* LIGAND DATABASE FILE (OPLS2005)
*
001      64    66    117    182     339
    1     0 S   NP   _N1_     1    28.53143    92.34111   -18.65529
    2     1 S   H    _HN1     2     1.03064   111.80939    31.25170
    3     1 S   H    _H1_     3     1.02804    32.02823   118.79036
    4     1 S   H    _H2_     4     1.02783    76.62190   -73.05341
    5     1 S   CT   _CA1     5     1.50129   131.02368   178.86323
    6     5 S   HC   _HA1     6     1.09571   105.34174    28.94818
    7     5 S   CO3  _C1_     7     1.53844   112.02053   -91.23305
    8     7 S   O2Z  _O11     8     1.26360   115.08999   -49.40942
    9     7 S   O2Z  _O12     9     1.26251   114.87748   129.64350
   10     5 S   CT   _CB1    10     1.52995   107.29640   146.62976
   11    10 S   HC   HB11    11     1.09801   109.41196   -52.41505
   12    10 S   HC   HB12    12     1.09519   110.13791    64.06944
   13    10 S   CT   _CG1    13     1.52895   113.16664  -174.35260
   14    13 S   HC   HG11    14     1.09560   110.13876   -59.00900
   15    13 S   HC   HG12    15     1.09584   110.46791    60.10973
   16    13 S   C    _CD1    16     1.51886   111.38068   179.83098
   17    16 S   O    _OE1    17     1.22821   122.83455   -29.10522
   18    16 S   N    _N2_    18     1.38439   112.16563   152.21674
   19    18 S   H    _HN2    19     1.01554   119.11511     5.41454
   20    18 S   CT1  _CA2    20     1.45736   123.07210   179.28866
   21    20 S   HC   _HA2    21     1.09589   108.90064    19.36516
   22    20 S   C    _C2_    22     1.52824   107.19128   -97.51388
   23    22 S   O    _O2_    23     1.22938   122.90525   -28.16476
   24    20 S   CT   _CB2    32     1.53229   111.91314   142.80147
   25    24 S   HC   HB21    33     1.09652   109.93557    53.70130
   26    24 S   HC   HB22    34     1.09566   111.52271   171.50988
   27    22 S   N    _N3_    24     1.38623   112.33046   154.75225
   28    27 S   H    _HN3    25     1.01488   119.71830     0.92767
   29    24 S   S    _SG2    35     1.82809   112.96934   -65.75089
   30    27 S   CT   _CA3    26     1.45458   122.92274   175.18786
   31    30 S   HC   HA31    27     1.09531   109.05645    28.47103
   32    30 S   HC   HA32    28     1.09480   107.16220   145.64646
   33    29 S   CT   _C13    36     1.82745    99.91182   -75.02434
   34    33 S   HC   _H10    37     1.09476   107.37330  -112.43364
   35    33 S   HC   _H11    38     1.09449   109.74266     4.73379
   36    30 S   CO3  _C3_    29     1.53050   113.43818   -94.62014
   37    36 S   O2Z  _O31    30     1.26389   115.72238   -32.75465
   38    36 S   O2Z  _O32    31     1.26393   114.74431   148.10691
   39    33 S   CT   _C12    39     1.52671   111.18669   126.98589
   40    39 S   HC   _H5_    40     1.09741   111.06146    51.13470
   41    39 S   CT   _C11    41     1.52979   111.83906   173.86473
   42    41 S   HC   _H8_    42     1.09682   110.60428    35.35602
   43    41 S   HC   _H9_    43     1.09417   111.48345   -85.69008
   44    41 S   CT   _C10    44     1.51213   102.30815   151.94443
   45    44 S   HC   _H4_    45     1.09383   113.88314  -158.61891
   46    44 S   CO   _C9_    46     1.52549   100.83988   -37.78455
   47    46 S   HC   _H3_    47     1.09773   109.69431   -81.50079
   48    44 S   OH   _O34    63     1.42264   109.07613    80.26314
   49    48 S   HO   _H12    64     0.97248   107.65528    65.19133
   50    46 S   N*   _N6_    48     1.44632   116.21878   156.47247
   51    39 S   OS   _O33    62     1.44003   110.50401   -68.06744
   52    50 S   CRAB _C8_    49     1.37157   124.34827    98.39274
   53    52 S   HA   _H7_    50     1.08186   122.45425     0.03956
