58    55    69    70   0.15000  1.0 3.0
   58    55    69    71   0.56750  1.0 1.0
   58    55    69    71  -0.07550 -1.0 2.0
   58    55    69    71   0.20000  1.0 3.0
   58    62   -68    69   1.63150  1.0 1.0
   58    62   -68    69   2.92000 -1.0 2.0
   59    58    62    63   0.00000  1.0 1.0
   59    58    62    68   0.00000  1.0 1.0
   59    58    64    65   0.15000  1.0 3.0
   59    58    64    66   0.15000  1.0 3.0
   59    58    64    67   0.15000  1.0 3.0
   62    58    64    65  -0.11250  1.0 3.0
   62    58    64    66  -0.11250  1.0 3.0
   62    58    64    67  -0.11250  1.0 3.0
   62    68   -69    55  -0.25900  1.0 1.0
   62    68   -69    55  -0.47000 -1.0 2.0
   62    68   -69    55   0.11750  1.0 3.0
   62    68    69    70   0.08050  1.0 3.0
   62    68    69    71  -0.25900  1.0 1.0
   62    68    69    71  -0.47000 -1.0 2.0
   62    68    69    71   0.11750  1.0 3.0
   63    62    68    69   3.00000 -1.0 2.0
   68    69    71    72   0.23400  1.0 3.0
   68    69    71    73   0.23400  1.0 3.0
   68    69    71    40   0.62750  1.0 1.0
   68    69    71    40  -0.30950 -1.0 2.0
   68    69    71    40   0.27300  1.0 3.0
   69    55    58    59   0.15000  1.0 3.0
   69    55   -58    62  -0.95700  1.0 1.0
   69    55   -58    62  -0.18200 -1.0 2.0
   69    55   -58    62   0.29450  1.0 3.0
   69    55    58    64   0.56750  1.0 1.0
   69    55    58    64  -0.07550 -1.0 2.0
   69    55    58    64   0.20000  1.0 3.0
   69    71    40    33   0.56750  1.0 1.0
   69    71    40    33  -0.07550 -1.0 2.0
   69    71    40    33   0.20000  1.0 3.0
   69    71    40    43   0.56750  1.0 1.0
   69    71    40    43  -0.07550 -1.0 2.0
   69    71    40    43   0.20000  1.0 3.0
   69    71    40    47   0.86500  1.0 1.0
   69    71    40    47  -0.17500 -1.0 2.0
   69    71    40    47   0.20800  1.0 3.0
   70    69    71    72   0.15000  1.0 3.0
   70    69    71    73   0.15000  1.0 3.0
   70    69    71    40   0.15000  1.0 3.0
   71    40    43    44   0.15000  1.0 3.0
   71    40    43    45   0.15000  1.0 3.0
   71    40    43    46   0.15000  1.0 3.0
   71    40    47    48  -0.11600  1.0 1.0
   71    40    47    48  -0.09450 -1.0 2.0
   71    40    47    48   0.21250  1.0 3.0
   72    71    40    33   0.15000  1.0 3.0
   72    71    40    43   0.15000  1.0 3.0
   72    71    40    47   0.23400  1.0 3.0
   73    71    40    33   0.15000  1.0 3.0
   73    71    40    43   0.15000  1.0 3.0
   73    71    40    47   0.23400  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33    38    41   0.07850  1.0 1.0
   40    33    38    41  -0.03950 -1.0 2.0
   40    33    38    41   0.67350  1.0 3.0
   40    33    38    50   0.02550  1.0 1.0
   40    33    38    50  -0.02600 -1.0 2.0
   40    33    38    50   1.20400  1.0 3.0
   43    40    47    48  -0.11600  1.0 1.0
   43    40    47    48  -0.09450 -1.0 2.0
   43    40    47    48   0.21250  1.0 3.0
   47    40    43    44   0.23400  1.0 3.0
   47    40    43    45   0.23400  1.0 3.0
   47    40    43    46   0.23400  1.0 3.0
   64    58    62    63   0.30150 -1.0 2.0
   64    58    62    68   0.36750  1.0 3.0
   57    53    55    56   0.23400  1.0 3.0
   57    53    55    58   0.62750  1.0 1.0
   57    53    55    58  -0.30950 -1.0 2.0
   57    53    55    58   0.27300  1.0 3.0
   57    53    55    69   0.62750  1.0 1.0
   57    53    55    69  -0.30950 -1.0 2.0
   57    53    55    69   0.27300  1.0 3.0
   60    49    51    52   7.00000 -1.0 2.0
   60    49   -51    53   7.00000 -1.0 2.0
   50    38   -41    42   0.23400  1.0 3.0
   50    38   -41    49   0.61850  1.0 1.0
   50    38   -41    49  -0.22750 -1.0 2.0
   50    38   -41    49   0.15300  1.0 3.0
   50    41    49    51   0.39000  1.0 1.0
   50    41    49    51  -0.05800 -1.0 2.0
   50    41    49    51  -0.55150  1.0 3.0
   50    41    49    60   0.09700  1.0 1.0
   50    41    49    60   0.15600 -1.0 2.0
   50    41    49    60  -0.50800  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    35    36  10.50000 -1.0 2.0
   41    60    49    51   1.10000 -1.0 2.0
   53    52    51    49   1.10000 -1.0 2.0
   58    68    62    63  10.50000 -1.0 2.0
   49    57    60    61  10.50000 -1.0 2.0
END
