* LIGAND DATABASE FILE (OPLS2005)
*
001      74    75    137    209     403
    1     0 S   NP   _N1_     1    29.15644    94.82173   -17.12831
    2     1 S   H    _HN1     2     1.02703    26.01807   166.81668
    3     1 S   H    _H1_     3     1.02886    83.86517   -34.21227
    4     1 S   H    _H2_     4     1.03344   104.92103    70.52731
    5     1 S   CT   _CA1     5     1.49984   132.47414  -149.64710
    6     5 S   HC   _HA1     6     1.09632   104.72427    35.06757
    7     5 S   CO3  _C1_     7     1.53862   113.37952   -83.91817
    8     7 S   O2Z  _O11     8     1.26322   115.59567   -35.04257
    9     7 S   O2Z  _O12     9     1.26378   114.80889   144.33737
   10     5 S   CT   _CB1    10     1.53274   107.67531   151.75141
   11    10 S   HC   HB11    11     1.09769   108.56571   -53.33531
   12    10 S   HC   HB12    12     1.09656   110.64521    62.80296
   13    10 S   CT   _CG1    13     1.53136   113.36349  -175.21484
   14    13 S   HC   HG11    14     1.09597   109.75314   -72.03803
   15    13 S   HC   HG12    15     1.09639   110.39668    46.86473
   16    13 S   C    _CD1    16     1.52020   112.38934   166.11250
   17    16 S   O    _OE1    17     1.22780   122.91883   -26.08196
   18    16 S   N    _N2_    18     1.38658   112.34407   156.19901
   19    18 S   H    _HN2    19     1.01599   119.01222    -1.22509
   20    18 S   CT1  _CA2    20     1.46458   123.35759   177.69056
   21    20 S   HC   _HA2    21     1.09752   109.11605   -20.91519
   22    20 S   C    _C2_    22     1.53410   107.89288  -136.33563
   23    22 S   O    _O2_    23     1.22993   122.36233  -143.70265
   24    20 S   CT   _CB2    32     1.53557   111.99624   101.49461
   25    24 S   HC   HB21    33     1.09532   109.70799    54.55555
   26    24 S   HC   HB22    34     1.09512   110.68489   172.79617
   27    22 S   N    _N3_    24     1.38538   113.21601    43.44886
   28    27 S   H    _HN3    25     1.01542   118.97179    -0.24469
   29    24 S   S    _SG2    35     1.82762   111.67406   -68.30954
   30    27 S   CT   _CA3    26     1.45439   123.28740   175.11228
   31    30 S   HC   HA31    27     1.09534   109.03199    27.92650
   32    30 S   HC   HA32    28     1.09488   107.16169   144.92586
   33    29 S   CT   _C7_    36     1.84741   100.00965   137.63121
   34    33 S   HC   _H4_    37     1.09464   107.12125   -36.33880
   35    30 S   CO3  _C3_    29     1.52951   113.31352   -95.38377
   36    35 S   O2Z  _O31    30     1.26388   115.51941   -41.21356
   37    35 S   O2Z  _O32    31     1.26373   114.89439   139.72156
   38    33 S   CT   _C6_    38     1.53732   111.07486    83.44290
   39    38 S   HC   _H3_    39     1.09970   109.92051   -43.36873
   40    38 S   CT   _C5_    40     1.52862   110.88652    75.52250
   41    40 S   HC   _H11    41     1.09724   109.23747   -69.72647
   42    40 S   HC   _H12    42     1.09701   110.71138   174.23496
   43    38 S   C    _C14    70     1.53122   110.78167  -159.12143
   44    43 S   O    _O40    71     1.22742   123.79545  -105.89591
   45    40 S   CT   _C4_    43     1.52020   112.90252    51.18310
   46    45 S   HC   _H9_    44     1.09631   109.96032  -150.46366
   47    45 S   HC   _H10    45     1.09720   109.62066    93.88133
   48    43 S   N    _N5_    72     1.37604   113.48933    73.43945
   49    48 S   H    _H18    73     1.01432   123.07321     1.89031
   50    48 S   H    _H19    74     1.01452   120.18368  -179.67555
   51    45 S   CG   _C8_    46     1.49789   116.90957   -27.00518
   52    51 S   HC   _H13    47     1.10087   118.77578  -178.89465
   53    33 S   N*   _N4_    48     1.51118   113.62909  -151.85068
   54    53 S   CO   _C9_    49     1.50706   115.85023    82.04376
   55    54 S   HC   _H5_    50     1.09710   106.46390   -20.33336
   56    54 S   CT   _C10    51     1.52784   109.65158    99.55456
   57    56 S   HC   _H6_    52     1.09744   111.62115    47.22418
   58    56 S   CT   _C11    53     1.51848   100.80511   163.79237
