* LIGAND DATABASE FILE (OPLS2005)
*
001      72    73    132    207     382
    1     0 S   NP   _N1_     1    28.71132    95.83800   -24.61462
    2     1 S   H    _HN1     2     1.02821    31.52628   171.44831
    3     1 S   H    _H1_     3     1.02801   115.16691  -105.24841
    4     1 S   H    _H2_     4     1.02945    75.85251    -1.31358
    5     1 S   CT   _CA1     5     1.50135   126.98805   103.77549
    6     5 S   HC   _HA1     6     1.09577   105.13864    90.51827
    7     5 S   CO3  _C1_     7     1.53744   112.41737   -29.68165
    8     7 S   O2Z  _O11     8     1.26381   115.00232   -43.89027
    9     7 S   O2Z  _O12     9     1.26229   114.92484   134.97295
   10     5 S   CT   _CB1    10     1.53031   107.37093  -151.55240
   11    10 S   HC   HB11    11     1.09854   109.28475   -49.16741
   12    10 S   HC   HB12    12     1.09810   110.51045    67.38747
   13    10 S   CT   _CG1    13     1.53063   112.69257  -170.06538
   14    13 S   HC   HG11    14     1.09556   110.85793   -69.11133
   15    13 S   HC   HG12    15     1.09659   109.62725    50.16428
   16    13 S   C    _CD1    16     1.51820   111.55802   170.73825
   17    16 S   O    _OE1    17     1.22793   123.00801    19.34489
   18    16 S   N    _N2_    18     1.38626   112.11339  -160.64007
   19    18 S   H    _HN2    19     1.01582   119.01263     0.18975
   20    18 S   CT1  _CA2    20     1.46222   123.24309   175.24717
   21    20 S   HC   _HA2    21     1.09741   109.30152     9.12641
   22    20 S   C    _C2_    22     1.53724   108.81815  -106.39469
   23    22 S   O    _O2_    23     1.23089   122.18991  -148.38043
   24    20 S   CT   _CB2    32     1.53441   111.72126   131.22004
   25    24 S   HC   HB21    33     1.09344   109.56357    58.31047
   26    24 S   HC   HB22    34     1.09460   109.45732   176.86975
   27    22 S   N    _N3_    24     1.38289   113.89689    39.05352
   28    27 S   H    _HN3    25     1.01530   119.64244    -2.96504
   29    24 S   S    _SG2    35     1.82749   111.20291   -64.15092
   30    27 S   CT   _CA3    26     1.45282   123.37902   177.37095
   31    30 S   HC   HA31    27     1.09544   107.49178   -65.61995
   32    30 S   HC   HA32    28     1.09553   108.03735    50.86624
   33    29 S   CT   _C9_    36     1.85362   102.69780   165.99822
   34    30 S   CO3  _C3_    29     1.53007   113.98165   172.88399
   35    34 S   O2Z  _O31    30     1.26397   116.07925    -0.41684
   36    34 S   O2Z  _O32    31     1.26424   114.41874   179.64557
   37    33 S   CT   _C8_    37     1.56401   114.69453    47.60424
   38    37 S   HC   _H10    38     1.09363   114.41409    77.09514
   39    37 S   HC   _H11    39     1.09298   110.94244   -43.99681
   40    33 S   S    _S1_    60     1.87200   108.13871   170.15222
   41    37 S   C4T  _C7_    40     1.53485   104.05952  -161.10202
   42    41 S   HC   _H5_    41     1.09714   112.79763   -85.90475
   43    40 S   CM   _C13    61     1.73202   103.39491   -62.75073
   44    43 S   HC   _H12    62     1.08471   119.02914     2.84806
   45    41 S   C4T  _C6_    42     1.56446   126.77290   127.06400
   46    45 S   HC   _H4_    43     1.09983   111.73581   154.39169
   47    41 S   N4   _N4_    46     1.47386   101.03717    32.94820
   48    43 S   CM   _C14    63     1.33888   121.17157  -177.33464
   49    48 S   HC   _H13    64     1.08612   121.86072     0.12511
   50    45 S   C4   _C11    44     1.54805    85.16633   -94.65582
   51    50 S   O    _O33    45     1.21001   136.06131   167.18818
   52    33 S   CT1  _C10    47     1.55810   112.43826   -69.12882