   54    52 S   NNA  _N7_    51     1.31533   112.17284  -180.00000
   55    54 S   C56B _C6_    52     1.37451   104.89544     0.03956
   56    50 S   C56A _C7_    53     1.36913   128.49475   -81.52020
   57    56 S   NB   _N5_    54     1.34268   128.34424     0.00000
   58    57 S   CQ   _C4_    55     1.34666   110.92471  -179.60833
   59    58 S   HA   _H6_    56     1.08497   115.80723   179.47735
   60    58 S   NB   _N4_    57     1.35415   128.60035    -0.03426
   61    55 S   CA   _C5_    58     1.40326   131.41324  -179.85463
   62    61 S   NND  _N8_    59     1.38152   122.22432     0.06853
   63    62 S   H    _H13    60     1.01125   120.20247    -2.52615
   64    62 S   H    _H14    61     1.01025   119.41631  -176.98014
  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   7   5   4   3
  10   5   4   2   1   1  11   6  10   6   5   9   6  11   5   3
   1   9   2   6   3   6   8   6   4   4   2   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    51  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    46    51  
   35    39    40    41    51  
   39    40    41    51  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    47    50    51    48  
   41    42    43    44    46    51  
   42    43    44    45    46    47    50    51    48    49  
   43    44    45    46    51    48  
   44    45    46    51    48  
   45    46    47    50    52    56    51    48    49  
   46    47    50    51    48    49  
   47    50    52    53    54    55    56    57    51    48    49  
   50    52    56    51    48  
   49    50    51  
    0  
   52    53    54    55    56    57    58    61    51  
   52    56  
   53    54    55    56    57    61  
   54    55    56  
   55    56    57    60    61    62  
   56    57    58    60    61    62    63    64  
   57    58    59    60    61    62  
   58    59    60    61  
   59    60    61    62  
   60    61  
   61    62    63    64  
   62    63    64  
   63    64  
   64  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.450000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.655000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.0000   0.0000   0.390000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.2500   0.1700  -0.500000   1.8000   1.6000   0.001000000  -0.511443539
   51   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   52   3.5000   0.0800   0.200000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   54   3.2500   0.1700  -0.490000   1.8000   1.6000   0.001000000  -0.511443539
   55   3.5000   0.0800   0.150000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5000   0.0800   0.380000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.2500   0.1700  -0.550000   1.8000   1.6000   0.001000000  -0.511443539
   58   3.5000   0.0800   0.220000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   60   3.2500   0.1700  -0.530000   1.8000   1.6000   0.001000000  -0.511443539
   61   3.5000   0.0800   0.440000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.2500   0.1700  -0.810000   1.8650   1.6500   0.051222218  -2.220205820
   63   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   64   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    51   320.000  1.410
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   268.000  1.529
   44    45   340.000  1.090
   44    46   250.000  1.527
   44    48   320.000  1.410
   46    47   340.000  1.090
   46    50   275.000  1.479
   46    51   320.000  1.380
   50    52   440.000  1.371
   50    56   436.000  1.374
   52    53   367.000  1.080
   52    54   529.000  1.304
   54    55   414.000  1.391
   55    56   447.000  1.419
   55    61   469.000  1.404
   56    57   461.000  1.354
