* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    127    199     370
    1     0 S   NP   _N1_     1    29.79186    96.00736   -23.02522
    2     1 S   H    _HN1     2     1.02955   121.53133   172.39638
    3     1 S   H    _H1_     3     1.02995    94.27893   -74.43116
    4     1 S   H    _H2_     4     1.02783    15.79752   138.74430
    5     1 S   CT   _CA1     5     1.50215   109.50560    39.10499
    6     5 S   HC   _HA1     6     1.09544   105.55548    73.91319
    7     5 S   CO3  _C1_     7     1.53483   112.74417   -47.11781
    8     7 S   O2Z  _O11     8     1.26422   115.53225   -46.81829
    9     7 S   O2Z  _O12     9     1.26312   115.32059   134.15423
   10     5 S   CT   _CB1    10     1.52818   106.81838  -168.19568
   11    10 S   HC   HB11    11     1.09706   108.70374   -52.83976
   12    10 S   HC   HB12    12     1.09869   110.15899    63.13485
   13    10 S   CT   _CG1    13     1.52891   114.17842  -173.58195
   14    13 S   HC   HG11    14     1.09363   111.79047   -55.51838
   15    13 S   HC   HG12    15     1.09564   110.83428    64.42917
   16    13 S   C    _CD1    16     1.51367   109.06754  -174.52081
   17    16 S   O    _OE1    17     1.22824   121.52664    99.41692
   18    16 S   N    _N2_    18     1.38482   112.81248   -77.88491
   19    18 S   H    _HN2    19     1.01557   119.21773    -2.59669
   20    18 S   CT1  _CA2    20     1.46018   123.18557   173.58305
   21    20 S   HC   _HA2    21     1.09539   109.06711    -4.13451
   22    20 S   C    _C2_    22     1.53722   108.77271  -119.05622
   23    22 S   O    _O2_    23     1.23082   121.99084  -152.69051
   24    20 S   CT   _CB2    32     1.53542   112.10584   118.51819
   25    24 S   HC   HB21    33     1.09660   109.44304    66.20396
   26    24 S   HC   HB22    34     1.09574   110.87125  -176.58127
   27    22 S   N    _N3_    24     1.38451   114.00741    34.40820
   28    27 S   H    _HN3    25     1.01511   119.38654    -1.63805
   29    24 S   S    _SG2    35     1.82836   114.74670   -53.20031
   30    27 S   CT   _CA3    26     1.45364   123.18467   177.80804
   31    30 S   HC   HA31    27     1.09555   107.13490   -71.55575
   32    30 S   HC   HA32    28     1.09562   108.26285    44.75107
   33    29 S   CT   _C13    36     1.82801   100.21339   -70.36854
   34    33 S   HC   _H15    37     1.09414   108.16302   -80.99984
   35    33 S   HC   _H16    38     1.09226   108.97441    37.52466
   36    30 S   CO3  _C3_    29     1.53061   114.58668   166.94360
   37    36 S   O2Z  _O31    30     1.26366   116.40322    -5.44554
   38    36 S   O2Z  _O32    31     1.26437   114.34343   174.77554
   39    33 S   CT   _C6_    39     1.52753   110.03619   157.89044
   40    39 S   HC   _H4_    40     1.09826   111.32174    49.22161
   41    39 S   CT   _C5_    41     1.52475   114.58166   173.52661
   42    41 S   HC   _H3_    42     1.09417   111.98399   -84.52616
   43    41 S   CT   _C4_    43     1.51776   103.10426   154.00346
   44    43 S   HC   _H7_    44     1.09730   109.03539    91.69071
   45    43 S   HC   _H8_    45     1.09377   114.21075  -148.60252
   46    41 S   OH   _O35    67     1.42043   110.91278    35.58500
   47    46 S   HO   _H17    68     0.97228   108.05185   167.81110
   48    43 S   CO   _C7_    46     1.52822   104.50788   -23.80070
   49    48 S   HC   _H5_    47     1.09651   108.92581   121.07119
   50    48 S   N*   _N4_    48     1.46001   116.64608  -116.76360
   51    39 S   OS   _O33    66     1.43802   109.36251   -69.24315
   52    50 S   CDX  _C8_    49     1.37049   123.76247  -148.38941
   53    52 S   CT   _C11    50     1.50611   110.19009  -179.81025
   54    53 S   HC   _H6_    51     1.09247   111.91476  -103.37411
   55    53 S   CG   _C10    52     1.46795   106.43919   131.46578
   56    53 S   N    _N8_    62     1.43065    99.52150    13.70273
   57    56 S   H    _H14    63     1.01452   125.25445   177.76945
   58    55 S   NG   _N6_    53     1.33130   115.40733    41.26814
   59    58 S   H    _H11    54     1.01871   118.43897   179.66370
   60    55 S   NG   _N7_    59     1.32309   120.15769  -140.22260
   61    60 S   H    _H12    60     1.01237   121.38972     1.27871
   62    60 S   H    _H13    61     1.01782   120.61055   179.51181
