* LIGAND DATABASE FILE (OPLS2005)
*
001      78    79    139    200     395
    1     0 S   NP   _N1_     1    28.72298    96.91664   -20.68313
    2     1 S   H    _HN1     2     1.02836    44.97056   141.26610
    3     1 S   H    _H1_     3     1.02781    86.89696   -99.43063
    4     1 S   H    _H2_     4     1.02959    76.97043    10.19295
    5     1 S   CT   _CA1     5     1.50128   154.49708   120.47094
    6     5 S   HC   _HA1     6     1.09561   105.26256    74.85075
    7     5 S   CO3  _C1_     7     1.53820   112.35413   -45.55544
    8     7 S   O2Z  _O11     8     1.26375   114.97168   -42.45814
    9     7 S   O2Z  _O12     9     1.26215   115.03328   136.72634
   10     5 S   CT   _CB1    10     1.53096   107.44579  -166.97514
   11    10 S   HC   HB11    11     1.09826   109.61939   -48.13917
   12    10 S   HC   HB12    12     1.09823   110.30176    68.51005
   13    10 S   CT   _CG1    13     1.53008   112.59639  -169.08972
   14    13 S   HC   HG11    14     1.09604   110.53677   -61.24988
   15    13 S   HC   HG12    15     1.09645   109.94312    58.00873
   16    13 S   C    _CD1    16     1.51808   112.24919   178.65885
   17    16 S   O    _OE1    17     1.22721   123.26664     1.86865
   18    16 S   N    _N2_    18     1.38608   111.63451  -178.76949
   19    18 S   H    _HN2    19     1.01587   119.01698     2.81605
   20    18 S   CT1  _CA2    20     1.46290   123.41140  -176.45945
   21    20 S   HC   _HA2    21     1.09721   109.44954    -6.22841
   22    20 S   C    _C2_    22     1.53366   108.71841  -122.23579
   23    22 S   O    _O2_    23     1.23031   122.12929  -146.16692
   24    20 S   CT   _CB2    32     1.53416   111.01690   115.56245
   25    24 S   HC   HB21    33     1.09573   109.32839    58.01477
   26    24 S   HC   HB22    34     1.09500   110.78199   176.75816
   27    22 S   N    _N3_    24     1.38468   113.47493    41.17558
   28    27 S   H    _HN3    25     1.01516   118.93557    -0.68386
   29    24 S   S    _SG2    35     1.82831   111.33491   -63.21050
   30    27 S   CT   _CA3    26     1.45452   123.50924   175.23030
   31    30 S   HC   HA31    27     1.09517   109.34937    22.51909
   32    30 S   HC   HA32    28     1.09499   107.10556   139.52359
   33    29 S   CT   _C20    36     1.84329    99.67489   154.39527
   34    33 S   HC   _H3_    37     1.09631   107.51006   -37.97580
   35    30 S   CO3  _C3_    29     1.52904   112.98551  -101.03796
   36    35 S   O2Z  _O31    30     1.26410   115.33575   -46.64564
   37    35 S   O2Z  _O32    31     1.26345   115.02959   134.25962
   38    33 S   CA   _C6_    38     1.52001   110.56728    80.67158
   39    33 S   CT   _C19    61     1.54245   109.48756  -154.33407
   40    39 S   HC   _H42    62     1.09617   110.45057   -53.41434
   41    39 S   HC   _H43    63     1.09741   108.83507  -171.99842
   42    38 S   CA   _C4_    39     1.40637   121.70533    72.35646
   43    42 S   HA   _H25    40     1.08574   118.49048     0.30132
   44    39 S   C    _C13    64     1.52879   113.13787    69.57669
   45    44 S   O    _O20    65     1.23406   120.67462    21.27470
   46    42 S   CA   _C7_    41     1.39751   120.92183  -179.46113
   47    44 S   N    _N18    66     1.41298   116.24819  -160.59286
   48    46 S   CA   _C9_    42     1.40316   118.82871     1.14038
   49    46 S   OS   _O21    56     1.37105   125.07946  -178.98973
   50    47 S   C    _C12    67     1.40875   124.97675   -21.68153
   51    50 S   O    _O19    68     1.22989   126.04190    -7.41802
   52    48 S   CA   _C8_    43     1.40300   121.41064    -2.01402
   53    48 S   OS   _O23    51     1.37720   119.25307  -178.56933
   54    49 S   CT   _C16    57     1.42225   117.25235     0.97297
   55    54 S   HC   _H33    58     1.09428   107.73707   179.21416
   56    54 S   HC   _H34    59     1.09502   111.18160    61.47066
   57    54 S   HC   _H35    60     1.09495   111.10406   -63.09862
   58    50 S   CM   _C10    69     1.49015   116.44073   173.18465
   59    58 S   HC   _H27    70     1.08439   117.16520   175.13828
   60    38 S   CA   _C5_    44     1.40655   119.24854  -106.98614
   61    60 S   HA   _H26    45     1.08645   118.24488    -0.80915
   62    52 S   OS   _O22    46     1.37091   116.11715  -178.10876
