* LIGAND DATABASE FILE (OPLS2005)
*
001      74    74    136    196     395
    1     0 S   NP   _N1_     1    28.02296    96.38868   -23.02551
    2     1 S   H    _HN1     2     1.02777   103.69074  -112.10326
    3     1 S   H    _H1_     3     1.02958    78.40469    -5.81022
    4     1 S   H    _H2_     4     1.02836    32.42182   145.99624
    5     1 S   CT   _CA1     5     1.50134   136.90786   101.72990
    6     5 S   HC   _HA1     6     1.09575   105.21235    82.74676
    7     5 S   CO3  _C1_     7     1.53780   112.35280   -37.43570
    8     7 S   O2Z  _O11     8     1.26364   114.99611   -44.12134
    9     7 S   O2Z  _O12     9     1.26235   114.93082   134.95154
   10     5 S   CT   _CB1    10     1.53096   107.42111  -159.35837
   11    10 S   HC   HB11    11     1.09827   109.31466   -50.55970
   12    10 S   HC   HB12    12     1.09816   110.43392    65.98764
   13    10 S   CT   _CG1    13     1.53024   112.68458  -171.63078
   14    13 S   HC   HG11    14     1.09594   110.49720   -64.63216
   15    13 S   HC   HG12    15     1.09658   109.91465    54.57179
   16    13 S   C    _CD1    16     1.51845   112.29966   174.92773
   17    16 S   O    _OE1    17     1.22755   123.28482     0.68300
   18    16 S   N    _N2_    18     1.38562   111.73044  -179.27909
   19    18 S   H    _HN2    19     1.01560   119.04034     4.30907
   20    18 S   CT1  _CA2    20     1.45827   122.85440   177.88382
   21    20 S   HC   _HA2    21     1.09733   108.90125    24.50430
   22    20 S   C    _C2_    22     1.52933   107.06829   -92.50686
   23    22 S   O    _O2_    23     1.22974   123.07906   -26.55300
   24    20 S   CT   _CB2    32     1.53146   112.19462   147.65252
   25    24 S   HC   HB21    33     1.09528   110.23084    54.33892
   26    24 S   HC   HB22    34     1.09535   110.20325   173.24983
   27    22 S   N    _N3_    24     1.38500   112.53300   156.14873
   28    27 S   H    _HN3    25     1.01658   120.33737    -2.17556
   29    24 S   S    _SG2    35     1.82656   111.13362   -66.99148
   30    27 S   CT   _CA3    26     1.45356   122.52022   178.61888
   31    30 S   HC   HA31    27     1.09566   107.83608   -55.40215
   32    30 S   HC   HA32    28     1.09561   107.59491    60.94612
   33    29 S   CT   _C13    36     1.87780    99.47905   177.66795
   34    33 S   HC   _H3_    37     1.09051   103.24993    26.44328
   35    30 S   CO3  _C3_    29     1.52897   114.28941  -177.29955
   36    35 S   O2Z  _O31    30     1.26341   116.04133     0.52451
   37    35 S   O2Z  _O32    31     1.26432   114.41969  -179.52563
   38    33 S   CT   _C11    38     1.55854   105.76665   -86.99561
   39    38 S   HC   _H24    39     1.10047   108.18140    48.49072
   40    38 S   HC   _H25    40     1.09582   109.11058   -62.92269
   41    33 S   CT   _C14    56     1.58338   112.54328   141.45332
   42    41 S   OM   _O16    57     1.32420   110.15238    69.01664
   43    38 S   CM   _C6_    41     1.51704   120.15395   168.39099
   44    41 S   CT   _C18    58     1.55375   111.58561   -49.54834
   45    44 S   HC   _H38    59     1.09741   113.33749    69.17373
   46    44 S   HC   _H39    60     1.09615   111.13845   -51.76104
   47    44 S   HC   _H40    61     1.09879   111.61272  -171.17706
   48    43 S   CO4  _C7_    42     1.50239   115.30272   -79.46213
   49    48 S   O    _O17    43     1.23264   119.32903   -97.18816
   50    43 S   CM   _C8_    66     1.35599   126.16654   111.75340
   51    48 S   CT   _C10    44     1.52241   119.68341    80.60070
   52    51 S   HC   _H22    45     1.08994   109.22197   -62.52165
   53    51 S   HC   _H23    46     1.09815   107.68757  -175.17879
   54    50 S   CT   _C16    67     1.51086   123.93940    -7.17343
   55    54 S   HC   _H32    68     1.09529   109.98388   116.76311
   56    54 S   HC   _H33    69     1.09567   109.89709  -124.13358
   57    54 S   HC   _H34    70     1.08950   114.39279    -4.06578
   58    50 S   CT   _C17    71     1.51153   124.84654   172.96684
   59    58 S   HC   _H35    72     1.09503   109.97132   110.43147