   63    50 S   C    _C12    64     1.38160   126.43396    45.13365
   64    63 S   O    _O34    65     1.22258   128.68198    -7.09514
   65    58 S   CT   _C9_    55     1.47438   120.52387    -2.61614
   66    65 S   HC   _H9_    56     1.09416   107.36259  -158.94581
   67    65 S   HC   _H10    57     1.09530   109.22753    83.83617
   68    52 S   NI   _N5_    58     1.28983   125.47934    -2.08685
  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  12   6  10   7  10   6   5   3   1   9
   4  11   2  13  13   7  12   6   2   8   5   3   1   1   2   1
   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    48    51    46  
   35    39    40    41    51  
   39    40    41    51  
   37    38  
   38  
    0  
   40    41    42    43    44    45    48    49    50    51    46    47  
   41    42    43    48    51    46  
   42    43    44    45    48    49    50    51    46    47  
   43    44    45    48    51    46    47  
   44    45    48    49    50    52    63    51    46    47  
   45    48    49    50    51    46  
   48    49    50    51    46  
   47    48    51  
    0  
   49    50    52    53    68    56    63    64    51  
   50    52    63    51  
   52    53    54    55    65    68    56    57    63    64    51  
   52    63  
   53    54    55    58    65    66    67    68    60    56    57    63    64  
   54    55    58    59    65    68    60    61    62    56    57    63    64  
   55    58    68    60    56    57    63  
   58    59    65    66    67    68    60    61    62    56    57    63  
   57    63    64    58    60    68  
   63    64  
   59    65    66    67    68    60    61    62  
   65    66    67    68    60  
   61    62    65  
   62  
    0  
   64    68  
    0  
   66    67    68  
   67    68  
   68  
    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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.1200   0.1700  -0.655000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.0000   0.0000   0.390000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.100000   1.3810   1.2100   0.008598240   0.268726247
   50   3.2500   0.1700  -0.367500   1.8100   1.6000   0.054801302  -1.445846770
   51   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   52   3.7500   0.1050   0.481500   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5000   0.0660   0.321800   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   2.2500   0.0500   0.280700   2.0020   1.7750   0.023028004  -0.852763146
   56   3.2500   0.1700  -0.518100   1.8100   1.6000   0.054801302  -1.445846770
   57   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   58   3.2500   0.1700  -0.340900   1.8650   1.6500   0.051222218  -2.220205820
   59   0.0000   0.0000   0.345100   0.9960   0.8600   0.030040813  -0.651083722
   60   3.2500   0.1700  -0.747100   2.2900   2.0360   0.003973653   1.685851020
   61   0.0000   0.0000   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   62   0.0000   0.0000   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.7500   0.1050   0.813700   1.9250   1.7000   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.616300   1.5250   1.4250   0.001000000  -1.480495490
   65   3.5000   0.0660   0.349400   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.2800   0.1700  -0.516000   1.8540   1.6400   0.005000000   0.000000000
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   268.000  1.529
   41    46   320.000  1.410
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    48   250.000  1.527
   48    49   340.000  1.090
   48    50   275.000  1.479
   48    51   320.000  1.380
   50    52   360.000  1.429
   50    63   418.000  1.388
   52    53   260.000  1.508
   52    68   650.000  1.285
   53    54   340.000  1.090
   53    55   290.000  1.488
   53    56   337.000  1.449
   55    58   481.000  1.340
   55    60   481.000  1.340
   58    59   434.000  1.010
   58    65   337.000  1.463
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   315.000  1.435
   60    61   434.000  1.010
   60    62   434.000  1.010
   56    57   434.000  1.010
   56    63   490.000  1.335
   63    64   570.000  1.229
   46    47   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    58.35000  112.70000
   39    41    46    50.00000  109.50000
