* LIGAND DATABASE FILE (OPLS2005)
*
001      74    75    135    204     383
    1     0 S   NP   _N1_     1    30.98143   100.56624   -23.97558
    2     1 S   H    _HN1     2     1.02852    39.09444   -60.05135
    3     1 S   H    _H1_     3     1.02752    84.80449   174.02545
    4     1 S   H    _H2_     4     1.03483   146.86645   -71.51172
    5     1 S   CT   _CA1     5     1.50061    90.96695    62.99129
    6     5 S   HC   _HA1     6     1.09551   104.89181   144.32061
    7     5 S   CO3  _C1_     7     1.53681   113.33101    23.70410
    8     7 S   O2Z  _O11     8     1.26392   115.09479   -32.85206
    9     7 S   O2Z  _O12     9     1.26245   115.02893   146.53342
   10     5 S   CT   _CB1    10     1.53037   107.45372   -97.26332
   11    10 S   HC   HB11    11     1.09564   109.47929   -40.15623
   12    10 S   HC   HB12    12     1.09837   110.35916    75.44116
   13    10 S   CT   _CG1    13     1.53243   112.95832  -162.83436
   14    13 S   HC   HG11    14     1.09558   110.83315   -97.47947
   15    13 S   HC   HG12    15     1.09607   111.67809    21.75187
   16    13 S   C    _CD1    16     1.51522   109.45862   142.55531
   17    16 S   O    _OE1    17     1.22797   121.81887    85.85623
   18    16 S   N    _N2_    18     1.38581   112.52665   -90.87198
   19    18 S   H    _HN2    19     1.01583   119.22194    -3.73654
   20    18 S   CT1  _CA2    20     1.46189   123.51376   174.18442
   21    20 S   HC   _HA2    21     1.09713   109.25639    -6.96075
   22    20 S   C    _C2_    22     1.53844   109.08263  -122.75153
   23    22 S   O    _O2_    23     1.23092   122.03592  -157.60444
   24    20 S   CT   _CB2    32     1.53534   111.66194   115.33247
   25    24 S   HC   HB21    33     1.09483   109.20879    56.73298
   26    24 S   HC   HB22    34     1.09398   109.81201   175.23211
   27    22 S   N    _N3_    24     1.38319   114.14920    29.07798
   28    27 S   H    _HN3    25     1.01436   119.13572    -2.23738
   29    24 S   S    _SG2    35     1.82967   111.63287   -64.31526
   30    27 S   CT   _CA3    26     1.45338   123.35239   178.10948
   31    30 S   HC   HA31    27     1.09554   107.21162   -69.26507
   32    30 S   HC   HA32    28     1.09556   108.20768    47.07048
   33    29 S   CT   _C9_    36     1.83521   101.62969  -179.11353
   34    30 S   CO3  _C3_    29     1.53025   114.39032   169.09263
   35    34 S   O2Z  _O31    30     1.26436   116.30521    -8.31430
   36    34 S   O2Z  _O32    31     1.26408   114.46127   171.82524
   37    33 S   CM   _C10    37     1.52176   114.36419  -165.28621
   38    33 S   S    _S1_    62     1.84452   112.55363    68.04636
   39    37 S   N4   _N4_    38     1.36513   108.81967   139.29897
   40    37 S   CMA  _C11    59     1.51087   127.11882   -29.29868
   41    40 S   OM   _O33    60     1.26298   120.09353  -102.95373
   42    40 S   OM   _O34    61     1.26293   121.29027    78.60413
   43    38 S   CM   _C13    63     1.72986   103.25266    60.35995
   44    43 S   HC   _H11    64     1.08457   118.85295    -2.92155
   45    39 S   C4   _C12    39     1.35079   132.87880  -131.43543
   46    45 S   O    _O35    40     1.20914   134.03654   -39.25663
   47    39 S   C4T  _C7_    43     1.45423   113.65506    -2.42511
   48    47 S   HC   _H5_    44     1.09851   111.42950   100.48751
   49    43 S   CM   _C14    65     1.33856   121.49479   176.96185
   50    49 S   HC   _H12    66     1.08566   121.99615     0.33977
   51    45 S   C4T  _C6_    41     1.56061    89.99112   136.53336
   52    51 S   HC   _H4_    42     1.10023   111.03664   109.09250
   53    33 S   CT   _C8_    45     1.56275   109.92478   -53.86910
   54    53 S   HC   _H9_    46     1.09579   113.69725    85.16552
   55    53 S   HC   _H10    47     1.09668   110.30013   -35.82933
