* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    126    203     370
    1     0 S   NP   _N1_     1    28.05370    96.15495   -22.27348
    2     1 S   H    _HN1     2     1.02959    77.96772     2.74281
    3     1 S   H    _H1_     3     1.02836    35.16420   148.15187
    4     1 S   H    _H2_     4     1.02778    99.46856  -104.14130
    5     1 S   CT   _CA1     5     1.50124   141.37109   110.43660
    6     5 S   HC   _HA1     6     1.09575   105.22537    81.29304
    7     5 S   CO3  _C1_     7     1.53786   112.36461   -38.91714
    8     7 S   O2Z  _O11     8     1.26364   114.99853   -44.21416
    9     7 S   O2Z  _O12     9     1.26237   114.93411   134.91591
   10     5 S   CT   _CB1    10     1.53095   107.42367  -160.79561
   11    10 S   HC   HB11    11     1.09826   109.34187   -50.63187
   12    10 S   HC   HB12    12     1.09816   110.42634    65.92677
   13    10 S   CT   _CG1    13     1.53010   112.65640  -171.70864
   14    13 S   HC   HG11    14     1.09596   110.48082   -64.07282
   15    13 S   HC   HG12    15     1.09655   109.93406    55.12637
   16    13 S   C    _CD1    16     1.51830   112.32378   175.49854
   17    16 S   O    _OE1    17     1.22744   123.28837    -0.37220
   18    16 S   N    _N2_    18     1.38548   111.68087   179.59846
   19    18 S   H    _HN2    19     1.01559   119.03633     4.72476
   20    18 S   CT1  _CA2    20     1.45839   122.91218   177.92057
   21    20 S   HC   _HA2    21     1.09708   109.04033    22.33815
   22    20 S   C    _C2_    22     1.52813   106.60421   -95.03376
   23    22 S   O    _O2_    23     1.23010   122.81656   -32.47709
   24    20 S   CT   _CB2    32     1.53233   112.23594   145.58576
   25    24 S   HC   HB21    33     1.09533   109.77949    53.90704
   26    24 S   HC   HB22    34     1.09142   109.75626   172.04155
   27    22 S   N    _N3_    24     1.38445   112.76458   150.29851
   28    27 S   H    _HN3    25     1.01681   120.37039    -1.98771
   29    24 S   S    _SG2    35     1.83021   110.60768   -66.07394
   30    27 S   CT   _CA3    26     1.45343   122.34295   178.38917
   31    30 S   HC   HA31    27     1.09577   107.36852   -62.47389
   32    30 S   HC   HA32    28     1.09561   108.01328    53.76879
   33    29 S   CT   _C11    36     1.93240   102.18201  -162.72686
   34    30 S   CO3  _C3_    29     1.52850   114.39325   175.47814
   35    34 S   O2Z  _O31    30     1.26307   116.05065   -14.12689
   36    34 S   O2Z  _O32    31     1.26439   114.44399   166.12873
   37    33 S   CA   _C15    37     1.56391   106.55138   -48.20673
   38    33 S   CT   _C12    48     1.57712   102.23393  -163.25193
   39    38 S   HC   _H8_    49     1.09775   111.54404    60.73656
   40    38 S   HC   _H9_    50     1.09534   110.74139   -54.72282
   41    33 S   CT   _C10    58     1.62364   106.54264    75.13657
   42    41 S   OM   _O33    59     1.32661   110.74291   167.79867
   43    41 S   HC   _H3_    60     1.09409   102.15397   -68.28719
   44    37 S   CA   _C16    38     1.41569   120.56809   -58.57947
   45    44 S   HA   _H12    39     1.08736   120.89095     0.50280
   46    38 S   NA   _N4_    51     1.45098   118.32831  -178.24699
   47    41 S   CA   _C8_    61     1.55196   117.40075    45.05932
   48    44 S   CA   _C17    40     1.39715   121.82400   179.71607
   49    48 S   HA   _H13    41     1.08536   120.29302  -179.92867
   50    46 S   CRA  _C13    52     1.36279   128.72309   -68.20099
   51    50 S   HA   _H10    53     1.07937   124.28751     5.31150