   39    51    48    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    45    37.50000  110.70000
   41    43    48    75.00000  109.43000
   41    46    47    55.00000  108.50000
   43    41    42    37.50000  110.70000
   43    48    49    45.00000  112.01100
   43    48    50    75.00000  107.44000
   43    48    51    90.00000  108.56700
   45    43    44    33.00000  107.80000
   48    43    44    45.00000  108.72000
   48    43    45    45.00000  108.72000
   48    50    52    70.00000  121.20000
   48    50    63    70.00000  117.60000
   50    48    49    55.00000  103.44000
   50    52    53    70.00000  106.88000
   50    52    68    80.00000  119.04400
   50    63    56    90.00000  111.91700
   50    63    64    80.00000  120.60000
   52    53    54    45.00000  109.58200
   52    53    55    60.00000  115.84000
   52    53    56    75.00000  110.78400
   52    68    65    75.00000  112.28000
   53    55    58    70.00000  119.45300
   53    55    60    70.00000  119.45300
   53    56    57    38.00000  118.40000
   53    56    63    50.00000  121.90000
   55    53    54    45.00000  109.33400
   55    58    59    35.00000  120.00000
   55    58    65    50.00000  123.20000
   55    60    61    35.00000  120.00000
   55    60    62    35.00000  120.00000
   58    65    66    35.00000  109.50000
   58    65    67    35.00000  109.50000
   58    65    68    85.00000  110.25000
   65    58    59    35.00000  118.40000
   67    65    66    33.00000  107.80000
   68    52    53    70.00000  118.34500
   68    65    66    50.00000  110.29200
   68    65    67    50.00000  110.29200
   60    55    58    70.00000  120.00000
   62    60    61    35.00000  120.00000
   56    53    54    35.00000  109.50000
   56    53    55    75.00000  110.78400
   56    63    64    80.00000  122.90000
   63    50    52    70.00000  121.60000
   63    56    57    35.00000  119.80000
   51    39    40    35.00000  109.50000
   51    39    41    50.00000  109.50000
   51    48    49    35.00000  109.50000
   51    48    50   105.00000  106.22000
   46    41    42    35.00000  109.50000
   46    41    43    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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   0.56750  1.0 1.0
   33    39    41    43  -0.07550 -1.0 2.0
   33    39    41    43   0.20000  1.0 3.0
   33    39    41    46   0.86500  1.0 1.0
   33    39    41    46  -0.17500 -1.0 2.0
   33    39    41    46   0.20800  1.0 3.0
   33    39    51    48   0.06250  1.0 1.0
   33    39    51    48  -0.01100 -1.0 2.0
   33    39    51    48   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    43    44   0.15000  1.0 3.0
   39    41    43    45   0.15000  1.0 3.0
   39    41   -43    48   3.97050  1.0 1.0
   39    41    46    47  -0.11600  1.0 1.0
   39    41    46    47  -0.09450 -1.0 2.0
   39    41    46    47   0.21250  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    46   0.23400  1.0 3.0
   40    39    51    48   0.37050  1.0 3.0
   41    39   -51    48   0.06250  1.0 1.0
   41    39   -51    48  -0.01100 -1.0 2.0
   41    39   -51    48   0.28050  1.0 3.0
   41    43    48    49   0.15000  1.0 3.0
   41    43    48    50  -0.27100  1.0 1.0
   41    43    48    50  -0.01700 -1.0 2.0
   41    43    48    50  -0.48600  1.0 3.0
   41    43   -48    51   0.62750  1.0 1.0
   41    43   -48    51  -0.30950 -1.0 2.0
   41    43   -48    51   0.27300  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    45   0.15000  1.0 3.0
   42    41    43    48   0.15000  1.0 3.0
   42    41    46    47   0.19450  1.0 3.0
   43    41    46    47  -0.11600  1.0 1.0
   43    41    46    47  -0.09450 -1.0 2.0
   43    41    46    47   0.21250  1.0 3.0
   43    48    50    52   2.08450  1.0 1.0
   43    48    50    52  -0.39300 -1.0 2.0
   43    48    50    52   0.23400  1.0 3.0
   43    48    50    63  -0.43950  1.0 1.0
   43    48    50    63  -0.08100 -1.0 2.0
   43    48    50    63   0.03350  1.0 3.0
   43    48   -51    39   0.06250  1.0 1.0
   43    48   -51    39  -0.01100 -1.0 2.0
   43    48   -51    39   0.28050  1.0 3.0
   44    43    48    49   0.15000  1.0 3.0
   44    43    48    50   0.15000  1.0 3.0
   44    43    48    51   0.23400  1.0 3.0
   45    43    48    49   0.15000  1.0 3.0