   56    49 S   N    _N5_    67     1.37286   121.88320  -179.37536
   57    56 S   H    _H13    68     1.01706   117.32384     0.69492
   58    51 S   CT   _C5_    48     1.52576   116.62512  -122.01654
   59    58 S   HC   _H3_    49     1.09574   111.04577    48.84009
   60    56 S   C    _C15    69     1.38633   123.66782  -179.78971
   61    60 S   O    _O36    70     1.22834   126.12535     0.88404
   62    58 S   CT   _C4_    50     1.52583   109.74655   -72.68797
   63    62 S   HC   _H6_    51     1.09596   110.94882   -58.68290
   64    62 S   HC   _H7_    52     1.09405   111.10555  -177.12159
   65    62 S   HC   _H8_    53     1.09373   111.61656    62.09036
   66    58 S   OS   _O37    54     1.42952   107.22776   169.84807
   67    60 S   CT   _C16    71     1.50571   112.06667  -179.79158
   68    67 S   HC   _H14    72     1.09377   110.13806    52.67435
   69    67 S   HC   _H15    73     1.09350   109.58512   -67.85826
   70    67 S   HC   _H16    74     1.09350   109.71770   172.33251
   71    66 S   SY   _S2_    55     1.64057   120.95807  -142.98029
   72    71 S   OY   _O40    56     1.46129   104.91946   -50.53195
   73    71 S   OY   _O38    57     1.46185   103.30796  -170.31077
   74    71 S   OY   _O39    58     1.46118   104.36405    70.15410
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  16   2   1   1  14  11  13   5   1   1   7   3  10   4  10   6
   6   3  12   5   3   1   1   7   3  10   6   5   4   5   3   2
   1   4   3   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    53    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    39    47    53    54    55    40    38    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    39    45    51    47    48    53    54    55    40    41    42    38    43    44    49  
   35    36  
   36  
    0  
   39    45    46    51    47    48    53    54    55    40    41    42    38    43  
   43    44    49    50    56    39    40    47    53    54    55  
   45    46    51    52    47    48    53    54    55    58    40    41    42  
   41    42    45    47    53  
   42  
    0  
   44    49    50    56    57    60    53  
   49    50    56  
   46    51    52    47    48    53    58    59    62    66  
   51    52    47    58  
   48    53    54    55    58    59    62    66    51    52  
   53    54    55    58    51    52  
   50    56    57    60    61    67  
   56    57    60  
   52    53    54    55    58    59    62    63    64    65    66    71  
   53    58    59    62    66  
   54    55    58  
   55  
    0  
   57    60    61    67    68    69    70  
   60    61    67  
   59    62    63    64    65    66    71    72    73    74  
   62    63    64    65    66    71  
   61    67    68    69    70  
   67    68    69    70  
   63    64    65    66    71  
   64    65    66  
   65    66  
   66  
   71    72    73    74  
   68    69    70  
   69    70  
   70  
    0  
   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   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.549900   2.0020   1.7750   0.023028004  -0.852763146
   38   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   39   3.2500   0.1700  -0.296300   1.8100   1.6000   0.054801302  -1.445846770
   40   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   42   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   43   3.5500   0.0760  -0.107500   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5000   0.0660   0.003700   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   49   3.5500   0.0760  -0.063700   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.061200   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   57   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   58   3.5000   0.0660   0.169900   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.9000   0.1400  -0.500300   1.5900   1.4000   0.020110767  -0.896042159