   53    52 S   HC   _H6_    48     1.09755   110.19963    41.23084
   54    45 S   CT   _C5_    52     1.52171   118.52329    22.58298
   55    54 S   HC   _H3_    53     1.09506   112.05435   -53.22717
   56    48 S   N    _N5_    65     1.37299   122.14989  -179.82754
   57    56 S   H    _H14    66     1.01647   117.60816     0.17017
   58    52 S   CO3  _C12    49     1.53849   119.99186   -80.07689
   59    58 S   O2Z  _O35    50     1.26486   114.60500    62.14958
   60    58 S   O2Z  _O34    51     1.26304   116.31276  -118.75127
   61    54 S   CT   _C4_    54     1.52189   110.74186  -175.34066
   62    61 S   HC   _H7_    55     1.09591   111.06105   -58.63440
   63    61 S   HC   _H8_    56     1.09537   110.41814  -176.83288
   64    61 S   HC   _H9_    57     1.09379   111.66993    62.29438
   65    54 S   OH   _O37    58     1.42588   108.88773    66.51353
   66    65 S   HO   _H18    59     0.97201   107.77566   -68.00170
   67    56 S   C    _C15    67     1.38718   123.52794  -179.91153
   68    67 S   O    _O36    68     1.22818   126.09438     0.44675
   69    67 S   CT   _C16    69     1.50570   112.06827   179.95154
   70    69 S   HC   _H15    70     1.09374   110.06186    54.40045
   71    69 S   HC   _H16    71     1.09353   109.63435   -66.12430
   72    69 S   HC   _H17    72     1.09350   109.73006   174.08026
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  11   5   4   3
  17   2   1   1  14   7   6  10  13   6   7   3  13   7   8   6
   3   8   2   4   3   7   6   7   3   2   1   1   5   3   2   1
   1   1   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    52    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41    47    52    53    58    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    42    45    50    47    52    53    58    59    60    40    43    44    48  
   35    36  
   36  
    0  
   38    39    41    42    45    46    50    47    52    53    58    54    40    43  
   39    41    42    45    47    52    40  
   41    42    45    47    52    40  
   43    44    48    49    56    41    47    52    53    58  
   42    45    46    50    51    47    52    53    58    54    55    61    65  
   45    46    50    47    52    54  
   44    48    49    56    57    67    52  
   48    49    56  
   46    50    51    47    52    54    55    61    62    63    64    65    66  
   50    51    47    54    55    61    65  
   52    53    58    59    60    54    50    51  
   49    56    57    67    68    69  
   56    57    67  
   51    52    53    58    54    55    61    65  
   52    54  
   53    58    59    60  
   58    59    60  
   55    61    62    63    64    65    66  
   61    62    63    64    65    66  
   57    67    68    69    70    71    72  
   67    68    69  
   59    60  
   60  
    0  
   62    63    64    65    66  
   63    64    65  
   64    65  
   65  
   66  
    0  
   68    69    70    71    72  
   69    70    71    72  
   70    71    72  
   71    72  
   72  
    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   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   41   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   43   3.5500   0.0760  -0.107500   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   48   3.5500   0.0760  -0.063700   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   52   3.5000   0.0660   0.040000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.5000   0.0660   0.263800   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   57   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   58   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   67   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   68   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   69   3.5000   0.0660  -0.180000   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