   45    43    48    50   0.15000  1.0 3.0
   45    43    48    51   0.23400  1.0 3.0
   48    50    52    53   3.62500 -1.0 2.0
   48    50    52    68   3.62500 -1.0 2.0
   48    50    63    56   3.62500 -1.0 2.0
   48    50    63    64   3.04450 -1.0 2.0
   49    48    50    52   0.00000  1.0 1.0
   49    48    50    63   0.00000  1.0 1.0
   49    48    51    39   0.37050  1.0 3.0
   50    48    51    39  -2.37750  1.0 1.0
   50    48    51    39  -0.08150 -1.0 2.0
   50    48    51    39   0.59000  1.0 3.0
   50    52    53    54   0.00000  1.0 1.0
   50    52    53    55  -1.35150  1.0 1.0
   50    52    53    55   0.13900 -1.0 2.0
   50    52    53    55   0.25250  1.0 3.0
   50    52   -53    56   0.00000  1.0 1.0
   50    52    68    65   6.00000 -1.0 2.0
   52    50   -63    56   3.62500 -1.0 2.0
   52    50    63    64   2.67200 -1.0 2.0
   52    53    55    58  -1.35150  1.0 1.0
   52    53    55    58   0.13900 -1.0 2.0
   52    53    55    58   0.25250  1.0 3.0
   52    53    55    60  -1.35150  1.0 1.0
   52    53    55    60   0.13900 -1.0 2.0
   52    53    55    60   0.25250  1.0 3.0
   52    53    56    57   0.00000  1.0 1.0
   52    53   -56    63  -0.19250  1.0 1.0
   52    53   -56    63  -0.00500 -1.0 2.0
   52    53   -56    63   0.17000  1.0 3.0
   53    52    68    65   6.00000 -1.0 2.0
   53    55    58    59   1.50000 -1.0 2.0
   53    55   -58    65   6.00000 -1.0 2.0
   53    55    60    61   1.50000 -1.0 2.0
   53    55    60    62   1.50000 -1.0 2.0
   53    56   -63    50   4.56800  1.0 1.0
   53    56   -63    50   0.31650 -1.0 2.0
   53    56    63    64   3.04450 -1.0 2.0
   54    53    55    58   0.00000  1.0 1.0
   54    53    55    60   0.00000  1.0 1.0
   54    53    56    57   0.00000  1.0 1.0
   54    53    56    63   0.00000  1.0 1.0
   55    53    56    57   0.00000  1.0 1.0
   55    53    56    63  -0.19250  1.0 1.0
   55    53    56    63  -0.00500 -1.0 2.0
   55    53    56    63   0.17000  1.0 3.0
   55    58    65    66   0.08850  1.0 3.0
   55    58    65    67   0.08850  1.0 3.0
   55    58    65    68  -0.12500  1.0 1.0
   55    58    65    68  -0.12500 -1.0 2.0
   55    58    65    68   0.25000  1.0 3.0
   58    55    60    61   1.50000 -1.0 2.0
   58    55    60    62   1.50000 -1.0 2.0
   58    65   -68    52  -0.12500  1.0 1.0
   58    65   -68    52  -0.12500 -1.0 2.0
   58    65   -68    52   0.25000  1.0 3.0
   59    58    65    66   0.00000  1.0 1.0
   59    58    65    67   0.00000  1.0 1.0
   59    58    65    68   0.00000  1.0 1.0
   66    65    68    52  -0.15000  1.0 3.0
   67    65    68    52  -0.15000  1.0 3.0
   68    52    53    54   0.00000  1.0 1.0
   68    52   -53    55   0.00000  1.0 1.0
   68    52    53    56   0.00000  1.0 1.0
   60    55    58    59   1.50000 -1.0 2.0
   60    55    58    65   3.96800 -1.0 2.0
   56    53    55    58   0.00000  1.0 1.0
   56    53    55    60   0.00000  1.0 1.0
   57    56    63    50   2.56700 -1.0 2.0
   57    56    63    64   2.45000 -1.0 2.0
   63    50   -52    53  -0.45200  1.0 1.0
   63    50   -52    53   0.85900 -1.0 2.0
   63    50   -52    53   0.16650  1.0 3.0
   63    50    52    68  -0.56400  1.0 1.0
   63    50    52    68   0.77500 -1.0 2.0
   63    50    52    68   0.18700  1.0 3.0
   51    39    41    42   0.23400  1.0 3.0
   51    39   -41    43   0.62750  1.0 1.0
   51    39   -41    43  -0.30950 -1.0 2.0
   51    39   -41    43   0.27300  1.0 3.0
   51    39    41    46   3.69350  1.0 1.0
   51    39    41    46  -1.82950 -1.0 2.0
   51    48    50    52  -0.28000  1.0 1.0
   51    48    50    52  -1.16550 -1.0 2.0
   51    48    50    63  -2.75650  1.0 1.0
   51    48    50    63  -1.18150 -1.0 2.0
   51    48    50    63   0.81900  1.0 3.0
   46    41    43    44   0.23400  1.0 3.0
   46    41    43    45   0.23400  1.0 3.0
   46    41    43    48   0.86500  1.0 1.0
   46    41    43    48  -0.17500 -1.0 2.0
   46    41    43    48   0.20800  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   63    52    50    48   1.00000 -1.0 2.0
   50    53    52    68  10.50000 -1.0 2.0
   58    53    55    60  10.50000 -1.0 2.0
   59    55    58    65   1.00000 -1.0 2.0
   61    62    60    55   1.00000 -1.0 2.0
   57    63    56    53   1.00000 -1.0 2.0
   50    56    63    64  10.50000 -1.0 2.0
END