   67   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5500   0.2500   1.628500   2.0025   1.7750   0.025682759  -1.666211680
   72   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   73   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   74   2.9600   0.1700  -0.766433   1.6780   1.4800   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    53   268.000  1.529
   33    38   222.000  1.810
   37    39   400.000  1.384
   37    40   465.000  1.376
   39    45   440.000  1.369
   39    47   305.000  1.456
   45    46   930.000  1.212
   45    51   250.000  1.540
   51    52   340.000  1.090
   51    47   268.000  1.529
   51    58   260.000  1.519
   47    48   340.000  1.090
   47    53   260.000  1.519
   53    54   340.000  1.090
   53    55   340.000  1.090
   58    59   340.000  1.090
   58    62   268.000  1.529
   58    66   320.000  1.410
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   66    71   335.000  1.682
   71    72   735.000  1.471
   71    73   735.000  1.471
   71    74   735.000  1.471
   40    41   745.000  1.250
   40    42   745.000  1.250
   38    43   240.000  1.763
   43    44   340.000  1.080
   43    49   549.000  1.340
   49    50   340.000  1.080
   49    56   400.000  1.384
   56    57   434.000  1.010
   56    60   490.000  1.335
   60    61   570.000  1.229
   60    67   317.000  1.522
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    53    75.00000  111.63000
   29    33    38    75.00000  118.28000
   33    37    39    70.00000  113.82800
   33    37    40    70.00000  124.00000
   33    53    47    70.00000  112.98000
   33    53    54    37.50000  110.70000
   33    53    55    37.50000  110.70000
   33    38    43    85.00000  102.41200
   37    39    45    50.00000  132.10000
   37    39    47    50.00000  132.70000
   37    40    41    65.00000  137.10300
   37    40    42    65.00000  137.10300
   39    45    46    75.00000  131.60000
   39    45    51    95.00000   92.72400
   39    47    51   105.00000   87.49700
   39    47    48    50.00000  112.01000
   39    47    53    80.00000  110.05700
   45    51    52    40.00000  113.37500
   45    51    47   100.00000   86.36000
   45    51    58    63.00000  111.10000
   51    45    46    60.00000  136.58000
   51    47    48    37.50000  110.70000
   51    47    53    65.00000  119.52000
   51    58    59    45.00000  111.22300
   51    58    62    70.00000  112.98000
   51    58    66    50.00000  109.50000
   47    39    45   100.00000   93.00000
   47    51    52    37.50000  110.70000
   47    53    54    45.00000  111.22300
   47    53    55    45.00000  111.22300
   53    33    37    70.00000  112.02700
   53    47    48    45.00000  112.72800
   55    53    54    33.00000  107.80000
   58    51    52    45.00000  112.72800
   58    51    47    65.00000  119.52000
   58    62    63    37.50000  110.70000
   58    62    64    37.50000  110.70000
   58    62    65    37.50000  110.70000
   58    66    71   100.00000  113.05000
   62    58    59    37.50000  110.70000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   66    58    59    35.00000  109.50000
   66    58    62    50.00000  109.50000
   66    71    72   135.00000  106.70400
   66    71    73   135.00000  106.70400
   66    71    74   135.00000  106.70400
   73    71    72   115.00000  120.17200
   74    71    72   115.00000  120.17200
   74    71    73   115.00000  120.17200
   40    37    39    75.00000  120.83300
   42    40    41    65.00000  121.00000
   38    33    37    75.00000  112.20000
   38    33    53    75.00000  111.63000
   38    43    44    40.00000  115.49800