   52    47 S   CA   _C9_    62     1.41231   121.13876    64.46185
   53    52 S   HA   _H7_    63     1.08462   120.71944     2.96927
   54    48 S   CA   _C18    42     1.38570   119.43657    -0.14935
   55    54 S   F    F1__    43     1.33992   119.67548  -179.98022
   56    50 S   N5B  _N5_    54     1.31382   109.90962  -174.35812
   57    52 S   CA   _C4_    64     1.39802   122.17801  -178.75636
   58    57 S   HA   _H4_    65     1.08623   119.80286   179.77794
   59    54 S   CA   _C19    44     1.38657   120.64266    -0.18452
   60    59 S   HA   _H14    45     1.08568   120.14960  -179.76845
   61    56 S   CRB  _C14    55     1.36327   102.49659     1.61882
   62    61 S   HA   _H11    56     1.07992   123.19921   179.96044
   63    57 S   CA   _C5_    66     1.38728   120.07953    -0.75899
   64    63 S   HA   _H5_    67     1.08570   120.26445  -179.91153
   65    37 S   CA   _C20    46     1.40830   122.67617   120.58543
   66    65 S   HA   _H15    47     1.08537   121.76686     0.12820
   67    46 S   N5A  _N6_    57     1.34919   120.18117   121.58024
   68    63 S   CA   _C6_    68     1.39041   119.51417    -0.94915
   69    68 S   HA   _H6_    69     1.08772   118.83452  -178.66646
   70    47 S   CA   _C7_    70     1.41618   122.48450  -116.86216
   71    70 S   Cl   Cl1_    71     1.73274   123.19275    -2.66183
  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  12   5   4   3
  19   2   1   1  17  14   5   4  12   4   3   8   4   6   9   6
   3   5   3   8   4   5   3   3   6   3   3   2   2   1   5   3
   1   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    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    44    65    38    39    40    46    41    42    43    47  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    44    45    48    59    65    66    38    39    40    46    50    67    41    42    43    47    52    70  
   35    36  
   36  
    0  
   44    45    48    49    54    59    60    65    66    38    39    40    46    41    42    43    47  
   39    40    46    50    51    56    61    67    41    42    43    47    44    65  
   40    46    50    67    41  
   46    50    67    41  
   42    43    47    52    53    57    68    70    71    44    46    65  
   43    47    52    70  
   47    52    70  
   45    48    49    54    55    59    65    66  
   48    49    54    65  
   50    51    56    61    62    67  
   52    53    57    58    63    68    69    70    71  
   49    54    55    59    60    65  
   54    55    59  
   51    56    61    62    67  
   56    61    67  
   53    57    58    63    64    68    70    71  
   57    58    63    70  
   55    59    60    65    66  
   59    60    65  
   61    62    67  
   58    63    64    68    69    70  
   63    64    68  
   60    65    66  
   65    66  
   62    67  
   67  
   64    68    69    70    71  
   68    69    70  
   66  
    0  
    0  
   69    70    71  
   70    71  
   71  
    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   0.282500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5000   0.0660   0.002500   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   0.035000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   43   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   45   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   46   3.2500   0.1700   0.065600   1.8000   1.6000   0.001000000  -0.511443539