   59    58 S   HC   _H7_    54     1.09349   113.37013  -163.65925
   60    56 S   OH   _O39    68     1.41532   112.36235   -75.21847
   61    60 S   HO   _H17    69     0.97287   107.58479  -161.27741
   62    58 S   CT   _C12    55     1.52855   100.60502   -41.86674
   63    62 S   HC   _H8_    56     1.09707   110.28465   -79.13187
   64    58 S   OH   _O38    66     1.42508   108.35629    76.06390
   65    64 S   HO   _H16    67     0.97458   109.12306  -176.52188
   66    54 S   OS   _O33    57     1.44159   117.89747  -139.48627
   67    62 S   CT   _C13    58     1.51895   115.10605   155.27344
   68    67 S   HC   _H14    59     1.09410   110.95689    53.83484
   69    67 S   HC   _H15    60     1.09085   110.19987   -67.35900
   70    67 S   OS   _O34    61     1.42456   109.49676   172.83259
   71    70 S   P3   _P1_    62     1.65111   117.84247   146.74674
   72    71 S   O2Z  _O36    63     1.52346   103.83671   170.99307
   73    71 S   O2Z  _O37    64     1.52603   104.58593    50.61386
   74    71 S   O2Z  _O35    65     1.52547   104.45605   -68.89725
  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   9   5   4   3
  17   7   2   1   1  15   8  11   6   5   6   3   6   4   3   2
   1   1   6   2   8  12   6  11   7  12   7   4   1   9   6   3
   1   4   7   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    53    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    51    53    54    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    45    51    52    53    54    55    56    66    43    44    48  
   38    39    40    51    53    54    43  
   36    37  
   37  
    0  
   39    40    41    42    45    46    47    51    53    54    43    44    48    49    50  
   40    41    42    45    53    43    44    48  
   41    42    45    46    47    51    52    53    43    44    48  
   42    45    46    47    51    43  
   45    46    47    51    43  
   44    48    49    50    45    53  
   48    49    50  
   46    47    51    52    53    54  
   47    51    52    53  
   51    52    53  
   49    50  
   50  
    0  
   52    53    54    55    56    66  
   53    54  
   54    55    56    57    58    62    66    60  
   55    56    57    58    59    62    63    66    67    64    60    61  
   56    57    58    62    66    60  
   57    58    59    62    63    66    67    64    65    60    61  
   58    59    62    66    64    60    61  
   59    62    63    66    67    68    69    70    64    65    60    61  
   62    63    66    67    64    65    60  
   61    62    64    66  
    0  
   63    66    67    68    69    70    71    64    65  
   66    67    68    69    70    64  
   65    66    67  
    0  
   67    68    69    70  
   68    69    70    71    72    73    74  
   69    70    71  
   70    71  
   71    72    73    74  
   72    73    74  
   73    74  
   74  
    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   0.514200   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0150   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  -0.060000   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.500000   1.8100   1.6000   0.001000000  -1.480495490
   45   3.5000   0.0660   0.215700   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
   49   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   50   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   51   3.7500   0.1050  -0.072300   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.273100   1.4250   1.2500   0.008598240   0.268726247
   53   3.2500   0.1700  -0.065700   1.9050   1.6860   0.051222218  -2.220205820
   54   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0150   0.100000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   66   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   67   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.8500   0.1400  -0.760000   1.7660   1.5600   0.020110767  -0.896042159
   71   3.7400   0.2000   1.919900   2.1070   1.8700   0.005000000   0.000000000
   72   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