   72   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   268.000  1.529
   33    52   268.000  1.529
   33    40   222.000  1.810
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    41   260.000  1.519
   41    42   340.000  1.090
   41    45   268.000  1.529
   41    47   305.000  1.456
   45    46   340.000  1.090
   45    50   250.000  1.540
   45    54   260.000  1.519
   50    51   930.000  1.212
   50    47   440.000  1.369
   47    52   337.000  1.449
   52    53   340.000  1.090
   52    58   317.000  1.522
   58    59   656.000  1.250
   58    60   656.000  1.250
   54    55   340.000  1.090
   54    61   268.000  1.529
   54    65   320.000  1.410
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   65    66   553.000  0.945
   40    43   240.000  1.763
   43    44   340.000  1.080
   43    48   549.000  1.340
   48    49   340.000  1.080
   48    56   400.000  1.384
   56    57   434.000  1.010
   56    67   490.000  1.335
   67    68   570.000  1.229
   67    69   317.000  1.522
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    52    75.00000  108.68000
   29    33    40    75.00000  118.28000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    41    70.00000  112.98000
   33    52    47    80.00000  109.70000
   33    52    53    37.50000  110.70000
   33    52    58    63.00000  111.10000
   33    40    43    85.00000  102.41200
   37    41    42    45.00000  112.72800
   37    41    45    65.00000  119.52000
   37    41    47    80.00000  110.05700
   39    37    38    33.00000  107.80000
   41    37    38    45.00000  111.22300
   41    37    39    45.00000  111.22300
   41    45    46    37.50000  110.70000
   41    45    50   100.00000   86.36000
   41    45    54    65.00000  119.52000
   41    47    50   100.00000   93.00000
   41    47    52    50.00000  132.70000
   45    41    42    37.50000  110.70000
   45    50    51    60.00000  136.58000
   45    50    47    95.00000   92.72400
   45    54    55    45.00000  111.22300
   45    54    61    70.00000  112.98000
   45    54    65    50.00000  109.50000
   50    45    46    40.00000  113.37500
   50    47    52    50.00000  132.10000
   47    41    42    50.00000  112.01000
   47    41    45   105.00000   87.49700
   47    50    51    75.00000  131.60000
   47    52    53    35.00000  109.50000
   47    52    58    63.00000  110.10000
   52    33    37    58.35000  112.70000
   52    58    59    70.00000  117.00000
   52    58    60    70.00000  117.00000
   58    52    53    35.00000  109.50000
   60    58    59    80.00000  126.00000
   54    45    46    45.00000  112.72800
   54    45    50    63.00000  111.10000
   54    61    62    37.50000  110.70000
   54    61    63    37.50000  110.70000
   54    61    64    37.50000  110.70000
   54    65    66    55.00000  108.50000
   61    54    55    37.50000  110.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   65    54    55    35.00000  109.50000
   65    54    61    50.00000  109.50000
   40    33    37    75.00000  111.63000
   40    33    52    75.00000  108.68000
   40    43    44    40.00000  115.49800
   40    43    48    65.00000  122.11800
   43    48    49    35.00000  120.00000
   43    48    56    75.00000  120.83300
   48    43    44    35.00000  120.00000
   48    56    57    45.00000  117.55000
   48    56    67    70.00000  120.89900
   56    48    49    45.00000  111.09300
   56    67    68    80.00000  122.90000