   60    58 S   HC   _H36    73     1.09582   110.04279  -130.39841
   61    58 S   HC   _H37    74     1.09031   114.14288   -11.09860
   62    51 S   CM   _C5_    47     1.50726   112.90924    64.64588
   63    62 S   CM   _C4_    48     1.34781   124.39180   -99.70865
   64    63 S   HC   _H19    49     1.08870   118.73023   179.65622
   65    62 S   CT   _C15    62     1.50653   115.44594    82.35041
   66    65 S   HC   _H29    63     1.09272   111.09638   -55.50238
   67    65 S   HC   _H30    64     1.09514   112.31283  -175.92537
   68    65 S   HC   _H31    65     1.09513   109.98461    64.19596
   69    63 S   CT   _C9_    50     1.50223   126.53571    -1.45522
   70    69 S   HC   _H20    51     1.09807   107.79953  -146.38143
   71    69 S   HC   _H21    52     1.09158   110.34724   -33.08721
   72    69 S   CT   _C12    53     1.53685   112.29066    93.77237
   73    72 S   HC   _H26    54     1.09389   110.62143   -11.32853
   74    72 S   HC   _H27    55     1.10266   106.81633   100.61265
  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
  17   8   2   1   1  13   5   4  13   8  15   7   3   2   1  10
   5   9  10   4   3   7   3   2   1   3   2   1   1  10  11   5
   4   2   1   1   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    72    41    42    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    48    69    72    73    74    41    42    44    45    46    47    50  
   38    39    40    43    72    41    42    44  
   36    37  
   37  
    0  
   39    40    43    48    49    51    72    41    42    44    50    54    58  
   40    43    48    41    50  
   43    48    41    50  
   42    44    45    46    47    43    63    69    70    71    72    73    74  
   44    45    46    47    69    72    73    74  
   48    49    51    52    53    62    50    54    55    56    57    58    59    60    61  
   45    46    47    69    72    73    74  
   46    47    72  
   47    72  
   72  
   49    51    52    53    62    63    65    50    54    58  
   51    52    53    62    50  
   54    55    56    57    58    59    60    61    51  
   52    53    62    63    64    69    65    66    67    68  
   53    62    63    65  
   62    63    65  
   55    56    57    58    59    60    61  
   56    57    58  
   57    58  
   58  
   59    60    61  
   60    61  
   61  
    0  
   63    64    69    70    71    72    65    66    67    68  
   64    69    70    71    72    73    74    65    66    67    68  
   69    70    71    72    65  
   66    67    68    69  
   67    68  
   68  
    0  
   70    71    72    73    74  
   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   317.000  1.510
   43    48   320.000  1.462
   43    50   549.000  1.340
   48    49   570.000  1.229
   48    51   317.000  1.522
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    62   317.000  1.510
   62    63   549.000  1.340
   62    65   317.000  1.510
   63    64   340.000  1.080
   63    69   317.000  1.510
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    41   268.000  1.529
   41    42   570.000  1.307
   41    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   50    54   317.000  1.510
   50    58   317.000  1.510
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   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    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    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    70.00000  112.02700
   33    41    72    58.35000  112.70000
   33    41    42    50.00000  109.50000
   33    41    44    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    43    48    65.00000  116.34900
   38    43    50    70.00000  124.00000
   40    38    39    33.00000  107.80000
   43    38    39    35.00000  109.50000
   43    38    40    35.00000  109.50000
   43    48    49    80.00000  123.72100
   43    48    51    65.00000  118.62400
   43    50    54    70.00000  124.00000
   43    50    58    70.00000  124.00000
   48    51    52    35.00000  109.50000
   48    51    53    35.00000  109.50000
   48    51    62    70.00000  109.06800