   63    53 S   CT   _C18    52     1.42845   110.07902   -91.69021
   64    63 S   HC   _H39    53     1.09407   107.77675  -180.00000
   65    63 S   HC   _H40    54     1.09541   111.33681    61.74823
   66    63 S   HC   _H41    55     1.09541   111.33924   -61.71016
   67    58 S   CM   _C11    71     1.33615   121.63518    -9.10239
   68    67 S   HC   _H28    72     1.08573   119.71112  -176.01051
   69    62 S   CT   _C17    47     1.42222   117.24841  -178.73082
   70    69 S   HC   _H36    48     1.09428   107.73904   179.32420
   71    69 S   HC   _H37    49     1.09503   111.15755    61.59787
   72    69 S   HC   _H38    50     1.09494   111.12310   -62.96480
   73    67 S   CT   _C14    73     1.48979   122.06906     4.19946
   74    73 S   HC   _H29    74     1.09531   109.83536   144.57472
   75    73 S   HC   _H30    75     1.09601   109.00286   -97.67147
   76    47 S   CT   _C15    76     1.46741   116.12709   168.28573
   77    76 S   HC   _H31    77     1.09801   106.65609    95.70024
   78    76 S   HC   _H32    78     1.09559   110.77727   -20.68891
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  14   7   2   1   1  13   9   4   3   9   4   9   3  11  11  12
   6   9   4   9   6   3   2   1   1   7   3   3   1   4   3   2
   1   1   7   4   3   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    60    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    46    52    60    61    39    40    41    44    45    47  
   38    42    60    39    40    41    44  
   36    37  
   37  
    0  
   42    43    46    48    52    60    61    62    49    39    40    41    44  
   40    41    44    45    47    50    76    42    60  
   41    44    45    47  
   44    45    47  
   43    46    48    52    60    61    53    49    54  
   46    48    60    49  
   45    47    50    51    58    73    76    77    78  
   47    50    76  
   48    52    60    62    53    63    49    54    55    56    57  
   50    51    58    59    67    73    74    75    76    77    78  
   52    60    61    62    69    53    63    64    65    66    49    54  
   54    55    56    57    52    53  
   51    58    59    67    68    73    76    77    78  
   58    59    67    76  
   60    61    62    69    70    71    72    53    63  
   63    64    65    66    60    62  
   55    56    57  
   56    57  
   57  
    0  
   59    67    68    73    74    75    76  
   67    68    73  
   61    62    69  
   62  
   69    70    71    72  
   64    65    66  
   65    66  
   66  
    0  
   68    73    74    75    76    77    78  
   73    74    75    76  
   70    71    72  
   71    72  
   72  
    0  
   74    75    76    77    78  
   75    76    77    78  
   76    77    78  
   77    78  
   78  
    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   0.222500   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.7500   0.1050   0.630500   1.9250   1.7000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   46   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.2500   0.1700  -0.315000   1.8100   1.6000   0.054801302  -1.445846770
   48   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   49   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.7500   0.1050   0.630500   1.9250   1.7000   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   52   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   53   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   54   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   63   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.3810   1.2100   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   317.000  1.510
   33    39   268.000  1.529
   38    42   469.000  1.400
   38    60   469.000  1.400
   42    43   367.000  1.080
   42    46   469.000  1.400
   46    48   469.000  1.400
   46    49   450.000  1.364
   48    52   469.000  1.400
   48    53   450.000  1.364
   52    60   469.000  1.400
   52    62   450.000  1.364
   60    61   367.000  1.080
   62    69   320.000  1.410
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   53    63   320.000  1.410
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   49    54   320.000  1.410
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   317.000  1.522
   44    45   570.000  1.229