   73   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
   74   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
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   268.000  1.529
   33    53   337.000  1.475
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    43   317.000  1.522
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    51   290.000  1.488
   51    52   385.000  1.083
   51    53   590.000  1.308
   53    54   275.000  1.479
   54    55   340.000  1.090
   54    56   250.000  1.527
   54    66   320.000  1.380
   56    57   340.000  1.090
   56    58   268.000  1.529
   56    60   320.000  1.410
   58    59   340.000  1.090
   58    62   268.000  1.529
   58    64   320.000  1.410
   62    63   340.000  1.090
   62    66   320.000  1.410
   62    67   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   320.000  1.410
   70    71   230.000  1.630
   71    72   525.000  1.516
   71    73   525.000  1.516
   71    74   525.000  1.516
   64    65   553.000  0.945
   60    61   553.000  0.945
   43    44   570.000  1.229
   43    48   490.000  1.335
   48    49   434.000  1.010
   48    50   434.000  1.010
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    53    80.00000  108.62000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    43    63.00000  111.10000
   33    53    51    85.00000  113.64000
   33    53    54    65.00000  120.78000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    42    37.50000  110.70000
   38    40    45    58.35000  112.70000
   38    43    44    80.00000  120.40000
   38    43    48    70.00000  116.60000
   40    38    39    37.50000  110.70000
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    51    70.00000  109.02000
   42    40    41    33.00000  107.80000
   45    40    41    37.50000  110.70000
   45    40    42    37.50000  110.70000
   45    51    52    35.00000  121.91500
   45    51    53    65.00000  114.34000
   47    45    46    33.00000  107.80000
   51    45    46    45.00000  109.33400
   51    45    47    45.00000  109.33400
   51    53    54    65.00000  122.98000
   53    33    34    35.00000  109.50000
   53    33    38    80.00000  111.20000
   53    51    52    45.00000  115.58000
   53    54    55    55.00000  103.44000
   53    54    56    75.00000  107.44000
   53    54    66   105.00000  106.22000
   54    56    57    45.00000  108.72000
   54    56    58    75.00000  109.43000
   54    56    60    90.00000  111.58700
   54    66    62    60.00000  109.50000
   56    54    55    45.00000  112.01100
   56    58    59    37.50000  110.70000
   56    58    62    58.35000  112.70000
   56    58    64    50.00000  109.50000
   56    60    61    55.00000  108.50000
   58    56    57    37.50000  110.70000
   58    62    63    37.50000  110.70000
   58    62    66    50.00000  109.50000
   58    62    67    58.35000  112.70000
   58    64    65    55.00000  108.50000
   62    58    59    37.50000  110.70000
   62    67    68    37.50000  110.70000
   62    67    69    37.50000  110.70000
   62    67    70    50.00000  109.50000
   66    54    55    35.00000  109.50000
   66    54    56    90.00000  108.56700
   66    62    63    35.00000  109.50000
   67    62    63    37.50000  110.70000
   67    62    66    50.00000  109.50000
   67    70    71    80.00000  112.68000
   69    67    68    33.00000  107.80000
   70    67    68    35.00000  109.50000
   70    67    69    35.00000  109.50000
   70    71    72   100.00000  107.00000
   70    71    73   100.00000  107.00000
   70    71    74   100.00000  107.00000
   73    71    72   140.00000  114.00000
   74    71    72   140.00000  114.00000
   74    71    73   140.00000  114.00000
   64    58    59    35.00000  109.50000
   64    58    62    50.00000  109.50000
   60    56    57    35.00000  109.50000
   60    56    58    50.00000  109.50000
   43    38    39    35.00000  109.50000
   43    38    40    63.00000  111.10000
   43    48    49    35.00000  119.80000
   43    48    50    35.00000  119.80000
   48    43    44    80.00000  122.90000