   51    48    49    80.00000  120.40000
   51    62    63    70.00000  124.00000
   51    62    65    65.00000  117.92700
   53    51    52    33.00000  107.80000
   62    51    52    35.00000  109.50000
   62    51    53    35.00000  109.50000
   62    63    64    35.00000  120.00000
   62    63    69    70.00000  124.00000
   62    65    66    35.00000  109.50000
   62    65    67    35.00000  109.50000
   62    65    68    35.00000  109.50000
   63    69    70    35.00000  109.50000
   63    69    71    35.00000  109.50000
   63    69    72    70.00000  112.02700
   69    63    64    35.00000  117.00000
   69    72    73    37.50000  110.70000
   69    72    74    37.50000  110.70000
   69    72    41    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    37.50000  110.70000
   72    69    71    37.50000  110.70000
   72    41    42    50.00000  109.50000
   72    41    44    58.35000  112.70000
   74    72    73    33.00000  107.80000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41    72    73    37.50000  110.70000
   41    72    74    37.50000  110.70000
   41    44    45    37.50000  110.70000
   41    44    46    37.50000  110.70000
   41    44    47    37.50000  110.70000
   44    41    42    50.00000  109.50000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   65    62    63    70.00000  124.00000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   50    43    48    65.00000  118.96000
   50    54    55    35.00000  109.50000
   50    54    56    35.00000  109.50000
   50    54    57    35.00000  109.50000
   50    58    59    35.00000  109.50000
   50    58    60    35.00000  109.50000
   50    58    61    35.00000  109.50000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   58    50    54    65.00000  117.92700
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    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    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    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   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   0.15000  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    41    72   0.44750  1.0 1.0
   29    33    41    72  -0.17800 -1.0 2.0
   29    33    41    72   0.20200  1.0 3.0
   29    33    41    42   0.56750  1.0 1.0
   29    33    41    42  -0.07550 -1.0 2.0
   29    33    41    42   0.20000  1.0 3.0
   29    33    41    44   0.44750  1.0 1.0
   29    33    41    44  -0.17800 -1.0 2.0
   29    33    41    44   0.20200  1.0 3.0
   33    38    43    48   0.09700  1.0 1.0
   33    38    43    48   0.15600 -1.0 2.0
   33    38    43    48  -0.50800  1.0 3.0
   33    38    43    50   0.09850  1.0 1.0
   33    38    43    50   0.15250 -1.0 2.0
   33    38    43    50  -0.50650  1.0 3.0
   33    41    44    45   0.15000  1.0 3.0
   33    41    44    46   0.15000  1.0 3.0
   33    41    44    47   0.15000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    43   0.15000  1.0 3.0
   34    33    41    72   0.15000  1.0 3.0
   34    33    41    42   0.23400  1.0 3.0
   34    33    41    44   0.15000  1.0 3.0
   38    33    41    72   0.56750  1.0 1.0
   38    33    41    72  -0.07550 -1.0 2.0
   38    33    41    72   0.20000  1.0 3.0
   38    33    41    42   0.62750  1.0 1.0
   38    33    41    42  -0.30950 -1.0 2.0
   38    33    41    42   0.27300  1.0 3.0
   38    33    41    44   0.56750  1.0 1.0
   38    33    41    44  -0.07550 -1.0 2.0
   38    33    41    44   0.20000  1.0 3.0
   38    43    48    49  -0.64400  1.0 1.0
   38    43    48    49   0.26850 -1.0 2.0
   38    43    48    51   0.25700  1.0 1.0
   38    43    48    51   0.66200 -1.0 2.0
   38    43    48    51   0.04450  1.0 3.0
   38    43    50    54   7.00000 -1.0 2.0
   38    43    50    58   7.00000 -1.0 2.0
   39    38    43    48   0.15000  1.0 3.0
   39    38    43    50   0.00000  1.0 1.0
   40    38    43    48   0.15000  1.0 3.0
   40    38    43    50   0.00000  1.0 1.0
   43    48    51    52   0.00000  1.0 1.0
   43    48    51    53   0.00000  1.0 1.0
   43    48    51    62   0.65300  1.0 1.0
   43    48    51    62  -0.03850 -1.0 2.0