   47   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5500   0.0700   0.277800   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.114600   1.3810   1.2100   0.030040813   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0700   0.220000   2.5000   1.7750   0.001000000  -0.843144165
   55   2.8500   0.0610  -0.220000   2.4980   2.2250   0.001000000   0.985400000
   56   3.2800   0.1700  -0.632900   1.8000   1.6000   0.001000000  -0.511443539
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700   0.528100   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.052500   1.3810   1.2100   0.030040813   0.268726247
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.2800   0.1700  -0.528200   1.8000   1.6000   0.001000000  -0.511443539
   68   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   70   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   71   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
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    38   268.000  1.529
   33    41   268.000  1.529
   37    44   469.000  1.400
   37    65   469.000  1.400
   44    45   367.000  1.080
   44    48   469.000  1.400
   48    49   367.000  1.080
   48    54   469.000  1.400
   54    55   420.000  1.354
   54    59   469.000  1.400
   59    60   367.000  1.080
   59    65   469.000  1.400
   65    66   367.000  1.080
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    46   320.000  1.443
   46    50   477.000  1.343
   46    67   400.000  1.349
   50    51   367.000  1.080
   50    56   488.000  1.335
   56    61   470.000  1.361
   61    62   395.000  1.080
   61    67   550.000  1.323
   41    42   570.000  1.307
   41    43   340.000  1.090
   41    47   317.000  1.510
   47    52   469.000  1.400
   47    70   469.000  1.400
   52    53   367.000  1.080
   52    57   469.000  1.400
   57    58   367.000  1.080
   57    63   469.000  1.400
   63    64   367.000  1.080
   63    68   469.000  1.400
   68    69   367.000  1.080
   68    70   469.000  1.400
   70    71   300.000  1.725
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    80.00000  109.48900
   29    33    38    75.00000  111.63000
   29    33    41    75.00000  111.63000
   33    37    44    70.00000  120.00000
   33    37    65    70.00000  120.00000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    46    75.00000  111.19500
   33    41    42    50.00000  109.50000
   33    41    43    37.50000  110.70000
   33    41    47    70.00000  112.17500
   37    44    45    35.00000  120.00000
   37    44    48    63.00000  120.00000
   37    65    59    63.00000  120.00000
   37    65    66    35.00000  120.00000
   44    48    49    35.00000  120.00000
   44    48    54    63.00000  120.00000
   48    44    45    35.00000  120.00000
   48    54    55    80.00000  120.00000
   48    54    59    63.00000  120.00000
   54    48    49    35.00000  120.00000
   54    59    60    35.00000  120.00000
   54    59    65    63.00000  120.00000
   59    54    55    80.00000  120.00000
   59    65    66    35.00000  120.00000
   65    37    44    63.00000  120.00000
   65    59    60    35.00000  120.00000
   38    33    37    70.00000  112.17500
   38    46    50    60.00000  127.66100
   38    46    67    75.00000  118.68000
   40    38    39    33.00000  107.80000
   46    38    39    50.00000  108.61900
   46    38    40    50.00000  108.61900
   46    50    51    35.00000  120.00000
   46    50    56    70.00000  120.00000
   46    67    61   115.00000  101.71600
   50    56    61   105.00000  102.26600
   56    50    51    35.00000  120.00000
   56    61    62    40.00000  123.47600