   50    48    49    35.00000  120.00000
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    53   0.01700  1.0 1.0
   24    29    33    53  -0.23550 -1.0 2.0
   24    29    33    53   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    40   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    53    51   0.68100  1.0 1.0
   29    33    53    51   0.03350 -1.0 2.0
   29    33    53    51   0.36200  1.0 3.0
   29    33    53    54   0.68100  1.0 1.0
   29    33    53    54   0.03350 -1.0 2.0
   29    33    53    54   0.36200  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    42   0.15000  1.0 3.0
   33    38    40    45   0.56750  1.0 1.0
   33    38    40    45  -0.07550 -1.0 2.0
   33    38    40    45   0.20000  1.0 3.0
   33    38    43    44   0.30150 -1.0 2.0
   33    38    43    48   1.39750  1.0 1.0
   33    38    43    48  -0.07950 -1.0 2.0
   33    38    43    48  -0.18750  1.0 3.0
   33    53    54    55   0.00000  1.0 1.0
   33    53    54    56   2.08450  1.0 1.0
   33    53    54    56  -0.39300 -1.0 2.0
   33    53    54    56   0.23400  1.0 3.0
   33    53    54    66   0.10350  1.0 1.0
   33    53    54    66  -0.15350 -1.0 2.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    43  -0.11250  1.0 3.0
   34    33    53    51   0.00000  1.0 1.0
   34    33    53    54   0.00000  1.0 1.0
   38    33    53    51   2.08450  1.0 1.0
   38    33    53    51  -0.39300 -1.0 2.0
   38    33    53    51   0.23400  1.0 3.0
   38    33    53    54   0.00000  1.0 1.0
   38    40    45    46   0.15000  1.0 3.0
   38    40    45    47   0.15000  1.0 3.0
   38    40   -45    51   0.34400  1.0 1.0
   38    40   -45    51   0.09450 -1.0 2.0
   38    40   -45    51   0.11100  1.0 3.0
   38    43    48    49   2.45000 -1.0 2.0
   38    43    48    50   2.45000 -1.0 2.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    42   0.15000  1.0 3.0
   39    38    40    45   0.15000  1.0 3.0
   39    38    43    44   0.00000  1.0 1.0
   39    38    43    48   0.00000  1.0 1.0
   40    38    43    44   0.30150 -1.0 2.0
   40    38    43    48   1.39750  1.0 1.0
   40    38    43    48  -0.07950 -1.0 2.0
   40    38    43    48  -0.18750  1.0 3.0
   40    45    51    52   0.00000  1.0 1.0
   40    45    51    53  -0.93550  1.0 1.0
   40    45    51    53   0.38900 -1.0 2.0
   40    45    51    53   0.16950  1.0 3.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    47   0.15000  1.0 3.0
   41    40    45    51   0.15000  1.0 3.0
   42    40    45    46   0.15000  1.0 3.0
   42    40    45    47   0.15000  1.0 3.0
   42    40    45    51   0.15000  1.0 3.0
   45    51   -53    33   3.62500 -1.0 2.0
   45    51    53    54   3.62500 -1.0 2.0
   46    45    51    52   0.33100  1.0 3.0
   46    45    51    53   0.00000  1.0 1.0
   47    45    51    52   0.33100  1.0 3.0
   47    45    51    53   0.00000  1.0 1.0
   51    53    54    55   0.00000  1.0 1.0
   51    53    54    56   2.08450  1.0 1.0
   51    53    54    56  -0.39300 -1.0 2.0
   51    53    54    56   0.23400  1.0 3.0
   51    53    54    66  -0.28000  1.0 1.0
   51    53    54    66  -1.16550 -1.0 2.0
   52    51    53    33   1.88100 -1.0 2.0
   52    51    53    54   1.88100 -1.0 2.0
   53    33    38    39   0.15000  1.0 3.0
   53    33   -38    40  -0.64600  1.0 1.0
   53    33   -38    40   0.58400 -1.0 2.0
   53    33    38    43  -2.10200  1.0 1.0
   53    33    38    43  -0.31600 -1.0 2.0
   53    33    38    43   0.13050  1.0 3.0
   53    54    56    57   0.15000  1.0 3.0
   53    54    56    58  -0.27100  1.0 1.0
   53    54    56    58  -0.01700 -1.0 2.0
   53    54    56    58  -0.48600  1.0 3.0
   53    54    56    60   2.76900  1.0 1.0
   53    54    56    60  -0.24350 -1.0 2.0
   53    54    56    60  -0.78250  1.0 3.0
   53    54    66    62  -2.37750  1.0 1.0
   53    54    66    62  -0.08150 -1.0 2.0
   53    54    66    62   0.59000  1.0 3.0
   54    56    58    59   0.15000  1.0 3.0
   54    56   -58    62   3.97050  1.0 1.0
   54    56    58    64   0.86500  1.0 1.0