   44    47   490.000  1.335
   47    50   490.000  1.335
   47    76   337.000  1.449
   50    51   570.000  1.229
   50    58   410.000  1.444
   58    59   340.000  1.080
   58    67   549.000  1.340
   67    68   340.000  1.080
   67    73   317.000  1.510
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   268.000  1.529
   76    77   340.000  1.090
   76    78   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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    42    70.00000  120.00000
   33    38    60    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    44    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    46    63.00000  120.00000
   38    60    52    63.00000  120.00000
   38    60    61    35.00000  120.00000
   42    46    48    63.00000  120.00000
   42    46    49    70.00000  120.00000
   46    42    43    35.00000  120.00000
   46    48    52    63.00000  120.00000
   46    48    53    70.00000  120.00000
   46    49    54    75.00000  111.00000
   48    52    60    63.00000  120.00000
   48    52    62    70.00000  120.00000
   48    53    63    75.00000  111.00000
   52    60    61    35.00000  120.00000
   52    62    69    75.00000  111.00000
   60    38    42    63.00000  120.00000
   62    52    60    70.00000  120.00000
   62    69    70    35.00000  109.50000
   62    69    71    35.00000  109.50000
   62    69    72    35.00000  109.50000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   53    48    52    70.00000  120.00000
   53    63    64    35.00000  109.50000
   53    63    65    35.00000  109.50000
   53    63    66    35.00000  109.50000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   49    46    48    70.00000  120.00000
   49    54    55    35.00000  109.50000
   49    54    56    35.00000  109.50000
   49    54    57    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
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    44    45    80.00000  120.40000
   39    44    47    70.00000  116.60000
   41    39    40    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    41    35.00000  109.50000
   44    47    50    70.00000  121.37400
   44    47    76    50.00000  121.90000
   47    44    45    80.00000  122.90000
   47    50    51    80.00000  122.90000
   47    50    58    80.00000  111.56200
   47    76    73    70.00000  110.72300
   47    76    77    35.00000  109.50000
   47    76    78    35.00000  109.50000
   50    58    59    35.00000  119.70000
   50    58    67    70.00000  118.70000
   58    50    51    80.00000  125.30000
   58    67    68    35.00000  120.00000
   58    67    73    70.00000  124.00000
   67    58    59    35.00000  120.00000
   67    73    74    35.00000  109.50000
   67    73    75    35.00000  109.50000
   67    73    76    70.00000  112.02700
   73    67    68    35.00000  117.00000
   73    76    77    37.50000  110.70000
   73    76    78    37.50000  110.70000
   75    73    74    33.00000  107.80000
   76    47    50    50.00000  121.90000
   76    73    74    37.50000  110.70000
   76    73    75    37.50000  110.70000
   78    76    77    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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  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    38    42  -0.16000  1.0 1.0
   29    33    38    42  -0.03200 -1.0 2.0
   29    33    38    42   0.04500  1.0 3.0
   29    33    38    60  -0.16000  1.0 1.0
   29    33    38    60  -0.03200 -1.0 2.0
   29    33    38    60   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    42    43   3.62500 -1.0 2.0
   33    38    42    46   3.62500 -1.0 2.0
   33    38    60    52   3.62500 -1.0 2.0
   33    38    60    61   3.62500 -1.0 2.0
   33    39    44    45   0.30150 -1.0 2.0
   33    39    44    47   1.39750  1.0 1.0
   33    39    44    47  -0.07950 -1.0 2.0
   33    39    44    47  -0.18750  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    60   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    44  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    41   0.43200  1.0 3.0
   38    33    39    44   0.56750  1.0 1.0
   38    33    39    44  -0.07550 -1.0 2.0
   38    33    39    44   0.20000  1.0 3.0
   38    42    46    48   3.62500 -1.0 2.0
   38    42    46    49   3.62500 -1.0 2.0