   56    61    67    85.00000  115.28900
   67    46    50    95.00000  110.06400
   67    61    62    45.00000  122.26300
   41    33    37    70.00000  112.17500
   41    33    38    58.35000  112.70000
   41    47    52    70.00000  120.00000
   41    47    70    70.00000  120.00000
   43    41    42    45.00000  125.66300
   47    41    42    85.00000  111.85700
   47    41    43    35.00000  109.50000
   47    52    53    35.00000  120.00000
   47    52    57    63.00000  120.00000
   47    70    68    63.00000  120.00000
   47    70    71    75.00000  120.00000
   52    57    58    35.00000  120.00000
   52    57    63    63.00000  120.00000
   57    52    53    35.00000  120.00000
   57    63    64    35.00000  120.00000
   57    63    68    63.00000  120.00000
   63    57    58    35.00000  120.00000
   63    68    69    35.00000  120.00000
   63    68    70    63.00000  120.00000
   68    63    64    35.00000  120.00000
   68    70    71    75.00000  120.00000
   70    47    52    63.00000  120.00000
   70    68    69    35.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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  -0.23050  1.0 1.0
   24    29    33    37   0.06200 -1.0 2.0
   24    29    33    37   0.47200  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    37    44  -0.16000  1.0 1.0
   29    33    37    44  -0.03200 -1.0 2.0
   29    33    37    44   0.04500  1.0 3.0
   29    33    37    65  -0.16000  1.0 1.0
   29    33    37    65  -0.03200 -1.0 2.0
   29    33    37    65   0.04500  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    46   0.56750  1.0 1.0
   29    33    38    46  -0.07550 -1.0 2.0
   29    33    38    46   0.20000  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    43   0.15000  1.0 3.0
   29    33    41    47   0.56750  1.0 1.0
   29    33    41    47  -0.07550 -1.0 2.0
   29    33    41    47   0.20000  1.0 3.0
   33    37    44    45   3.62500 -1.0 2.0
   33    37    44    48   3.62500 -1.0 2.0
   33    37    65    59   3.62500 -1.0 2.0
   33    37    65    66   3.62500 -1.0 2.0
   33    38    46    50   1.10250  1.0 1.0
   33    38    46    50   0.01650 -1.0 2.0
   33    38    46    50   0.39100  1.0 3.0
   33    38    46    67   0.68100  1.0 1.0
   33    38    46    67   0.03350 -1.0 2.0
   33    38    46    67   0.36200  1.0 3.0
   33    41    47    52   0.04150 -1.0 2.0
   33    41    47    70   0.04150 -1.0 2.0
   37    33    38    39   0.43200  1.0 3.0
   37    33    38    40   0.43200  1.0 3.0
   37    33    38    46   0.56750  1.0 1.0
   37    33    38    46  -0.07550 -1.0 2.0
   37    33    38    46   0.20000  1.0 3.0
   37    33    41    42  -0.64350  1.0 1.0
   37    33    41    42  -0.04200 -1.0 2.0
   37    33    41    42   0.19800  1.0 3.0
   37    33    41    43   0.43200  1.0 3.0
   37    33    41    47  -0.94300  1.0 1.0
   37    33    41    47   1.32550 -1.0 2.0
   37    33    41    47  -0.07100  1.0 3.0
   37    44    48    49   3.62500 -1.0 2.0
   37    44    48    54   3.62500 -1.0 2.0
   44    37    65    59   3.62500 -1.0 2.0
   44    37    65    66   3.62500 -1.0 2.0
   44    48    54    55   3.62500 -1.0 2.0
   44    48   -54    59   3.62500 -1.0 2.0
   45    44    48    49   3.62500 -1.0 2.0
   45    44    48    54   3.62500 -1.0 2.0
   48    54    59    60   3.62500 -1.0 2.0
   48    54    59    65   3.62500 -1.0 2.0
   49    48    54    55   3.62500 -1.0 2.0
   49    48    54    59   3.62500 -1.0 2.0
   54    59   -65    37   3.62500 -1.0 2.0
   54    59    65    66   3.62500 -1.0 2.0