   54    56    58    64  -0.17500 -1.0 2.0
   54    56    58    64   0.20800  1.0 3.0
   54    56    60    61  -0.11600  1.0 1.0
   54    56    60    61  -0.09450 -1.0 2.0
   54    56    60    61   0.21250  1.0 3.0
   55    54    56    57   0.15000  1.0 3.0
   55    54    56    58   0.15000  1.0 3.0
   55    54    56    60   0.23400  1.0 3.0
   55    54    66    62   0.37050  1.0 3.0
   56    54   -66    62   0.06250  1.0 1.0
   56    54   -66    62  -0.01100 -1.0 2.0
   56    54   -66    62   0.28050  1.0 3.0
   56    58    62    63   0.15000  1.0 3.0
   56    58   -62    66   0.62750  1.0 1.0
   56    58   -62    66  -0.30950 -1.0 2.0
   56    58   -62    66   0.27300  1.0 3.0
   56    58    62    67   0.56750  1.0 1.0
   56    58    62    67  -0.07550 -1.0 2.0
   56    58    62    67   0.20000  1.0 3.0
   56    58    64    65  -0.11600  1.0 1.0
   56    58    64    65  -0.09450 -1.0 2.0
   56    58    64    65   0.21250  1.0 3.0
   57    56    58    59   0.15000  1.0 3.0
   57    56    58    62   0.15000  1.0 3.0
   57    56    58    64   0.23400  1.0 3.0
   57    56    60    61   0.19450  1.0 3.0
   58    56    60    61  -0.11600  1.0 1.0
   58    56    60    61  -0.09450 -1.0 2.0
   58    56    60    61   0.21250  1.0 3.0
   58    62   -66    54   0.06250  1.0 1.0
   58    62   -66    54  -0.01100 -1.0 2.0
   58    62   -66    54   0.28050  1.0 3.0
   58    62    67    68   0.15000  1.0 3.0
   58    62    67    69   0.15000  1.0 3.0
   58    62    67    70   0.62750  1.0 1.0
   58    62    67    70  -0.30950 -1.0 2.0
   58    62    67    70   0.27300  1.0 3.0
   59    58    62    63   0.15000  1.0 3.0
   59    58    62    66   0.23400  1.0 3.0
   59    58    62    67   0.15000  1.0 3.0
   59    58    64    65   0.19450  1.0 3.0
   62    58    64    65  -0.11600  1.0 1.0
   62    58    64    65  -0.09450 -1.0 2.0
   62    58    64    65   0.21250  1.0 3.0
   62    67    70    71  -2.65550  1.0 1.0
   62    67    70    71  -0.22350 -1.0 2.0
   62    67    70    71   0.24150  1.0 3.0
   63    62    66    54   0.37050  1.0 3.0
   63    62    67    68   0.15000  1.0 3.0
   63    62    67    69   0.15000  1.0 3.0
   63    62    67    70   0.23400  1.0 3.0
   66    54    56    57   0.23400  1.0 3.0
   66    54   -56    58   0.62750  1.0 1.0
   66    54   -56    58  -0.30950 -1.0 2.0
   66    54   -56    58   0.27300  1.0 3.0
   66    54    56    60   3.69350  1.0 1.0
   66    54    56    60  -1.82950 -1.0 2.0
   66    62    67    68   0.23400  1.0 3.0
   66    62    67    69   0.23400  1.0 3.0
   66    62    67    70   1.11900  1.0 1.0
   66    62    67    70  -1.16350 -1.0 2.0
   66    62    67    70  -0.34150  1.0 3.0
   67    62    66    54   0.06250  1.0 1.0
   67    62    66    54  -0.01100 -1.0 2.0
   67    62    66    54   0.28050  1.0 3.0
   67    70    71    72   0.00000  1.0 1.0
   67    70    71    73   0.00000  1.0 1.0
   67    70    71    74   0.00000  1.0 1.0
   68    67    70    71   0.03000  1.0 3.0
   69    67    70    71   0.03000  1.0 3.0
   64    58    62    63   0.23400  1.0 3.0
   64    58    62    66   3.69350  1.0 1.0
   64    58    62    66  -1.82950 -1.0 2.0
   64    58    62    67   0.86500  1.0 1.0
   64    58    62    67  -0.17500 -1.0 2.0
   64    58    62    67   0.20800  1.0 3.0
   60    56    58    59   0.23400  1.0 3.0
   60    56    58    62   0.86500  1.0 1.0
   60    56    58    62  -0.17500 -1.0 2.0
   60    56    58    62   0.20800  1.0 3.0
   60    56    58    64   3.75450  1.0 1.0
   43    38    40    41  -0.11250  1.0 3.0
   43    38    40    42  -0.11250  1.0 3.0
   43    38    40    45  -0.95700  1.0 1.0
   43    38    40    45  -0.18200 -1.0 2.0
   43    38    40    45   0.29450  1.0 3.0
   44    43    48    49   2.45000 -1.0 2.0
   44    43    48    50   2.45000 -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
   36    30    35    37  10.50000 -1.0 2.0
   45    52    51    53  10.50000 -1.0 2.0
   33    54    53    51   1.00000 -1.0 2.0
   38    48    43    44  10.50000 -1.0 2.0
   50    43    48    49   1.00000 -1.0 2.0
END