   42    38    60    52   3.62500 -1.0 2.0
   42    38    60    61   3.62500 -1.0 2.0
   42    46   -48    52   3.62500 -1.0 2.0
   42    46    48    53   3.62500 -1.0 2.0
   42    46    49    54   1.63200 -1.0 2.0
   43    42    46    48   3.62500 -1.0 2.0
   43    42    46    49   3.62500 -1.0 2.0
   46    48    52    60   3.62500 -1.0 2.0
   46    48    52    62   3.62500 -1.0 2.0
   46    48    53    63   1.63200 -1.0 2.0
   46    49    54    55   0.08050  1.0 3.0
   46    49    54    56   0.08050  1.0 3.0
   46    49    54    57   0.08050  1.0 3.0
   48    46    49    54   1.63200 -1.0 2.0
   48    52   -60    38   3.62500 -1.0 2.0
   48    52    60    61   3.62500 -1.0 2.0
   48    52    62    69   1.63200 -1.0 2.0
   48    53    63    64   0.08050  1.0 3.0
   48    53    63    65   0.08050  1.0 3.0
   48    53    63    66   0.08050  1.0 3.0
   52    48    53    63   1.63200 -1.0 2.0
   52    62    69    70   0.08050  1.0 3.0
   52    62    69    71   0.08050  1.0 3.0
   52    62    69    72   0.08050  1.0 3.0
   60    38    42    43   3.62500 -1.0 2.0
   60    38   -42    46   3.62500 -1.0 2.0
   60    52    62    69   1.63200 -1.0 2.0
   62    52    60    38   3.62500 -1.0 2.0
   62    52    60    61   3.62500 -1.0 2.0
   53    48    52    60   3.62500 -1.0 2.0
   53    48    52    62   3.62500 -1.0 2.0
   49    46    48    52   3.62500 -1.0 2.0
   49    46    48    53   3.62500 -1.0 2.0
   39    33    38    42   0.04150 -1.0 2.0
   39    33    38    60   0.04150 -1.0 2.0
   39    44    47    50   2.45000 -1.0 2.0
   39    44    47    76   1.49850  1.0 1.0
   39    44    47    76   1.53950 -1.0 2.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    47   0.00000  1.0 1.0
   41    39    44    45   0.00000  1.0 1.0
   41    39    44    47   0.00000  1.0 1.0
   44    47    50    51   2.22250 -1.0 2.0
   44    47    50    58   2.45000 -1.0 2.0
   44    47    76    73  -0.43950  1.0 1.0
   44    47    76    73  -0.08100 -1.0 2.0
   44    47    76    73   0.03350  1.0 3.0
   44    47    76    77   0.00000  1.0 1.0
   44    47    76    78   0.00000  1.0 1.0
   45    44    47    50   2.22250 -1.0 2.0
   45    44    47    76   3.04450 -1.0 2.0
   47    50    58    59   0.65100 -1.0 2.0
   47    50    58    67   0.49500  1.0 1.0
   47    50    58    67   1.31600 -1.0 2.0
   47    50    58    67  -0.02300  1.0 3.0
   50    47    76    73  -0.43950  1.0 1.0
   50    47    76    73  -0.08100 -1.0 2.0
   50    47    76    73   0.03350  1.0 3.0
   50    47    76    77   0.00000  1.0 1.0
   50    47    76    78   0.00000  1.0 1.0
   50    58    67    68   7.00000 -1.0 2.0
   50    58   -67    73   7.00000 -1.0 2.0
   51    50    58    59   0.00000  1.0 1.0
   51    50    58    67   1.00000 -1.0 2.0
   58    67    73    74   0.00000  1.0 1.0
   58    67    73    75   0.00000  1.0 1.0
   58    67    73    76   0.09850  1.0 1.0
   58    67    73    76   0.15250 -1.0 2.0
   58    67    73    76  -0.50650  1.0 3.0
   59    58    67    68   7.00000 -1.0 2.0
   59    58    67    73   7.00000 -1.0 2.0
   67    73   -76    47   0.21700  1.0 1.0
   67    73   -76    47   0.68550 -1.0 2.0
   67    73   -76    47  -0.27950  1.0 3.0
   67    73    76    77   0.15000  1.0 3.0
   67    73    76    78   0.15000  1.0 3.0
   68    67    73    74   0.33100  1.0 3.0
   68    67    73    75   0.33100  1.0 3.0
   68    67    73    76   0.00000  1.0 1.0
   74    73    76    47   0.15000  1.0 3.0
   74    73    76    77   0.15000  1.0 3.0
   74    73    76    78   0.15000  1.0 3.0
   75    73    76    47   0.15000  1.0 3.0
   75    73    76    77   0.15000  1.0 3.0
   75    73    76    78   0.15000  1.0 3.0
   76    47    50    51   3.04450 -1.0 2.0
   76    47   -50    58   1.49850  1.0 1.0
   76    47   -50    58   1.53950 -1.0 2.0
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
   42    60    38    33   4.00000 -1.0 2.0
   46    43    42    38   1.10000 -1.0 2.0
   48    49    46    42   4.00000 -1.0 2.0
   52    53    48    46   4.00000 -1.0 2.0
   60    62    52    48   4.00000 -1.0 2.0
   52    61    60    38   1.10000 -1.0 2.0
   39    47    44    45  10.50000 -1.0 2.0
   76    44    47    50   1.00000 -1.0 2.0
   47    58    50    51  10.50000 -1.0 2.0
   50    59    58    67   1.10000 -1.0 2.0
   73    68    67    58   1.10000 -1.0 2.0
END