   43    48    51    62   0.33900  1.0 3.0
   43    50    54    55   0.00000  1.0 1.0
   43    50    54    56   0.00000  1.0 1.0
   43    50    54    57   0.00000  1.0 1.0
   43    50    58    59   0.00000  1.0 1.0
   43    50    58    60   0.00000  1.0 1.0
   43    50    58    61   0.00000  1.0 1.0
   48    43    50    54   7.00000 -1.0 2.0
   48    43    50    58   7.00000 -1.0 2.0
   48    51    62    63  -0.51250  1.0 1.0
   48    51    62    63  -0.88800 -1.0 2.0
   48    51    62    63   0.08850  1.0 3.0
   48    51    62    65   0.17250  1.0 1.0
   48    51    62    65  -0.04100 -1.0 2.0
   48    51    62    65  -0.33850  1.0 3.0
   49    48    51    52   0.00000  1.0 1.0
   49    48    51    53   0.00000  1.0 1.0
   49    48    51    62   0.30150 -1.0 2.0
   51    62    63    64   7.00000 -1.0 2.0
   51    62    63    69   7.00000 -1.0 2.0
   51    62    65    66   0.34800  1.0 3.0
   51    62    65    67   0.34800  1.0 3.0
   51    62    65    68   0.34800  1.0 3.0
   52    51    62    63   0.00000  1.0 1.0
   52    51    62    65   0.34800  1.0 3.0
   53    51    62    63   0.00000  1.0 1.0
   53    51    62    65   0.34800  1.0 3.0
   62    63    69    70   0.00000  1.0 1.0
   62    63    69    71   0.00000  1.0 1.0
   62    63    69    72   0.09850  1.0 1.0
   62    63    69    72   0.15250 -1.0 2.0
   62    63    69    72  -0.50650  1.0 3.0
   63    62    65    66   0.00000  1.0 1.0
   63    62    65    67   0.00000  1.0 1.0
   63    62    65    68   0.00000  1.0 1.0
   63    69    72    73   0.15000  1.0 3.0
   63    69    72    74   0.15000  1.0 3.0
   63    69    72    41   0.34400  1.0 1.0
   63    69    72    41   0.09450 -1.0 2.0
   63    69    72    41   0.11100  1.0 3.0
   64    63    69    70   0.33100  1.0 3.0
   64    63    69    71   0.33100  1.0 3.0
   64    63    69    72   0.00000  1.0 1.0
   69    72    41    33   0.56750  1.0 1.0
   69    72    41    33  -0.07550 -1.0 2.0
   69    72    41    33   0.20000  1.0 3.0
   69    72    41    42   0.62750  1.0 1.0
   69    72    41    42  -0.30950 -1.0 2.0
   69    72    41    42   0.27300  1.0 3.0
   69    72    41    44   0.56750  1.0 1.0
   69    72    41    44  -0.07550 -1.0 2.0
   69    72    41    44   0.20000  1.0 3.0
   70    69    72    73   0.15000  1.0 3.0
   70    69    72    74   0.15000  1.0 3.0
   70    69    72    41   0.15000  1.0 3.0
   71    69    72    73   0.15000  1.0 3.0
   71    69    72    74   0.15000  1.0 3.0
   71    69    72    41   0.15000  1.0 3.0
   72    41    44    45   0.15000  1.0 3.0
   72    41    44    46   0.15000  1.0 3.0
   72    41    44    47   0.15000  1.0 3.0
   73    72    41    33   0.15000  1.0 3.0
   73    72    41    42   0.23400  1.0 3.0
   73    72    41    44   0.15000  1.0 3.0
   74    72    41    33   0.15000  1.0 3.0
   74    72    41    42   0.23400  1.0 3.0
   74    72    41    44   0.15000  1.0 3.0
   41    33    38    39   0.15000  1.0 3.0
   41    33    38    40   0.15000  1.0 3.0
   41    33    38    43   0.34400  1.0 1.0
   41    33    38    43   0.09450 -1.0 2.0
   41    33    38    43   0.11100  1.0 3.0
   42    41    44    45   0.23400  1.0 3.0
   42    41    44    46   0.23400  1.0 3.0
   42    41    44    47   0.23400  1.0 3.0
   65    62    63    64   7.00000 -1.0 2.0
   65    62    63    69   7.00000 -1.0 2.0
   50    43    48    49   1.00000 -1.0 2.0
   50    43    48    51  -0.33500  1.0 1.0
   50    43    48    51   1.06600 -1.0 2.0
   50    43    48    51  -0.14000  1.0 3.0
   54    50    58    59   0.34800  1.0 3.0
   54    50    58    60   0.34800  1.0 3.0
   54    50    58    61   0.34800  1.0 3.0
   58    50    54    55   0.34800  1.0 3.0
   58    50    54    56   0.34800  1.0 3.0
   58    50    54    57   0.34800  1.0 3.0
IPHI
    9     5     7     8  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    35    36  10.50000 -1.0 2.0
   38    48    43    50   1.10000 -1.0 2.0
   43    51    48    49  10.50000 -1.0 2.0
   51    65    62    63   1.10000 -1.0 2.0
   69    64    63    62   1.10000 -1.0 2.0
   54    58    50    43   1.10000 -1.0 2.0
END