   56    67    69    70.00000  116.60000
   67    56    57    35.00000  119.80000
   67    69    70    35.00000  109.50000
   67    69    71    35.00000  109.50000
   67    69    72    35.00000  109.50000
   69    67    68    80.00000  120.40000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   0.21350  1.0 3.0
   24    29    33    40   0.08500  1.0 1.0
   24    29    33    40  -0.53150 -1.0 2.0
   24    29    33    40   0.48050  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    41   0.44750  1.0 1.0
   29    33    37    41  -0.17800 -1.0 2.0
   29    33    37    41   0.20200  1.0 3.0
   29    33    52    47   0.71400  1.0 1.0
   29    33    52    47   0.04300 -1.0 2.0
   29    33    52    47   0.01450  1.0 3.0
   29    33    52    53   0.15000  1.0 3.0
   29    33    52    58  -2.17200  1.0 1.0
   29    33    52    58  -0.85700 -1.0 2.0
   29    33    40    43   0.08500  1.0 1.0
   29    33    40    43  -0.53150 -1.0 2.0
   29    33    40    43   0.48050  1.0 3.0
   33    37    41    42   0.15000  1.0 3.0
   33    37    41    45   0.04050  1.0 1.0
   33    37    41    45   0.63700 -1.0 2.0
   33    37    41    45   0.17650  1.0 3.0
   33    37   -41    47   0.43900  1.0 1.0
   33    37   -41    47   0.49100 -1.0 2.0
   33    37   -41    47   0.28400  1.0 3.0
   33    52    58    59   0.00000  1.0 1.0
   33    52    58    60   0.00000  1.0 1.0
   33    40    43    44   1.00000 -1.0 2.0
   33    40    43    48   1.00000 -1.0 2.0
   37    33   -52    47   0.42250  1.0 1.0
   37    33   -52    47  -0.48100 -1.0 2.0
   37    33   -52    47   0.35650  1.0 3.0
   37    33    52    53   0.15000  1.0 3.0
   37    33    52    58  -0.84850  1.0 1.0
   37    33    52    58  -0.22800 -1.0 2.0
   37    33    52    58   0.29250  1.0 3.0
   37    33    40    43   0.00000  1.0 1.0
   37    41    45    46   0.15000  1.0 3.0
   37    41    45    50  -0.95700  1.0 1.0
   37    41    45    50  -0.18200 -1.0 2.0
   37    41    45    50   0.29450  1.0 3.0
   37    41    45    54   0.56750  1.0 1.0
   37    41    45    54  -0.07550 -1.0 2.0
   37    41    45    54   0.20000  1.0 3.0
   37    41   -47    50   0.00000  1.0 1.0
   37    41   -47    52   0.00000  1.0 1.0
   38    37    41    42   0.15000  1.0 3.0
   38    37    41    45   0.00000  1.0 1.0
   38    37    41    47   0.15000  1.0 3.0
   39    37    41    42   0.15000  1.0 3.0
   39    37    41    45   0.00000  1.0 1.0
   39    37    41    47   0.15000  1.0 3.0
   41    45    50    51  -0.11250  1.0 1.0
   41    45    50    51   0.11400 -1.0 2.0
   41    45    50    51  -0.28950  1.0 3.0
   41    45   -50    47   3.00000 -1.0 2.0
   41    45    54    55   0.00000  1.0 1.0
   41    45    54    61   0.04050  1.0 1.0
   41    45    54    61   0.63700 -1.0 2.0
   41    45    54    61   0.17650  1.0 3.0
   41    45    54    65   0.86500  1.0 1.0
   41    45    54    65  -0.17500 -1.0 2.0
   41    45    54    65   0.20800  1.0 3.0
   41    47   -52    33   0.00000  1.0 1.0
   41    47    52    53   0.00000  1.0 1.0
   41    47    52    58   0.00000  1.0 1.0
   42    41    45    46   0.15000  1.0 3.0
   42    41    45    50   0.15000  1.0 3.0
   42    41    45    54   0.15000  1.0 3.0
   42    41   -47    50   0.00000  1.0 1.0
   42    41    47    52   0.00000  1.0 1.0
   45    41   -47    50   0.00000  1.0 1.0
   45    41    47    52   0.00000  1.0 1.0
   45    50   -47    41   3.00000 -1.0 2.0
   45    50   -47    52   3.00000 -1.0 2.0
   45    54    61    62   0.15000  1.0 3.0
   45    54    61    63   0.15000  1.0 3.0
   45    54    61    64   0.15000  1.0 3.0
   45    54    65    66  -0.11600  1.0 1.0
   45    54    65    66  -0.09450 -1.0 2.0