   38    43    49    65.00000  122.11800
   43    49    50    35.00000  120.00000
   43    49    56    75.00000  120.83300
   49    43    44    35.00000  120.00000
   49    56    57    45.00000  117.55000
   49    56    60    70.00000  120.89900
   56    49    50    45.00000  111.09300
   56    60    61    80.00000  122.90000
   56    60    67    70.00000  116.60000
   60    56    57    35.00000  119.80000
   60    67    68    35.00000  109.50000
   60    67    69    35.00000  109.50000
   60    67    70    35.00000  109.50000
   67    60    61    80.00000  120.40000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  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
   24    29    33    38   0.08500  1.0 1.0
   24    29    33    38  -0.53150 -1.0 2.0
   24    29    33    38   0.48050  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    39   0.09700  1.0 1.0
   29    33    37    39   0.15600 -1.0 2.0
   29    33    37    39  -0.50800  1.0 3.0
   29    33    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    53    47   0.44750  1.0 1.0
   29    33    53    47  -0.17800 -1.0 2.0
   29    33    53    47   0.20200  1.0 3.0
   29    33    53    54   0.15000  1.0 3.0
   29    33    53    55   0.15000  1.0 3.0
   29    33    38    43   0.08500  1.0 1.0
   29    33    38    43  -0.53150 -1.0 2.0
   29    33    38    43   0.48050  1.0 3.0
   33    37    39    45   0.00000  1.0 1.0
   33    37   -39    47   0.00000  1.0 1.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    42   7.00000 -1.0 2.0
   33    38    43    44   1.00000 -1.0 2.0
   33    38    43    49   1.00000 -1.0 2.0
   37    33   -53    47   0.34400  1.0 1.0
   37    33   -53    47   0.09450 -1.0 2.0
   37    33   -53    47   0.11100  1.0 3.0
   37    33    53    54   0.15000  1.0 3.0
   37    33    53    55   0.15000  1.0 3.0
   37    33    38    43   0.00000  1.0 1.0
   37    39    45    46   3.00000 -1.0 2.0
   37    39    45    51   3.00000 -1.0 2.0
   37    39   -47    51   0.00000  1.0 1.0
   37    39    47    48   0.00000  1.0 1.0
   37    39   -47    53   0.00000  1.0 1.0
   39    37    40    41   7.00000 -1.0 2.0
   39    37    40    42   7.00000 -1.0 2.0
   39    45    51    52   0.00000  1.0 1.0
   39    45   -51    47   3.00000 -1.0 2.0
   39    45    51    58   1.39750  1.0 1.0
   39    45    51    58  -0.07950 -1.0 2.0
   39    45    51    58  -0.18750  1.0 3.0
   39    47   -53    33   0.43900  1.0 1.0
   39    47   -53    33   0.49100 -1.0 2.0
   39    47   -53    33   0.28400  1.0 3.0
   39    47    53    54   0.15000  1.0 3.0
   39    47    53    55   0.15000  1.0 3.0
   45    39   -47    51   0.00000  1.0 1.0
   45    39    47    48   0.00000  1.0 1.0
   45    39    47    53   0.00000  1.0 1.0
   45    51   -47    39   3.00000 -1.0 2.0
   45    51   -47    48   0.15000  1.0 3.0
   45    51   -47    53  -0.95700  1.0 1.0
   45    51   -47    53  -0.18200 -1.0 2.0
   45    51   -47    53   0.29450  1.0 3.0
   45    51    58    59  -0.11250  1.0 3.0
   45    51    58    62  -0.95700  1.0 1.0
   45    51    58    62  -0.18200 -1.0 2.0
   45    51    58    62   0.29450  1.0 3.0
   45    51    58    66  -0.09450  1.0 1.0
   45    51    58    66  -1.12950 -1.0 2.0
   45    51    58    66   0.54000  1.0 3.0
   46    45    51    52   0.00000  1.0 1.0
   46    45    51    47  -0.11250  1.0 1.0
   46    45    51    47   0.11400 -1.0 2.0
   46    45    51    47  -0.28950  1.0 3.0
   46    45    51    58   0.30150 -1.0 2.0
   51    47    53    33   0.04050  1.0 1.0
   51    47    53    33   0.63700 -1.0 2.0
   51    47    53    33   0.17650  1.0 3.0
   51    47    53    54   0.00000  1.0 1.0
   51    47    53    55   0.00000  1.0 1.0
   51    58    62    63   0.15000  1.0 3.0
   51    58    62    64   0.15000  1.0 3.0