   57    58   502.000  1.324
   58    59   367.000  1.080
   58    60   502.000  1.324
   60    61   483.000  1.339
   61    62   481.000  1.340
   62    63   434.000  1.010
   62    64   434.000  1.010
   48    49   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    51    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    37.50000  110.70000
   39    41    44    58.35000  112.70000
   39    51    46    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    44    45    37.50000  110.70000
   41    44    46    75.00000  109.43000
   41    44    48    50.00000  109.50000
   43    41    42    33.00000  107.80000
   44    41    42    37.50000  110.70000
   44    41    43    37.50000  110.70000
   44    46    47    45.00000  112.01100
   44    46    50    75.00000  107.44000
   44    46    51    90.00000  108.56700
   44    48    49    55.00000  108.50000
   46    44    45    45.00000  108.72000
   46    50    52    70.00000  128.80000
   46    50    56    70.00000  125.80000
   50    46    47    55.00000  103.44000
   50    52    53    35.00000  123.05000
   50    52    54    70.00000  113.90000
   50    56    55    70.00000  106.20000
   50    56    57    70.00000  126.20000
   52    54    55    70.00000  103.80000
   54    52    53    35.00000  123.05000
   54    55    56    70.00000  110.40000
   54    55    61    70.00000  132.40000
   55    56    57    70.00000  127.70000
   55    61    60    70.00000  117.30000
   55    61    62    70.00000  123.50000
   56    50    52    70.00000  105.40000
   56    57    58    70.00000  111.00000
   57    58    59    35.00000  115.45000
   57    58    60    70.00000  129.10000
   58    60    61    70.00000  118.60000
   60    58    59    35.00000  115.45000
   60    61    62    70.00000  119.30000
   61    55    56    85.00000  116.20000
   61    62    63    35.00000  120.00000
   61    62    64    35.00000  120.00000
   64    62    63    35.00000  120.00000
   51    39    40    35.00000  109.50000
   51    39    41    50.00000  109.50000
   51    46    47    35.00000  109.50000
   51    46    50   105.00000  106.22000
   48    44    45    35.00000  109.50000
   48    44    46    90.00000  111.58700
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    51   0.56750  1.0 1.0
   29    33    39    51  -0.07550 -1.0 2.0
   29    33    39    51   0.20000  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    43   0.15000  1.0 3.0
   33    39    41    44   0.56750  1.0 1.0
   33    39    41    44  -0.07550 -1.0 2.0
   33    39    41    44   0.20000  1.0 3.0
   33    39    51    46   0.06250  1.0 1.0
   33    39    51    46  -0.01100 -1.0 2.0
   33    39    51    46   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    51   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    51   0.23400  1.0 3.0
   39    41    44    45   0.15000  1.0 3.0
   39    41   -44    46   3.97050  1.0 1.0
   39    41    44    48   0.86500  1.0 1.0
   39    41    44    48  -0.17500 -1.0 2.0
   39    41    44    48   0.20800  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    43   0.15000  1.0 3.0
   40    39    41    44   0.15000  1.0 3.0
   40    39    51    46   0.37050  1.0 3.0
   41    39   -51    46   0.06250  1.0 1.0
   41    39   -51    46  -0.01100 -1.0 2.0
   41    39   -51    46   0.28050  1.0 3.0
   41    44    46    47   0.15000  1.0 3.0
   41    44    46    50  -0.64600  1.0 1.0
   41    44    46    50   0.58400 -1.0 2.0
   41    44   -46    51   0.62750  1.0 1.0
   41    44   -46    51  -0.30950 -1.0 2.0
   41    44   -46    51   0.27300  1.0 3.0
   41    44    48    49  -0.11600  1.0 1.0
   41    44    48    49  -0.09450 -1.0 2.0
   41    44    48    49   0.21250  1.0 3.0