   45    54    65    66   0.21250  1.0 3.0
   46    45    50    51   0.00000  1.0 1.0
   46    45    50    47   0.00000  1.0 1.0
   46    45    54    55   0.15000  1.0 3.0
   46    45    54    61   0.15000  1.0 3.0
   46    45    54    65   0.23400  1.0 3.0
   50    45    54    55  -0.11250  1.0 3.0
   50    45    54    61  -0.95700  1.0 1.0
   50    45    54    61  -0.18200 -1.0 2.0
   50    45    54    61   0.29450  1.0 3.0
   50    45    54    65  -0.09450  1.0 1.0
   50    45    54    65  -1.12950 -1.0 2.0
   50    45    54    65   0.54000  1.0 3.0
   50    47    52    33   0.00000  1.0 1.0
   50    47    52    53   0.00000  1.0 1.0
   50    47    52    58   0.00000  1.0 1.0
   51    50   -47    41   3.00000 -1.0 2.0
   51    50    47    52   3.00000 -1.0 2.0
   47    41   -45    46   0.15000  1.0 3.0
   47    41   -45    50   3.00000 -1.0 2.0
   47    41    45    54   0.43900  1.0 1.0
   47    41    45    54   0.49100 -1.0 2.0
   47    41    45    54   0.28400  1.0 3.0
   47    52    58    59   0.00000  1.0 1.0
   47    52    58    60   0.00000  1.0 1.0
   52    33    37    38   0.15000  1.0 3.0
   52    33    37    39   0.15000  1.0 3.0
   52    33   -37    41   0.31550 -1.0 2.0
   52    33   -37    41   0.11250  1.0 3.0
   52    33    40    43   0.00000  1.0 1.0
   53    52    58    59   0.00000  1.0 1.0
   53    52    58    60   0.00000  1.0 1.0
   54    45    50    51   0.30150 -1.0 2.0
   54    45   -50    47   1.39750  1.0 1.0
   54    45   -50    47  -0.07950 -1.0 2.0
   54    45   -50    47  -0.18750  1.0 3.0
   55    54    61    62   0.15000  1.0 3.0
   55    54    61    63   0.15000  1.0 3.0
   55    54    61    64   0.15000  1.0 3.0
   55    54    65    66   0.19450  1.0 3.0
   61    54    65    66  -0.11600  1.0 1.0
   61    54    65    66  -0.09450 -1.0 2.0
   61    54    65    66   0.21250  1.0 3.0
   65    54    61    62   0.23400  1.0 3.0
   65    54    61    63   0.23400  1.0 3.0
   65    54    61    64   0.23400  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    41   0.44750  1.0 1.0
   40    33    37    41  -0.17800 -1.0 2.0
   40    33    37    41   0.20200  1.0 3.0
   40    33    52    47   0.71400  1.0 1.0
   40    33    52    47   0.04300 -1.0 2.0
   40    33    52    47   0.01450  1.0 3.0
   40    33    52    53   0.15000  1.0 3.0
   40    33    52    58  -2.17200  1.0 1.0
   40    33    52    58  -0.85700 -1.0 2.0
   40    43    48    49   7.00000 -1.0 2.0
   40    43    48    56   7.00000 -1.0 2.0
   43    48    56    57   0.78350 -1.0 2.0
   43    48    56    67  -0.18900  1.0 1.0
   43    48    56    67   1.70900 -1.0 2.0
   44    43    48    49   7.00000 -1.0 2.0
   44    43    48    56   7.00000 -1.0 2.0
   48    56    67    68   2.67200 -1.0 2.0
   48    56    67    69   0.67100  1.0 1.0
   48    56    67    69   1.42150 -1.0 2.0
   48    56    67    69   0.18700  1.0 3.0
   49    48    56    57   0.00000  1.0 1.0
   49    48    56    67   1.44600  1.0 1.0
   56    67    69    70   0.00000  1.0 1.0
   56    67    69    71   0.00000  1.0 1.0
   56    67    69    72   0.00000  1.0 1.0
   57    56    67    68   2.45000 -1.0 2.0
   57    56    67    69   2.45000 -1.0 2.0
   68    67    69    70   0.00000  1.0 1.0
   68    67    69    71   0.00000  1.0 1.0
   68    67    69    72   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
   45    47    50    51  10.50000 -1.0 2.0
   52    50    47    41   1.00000 -1.0 2.0
   59    52    58    60  10.50000 -1.0 2.0
   40    44    43    48  15.00000 -1.0 2.0
   56    49    48    43  15.00000 -1.0 2.0
   57    67    56    48   1.00000 -1.0 2.0
   56    69    67    68  10.50000 -1.0 2.0
END