   55    54    59    60   3.62500 -1.0 2.0
   55    54    59    65   3.62500 -1.0 2.0
   60    59    65    37   3.62500 -1.0 2.0
   60    59    65    66   3.62500 -1.0 2.0
   65    37    44    45   3.62500 -1.0 2.0
   65    37   -44    48   3.62500 -1.0 2.0
   38    33    37    44   0.04150 -1.0 2.0
   38    33    37    65   0.04150 -1.0 2.0
   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    43   0.15000  1.0 3.0
   38    33    41    47  -0.03700  1.0 1.0
   38    33    41    47   0.37200 -1.0 2.0
   38    33    41    47  -0.47300  1.0 3.0
   38    46    50    51   3.62500 -1.0 2.0
   38    46    50    56   3.62500 -1.0 2.0
   38    46    67    61   3.62500 -1.0 2.0
   39    38    46    50   0.00000  1.0 1.0
   39    38    46    67   0.00000  1.0 1.0
   40    38    46    50   0.00000  1.0 1.0
   40    38    46    67   0.00000  1.0 1.0
   46    50   -56    61   3.62500 -1.0 2.0
   50    46   -67    61   3.62500 -1.0 2.0
   50    56    61    62   3.62500 -1.0 2.0
   50    56   -61    67   3.62500 -1.0 2.0
   51    50    56    61   3.62500 -1.0 2.0
   56    61   -67    46   3.62500 -1.0 2.0
   62    61    67    46   3.62500 -1.0 2.0
   67    46    50    51   3.62500 -1.0 2.0
   67    46   -50    56   3.62500 -1.0 2.0
   41    33    37    44   0.04150 -1.0 2.0
   41    33    37    65   0.04150 -1.0 2.0
   41    33    38    39   0.15000  1.0 3.0
   41    33    38    40   0.15000  1.0 3.0
   41    33    38    46  -0.64600  1.0 1.0
   41    33    38    46   0.58400 -1.0 2.0
   41    47    52    53   3.62500 -1.0 2.0
   41    47    52    57   3.62500 -1.0 2.0
   41    47    70    68   3.62500 -1.0 2.0
   41    47    70    71   3.62500 -1.0 2.0
   42    41    47    52   0.64500  1.0 1.0
   42    41    47    52   0.14800 -1.0 2.0
   42    41    47    52   0.20650  1.0 3.0
   42    41    47    70   0.64500  1.0 1.0
   42    41    47    70   0.14800 -1.0 2.0
   42    41    47    70   0.20650  1.0 3.0
   43    41    47    52   0.00000  1.0 1.0
   43    41    47    70   0.00000  1.0 1.0
   47    52    57    58   3.62500 -1.0 2.0
   47    52    57    63   3.62500 -1.0 2.0
   52    47    70    68   3.62500 -1.0 2.0
   52    47    70    71   3.62500 -1.0 2.0
   52    57    63    64   3.62500 -1.0 2.0
   52    57   -63    68   3.62500 -1.0 2.0
   53    52    57    58   3.62500 -1.0 2.0
   53    52    57    63   3.62500 -1.0 2.0
   57    63    68    69   3.62500 -1.0 2.0
   57    63    68    70   3.62500 -1.0 2.0
   58    57    63    64   3.62500 -1.0 2.0
   58    57    63    68   3.62500 -1.0 2.0
   63    68   -70    47   3.62500 -1.0 2.0
   63    68    70    71   3.62500 -1.0 2.0
   64    63    68    69   3.62500 -1.0 2.0
   64    63    68    70   3.62500 -1.0 2.0
   69    68    70    47   3.62500 -1.0 2.0
   69    68    70    71   3.62500 -1.0 2.0
   70    47    52    53   3.62500 -1.0 2.0
   70    47   -52    57   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   44    65    37    33   4.00000 -1.0 2.0
   48    45    44    37   1.10000 -1.0 2.0
   54    49    48    44   1.10000 -1.0 2.0
   59    55    54    48   4.00000 -1.0 2.0
   65    60    59    54   1.10000 -1.0 2.0
   59    66    65    37   1.10000 -1.0 2.0
   50    67    46    38   4.00000 -1.0 2.0
   56    51    50    46   1.10000 -1.0 2.0
   67    62    61    56   1.10000 -1.0 2.0
   52    70    47    41   4.00000 -1.0 2.0
   57    53    52    47   1.10000 -1.0 2.0
   63    58    57    52   1.10000 -1.0 2.0
   68    64    63    57   1.10000 -1.0 2.0
   70    69    68    63   1.10000 -1.0 2.0
   68    71    70    47   4.00000 -1.0 2.0
END