   42    41    44    45   0.15000  1.0 3.0
   42    41    44    46   0.15000  1.0 3.0
   42    41    44    48   0.23400  1.0 3.0
   43    41    44    45   0.15000  1.0 3.0
   43    41    44    46   0.15000  1.0 3.0
   43    41    44    48   0.23400  1.0 3.0
   44    46    50    52   1.10250  1.0 1.0
   44    46    50    52   0.01650 -1.0 2.0
   44    46    50    52   0.39100  1.0 3.0
   44    46    50    56   1.10250  1.0 1.0
   44    46    50    56   0.01650 -1.0 2.0
   44    46    50    56   0.39100  1.0 3.0
   44    46   -51    39   0.06250  1.0 1.0
   44    46   -51    39  -0.01100 -1.0 2.0
   44    46   -51    39   0.28050  1.0 3.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    50   0.15000  1.0 3.0
   45    44    46    51   0.23400  1.0 3.0
   45    44    48    49   0.19450  1.0 3.0
   46    44    48    49  -0.11600  1.0 1.0
   46    44    48    49  -0.09450 -1.0 2.0
   46    44    48    49   0.21250  1.0 3.0
   46    50    52    53   3.62500 -1.0 2.0
   46    50    52    54   3.62500 -1.0 2.0
   46    50    56    55   0.81400  1.0 1.0
   46    50    56    55   1.55550 -1.0 2.0
   46    50    56    57   3.62500 -1.0 2.0
   47    46    50    52   0.00000  1.0 1.0
   47    46    50    56   0.00000  1.0 1.0
   47    46    51    39   0.37050  1.0 3.0
   50    46    51    39  -2.37750  1.0 1.0
   50    46    51    39  -0.08150 -1.0 2.0
   50    46    51    39   0.59000  1.0 3.0
   50    52   -54    55   3.62500 -1.0 2.0
   50    56    57    58   3.62500 -1.0 2.0
   52    50   -56    55   0.70250  1.0 1.0
   52    50   -56    55   1.56150 -1.0 2.0
   52    50    56    57   3.62500 -1.0 2.0
   52    54   -55    56   3.62500 -1.0 2.0
   52    54    55    61   3.62500 -1.0 2.0
   53    52    54    55   3.62500 -1.0 2.0
   54    55   -56    50   3.62500 -1.0 2.0
   54    55    56    57   3.62500 -1.0 2.0
   54    55    61    60   3.62500 -1.0 2.0
   54    55    61    62   3.62500 -1.0 2.0
   55    56    57    58   3.62500 -1.0 2.0
   55    61    62    63   0.70000 -1.0 2.0
   55    61    62    64   0.70000 -1.0 2.0
   56    50    52    53   3.62500 -1.0 2.0
   56    50   -52    54   3.62500 -1.0 2.0
   56    55    61    60   3.62500 -1.0 2.0
   56    55    61    62   3.62500 -1.0 2.0
   56    57    58    59   3.62500 -1.0 2.0
   56    57   -58    60   3.62500 -1.0 2.0
   57    58    60    61   3.62500 -1.0 2.0
   58    60   -61    55   3.62500 -1.0 2.0
   58    60    61    62   3.62500 -1.0 2.0
   59    58    60    61   3.62500 -1.0 2.0
   60    61    62    63   0.70000 -1.0 2.0
   60    61    62    64   0.70000 -1.0 2.0
   61    55    56    50   3.00000 -1.0 2.0
   61    55   -56    57   3.62500 -1.0 2.0
   51    39    41    42   0.23400  1.0 3.0
   51    39    41    43   0.23400  1.0 3.0
   51    39   -41    44   0.62750  1.0 1.0
   51    39   -41    44  -0.30950 -1.0 2.0
   51    39   -41    44   0.27300  1.0 3.0
   51    46    50    52   0.10350  1.0 1.0
   51    46    50    52  -0.15350 -1.0 2.0
   51    46    50    56   0.10350  1.0 1.0
   51    46    50    56  -0.15350 -1.0 2.0
   48    44    46    47   0.23400  1.0 3.0
   48    44    46    50   2.76900  1.0 1.0
   48    44    46    50  -0.24350 -1.0 2.0
   48    44    46    50  -0.78250  1.0 3.0
   48    44    46    51   3.69350  1.0 1.0
   48    44    46    51  -1.82950 -1.0 2.0
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
   37    30    36    38  10.50000 -1.0 2.0
   52    56    50    46   4.00000 -1.0 2.0
   54    53    52    50   1.10000 -1.0 2.0
   56    61    55    54   4.00000 -1.0 2.0
   55    57    56    50   4.00000 -1.0 2.0
   60    59    58    57   1.10000 -1.0 2.0
   60    62    61    55   4.00000 -1.0 2.0
   64    61    62    63   1.00000 -1.0 2.0
END