   51    58    62    65   0.15000  1.0 3.0
   51    58    66    71   0.37500  1.0 3.0
   52    51   -47    39   0.15000  1.0 3.0
   52    51    47    48   0.15000  1.0 3.0
   52    51    47    53   0.15000  1.0 3.0
   52    51    58    59   0.15000  1.0 3.0
   52    51    58    62   0.15000  1.0 3.0
   52    51    58    66   0.23400  1.0 3.0
   47    39   -45    46   3.00000 -1.0 2.0
   47    39   -45    51   3.00000 -1.0 2.0
   47    51    58    59   0.00000  1.0 1.0
   47    51    58    62   0.04050  1.0 1.0
   47    51    58    62   0.63700 -1.0 2.0
   47    51    58    62   0.17650  1.0 3.0
   47    51    58    66   0.62750  1.0 1.0
   47    51    58    66  -0.30950 -1.0 2.0
   47    51    58    66   0.27300  1.0 3.0
   48    47    53    33   0.15000  1.0 3.0
   48    47    53    54   0.15000  1.0 3.0
   48    47    53    55   0.15000  1.0 3.0
   53    33   -37    39  -0.93550  1.0 1.0
   53    33   -37    39   0.38900 -1.0 2.0
   53    33   -37    39   0.16950  1.0 3.0
   53    33    37    40   0.09850  1.0 1.0
   53    33    37    40   0.15250 -1.0 2.0
   53    33    37    40  -0.50650  1.0 3.0
   53    33    38    43   0.00000  1.0 1.0
   58    51   -47    39   0.43900  1.0 1.0
   58    51   -47    39   0.49100 -1.0 2.0
   58    51   -47    39   0.28400  1.0 3.0
   58    51    47    48   0.15000  1.0 3.0
   58    51    47    53   0.56750  1.0 1.0
   58    51    47    53  -0.07550 -1.0 2.0
   58    51    47    53   0.20000  1.0 3.0
   58    66    71    72   0.29800  1.0 3.0
   58    66    71    73   0.29800  1.0 3.0
   58    66    71    74   0.29800  1.0 3.0
   59    58    62    63   0.15000  1.0 3.0
   59    58    62    64   0.15000  1.0 3.0
   59    58    62    65   0.15000  1.0 3.0
   59    58    66    71   0.00000  1.0 1.0
   62    58    66    71   0.37500  1.0 3.0
   66    58    62    63   0.23400  1.0 3.0
   66    58    62    64   0.23400  1.0 3.0
   66    58    62    65   0.23400  1.0 3.0
   40    37    39    45   0.00000  1.0 1.0
   40    37    39    47   0.00000  1.0 1.0
   38    33    37    39   0.09700  1.0 1.0
   38    33    37    39   0.15600 -1.0 2.0
   38    33    37    39  -0.50800  1.0 3.0
   38    33    37    40   0.42700  1.0 1.0
   38    33    37    40  -0.70350 -1.0 2.0
   38    33    37    40  -0.43150  1.0 3.0
   38    33    53    47   0.44750  1.0 1.0
   38    33    53    47  -0.17800 -1.0 2.0
   38    33    53    47   0.20200  1.0 3.0
   38    33    53    54   0.15000  1.0 3.0
   38    33    53    55   0.15000  1.0 3.0
   38    43    49    50   7.00000 -1.0 2.0
   38    43    49    56   7.00000 -1.0 2.0
   43    49    56    57   0.78350 -1.0 2.0
   43    49    56    60  -0.18900  1.0 1.0
   43    49    56    60   1.70900 -1.0 2.0
   44    43    49    50   7.00000 -1.0 2.0
   44    43    49    56   7.00000 -1.0 2.0
   49    56    60    61   2.67200 -1.0 2.0
   49    56    60    67   0.67100  1.0 1.0
   49    56    60    67   1.42150 -1.0 2.0
   49    56    60    67   0.18700  1.0 3.0
   50    49    56    57   0.00000  1.0 1.0
   50    49    56    60   1.44600  1.0 1.0
   56    60    67    68   0.00000  1.0 1.0
   56    60    67    69   0.00000  1.0 1.0
   56    60    67    70   0.00000  1.0 1.0
   57    56    60    61   2.45000 -1.0 2.0
   57    56    60    67   2.45000 -1.0 2.0
   61    60    67    68   0.00000  1.0 1.0
   61    60    67    69   0.00000  1.0 1.0
   61    60    67    70   0.00000  1.0 1.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    39    37    40   1.10000 -1.0 2.0
   47    45    39    37   1.00000 -1.0 2.0
   39    51    45    46  10.50000 -1.0 2.0
   41    42    40    37   1.10000 -1.0 2.0
   38    44    43    49  15.00000 -1.0 2.0
   56    50    49    43  15.00000 -1.0 2.0
   57    60    56    49   1.00000 -1.0 2.0
   56    67    60    61  10.50000 -1.0 2.0
END
