* LIGAND DATABASE FILE (OPLS2005)
*
001      76    77    136    212     406
    1     0 S   NP   _N1_     1    28.67828    94.97423   -23.57692
    2     1 S   H    _HN1     2     1.02786   105.49727   -93.79769
    3     1 S   H    _H1_     3     1.02949    81.40065    12.98993
    4     1 S   H    _H2_     4     1.02828    28.52616   167.14267
    5     1 S   CT   _CA1     5     1.50112   133.35434   122.99473
    6     5 S   HC   _HA1     6     1.09573   105.18785    80.06469
    7     5 S   CO3  _C1_     7     1.53786   112.48470   -40.15962
    8     7 S   O2Z  _O11     8     1.26372   115.00508   -42.02993
    9     7 S   O2Z  _O12     9     1.26241   114.94831   137.10044
   10     5 S   CT   _CB1    10     1.53079   107.42056  -161.94939
   11    10 S   HC   HB11    11     1.09833   109.36157   -49.65362
   12    10 S   HC   HB12    12     1.09812   110.45149    66.95616
   13    10 S   CT   _CG1    13     1.52990   112.60867  -170.62820
   14    13 S   HC   HG11    14     1.09580   110.63895   -66.01191
   15    13 S   HC   HG12    15     1.09671   109.77270    53.21783
   16    13 S   C    _CD1    16     1.51801   112.22155   173.67033
   17    16 S   O    _OE1    17     1.22731   123.28818     7.53236
   18    16 S   N    _N2_    18     1.38656   111.67528  -172.53854
   19    18 S   H    _HN2    19     1.01579   118.92485     1.67199
   20    18 S   CT1  _CA2    20     1.46201   123.40242   177.30797
   21    20 S   HC   _HA2    21     1.09737   109.36208     3.57440
   22    20 S   C    _C2_    22     1.53575   108.63615  -111.90741
   23    22 S   O    _O2_    23     1.23062   122.26644  -147.99663
   24    20 S   CT   _CB2    32     1.53361   111.57692   125.60907
   25    24 S   HC   HB21    33     1.09579   110.01328    56.07466
   26    24 S   HC   HB22    34     1.09414   109.96397   175.12806
   27    22 S   N    _N3_    24     1.38321   113.73753    39.45536
   28    27 S   H    _HN3    25     1.01578   119.60210    -3.27393
   29    24 S   S    _SG2    35     1.82781   111.44911   -64.93454
   30    27 S   CT   _CA3    26     1.45289   123.23312   177.14988
   31    30 S   HC   HA31    27     1.09548   107.50619   -64.72841
   32    30 S   HC   HA32    28     1.09556   107.99363    51.71736
   33    29 S   CT   _C18    36     1.84176    99.91388   170.47143
   34    33 S   HC   _H3_    37     1.09726   106.39321   -45.45236
   35    30 S   CO3  _C3_    29     1.52966   114.06503   173.71469
   36    35 S   O2Z  _O31    30     1.26378   116.06568    -0.74283
   37    35 S   O2Z  _O32    31     1.26427   114.41402   179.31872
   38    33 S   CA   _C9_    38     1.52222   109.94346  -162.07956
   39    33 S   CT   _C16    49     1.53608   111.13159    72.48902
   40    39 S   HC   _H34    50     1.09688   112.38654    62.22483
   41    39 S   HC   _H35    51     1.09574   112.00101   -57.22090
   42    38 S   CA   _C7_    39     1.40432   119.58916   114.10116
   43    42 S   HA   _H27    40     1.08746   120.47983    -0.99956
   44    39 S   CO4  _C10    52     1.51062   110.11690  -175.43331
   45    44 S   O    _O16    53     1.22398   123.73862    72.58548
   46    42 S   CA   _C5_    41     1.39613   120.74783   178.34212
   47    46 S   HA   _H25    42     1.08622   119.90043  -179.66196
   48    44 S   OS1  _O22    54     1.36186   109.91519  -104.63032
   49    46 S   CA   _C4_    43     1.39262   120.09536     0.12195
   50    49 S   HA   _H24    44     1.08603   120.05222  -179.92598
   51    48 S   CO1  _C15    55     1.44176   116.13592   169.62419
   52    51 S   HC   _H33    56     1.09838   108.77258    48.98201
   53    49 S   CA   _C6_    45     1.39276   119.88960     0.11364
   54    53 S   HA   _H26    46     1.08627   119.98232   179.95154
   55    51 S   CT   _C13    57     1.53196   107.26926   168.47607
   56    55 S   HC   _H31    58     1.09691   109.96742    51.44534
   57    38 S   CA   _C8_    47     1.40474   121.95448   -67.28890
   58    57 S   HA   _H28    48     1.08718   120.58614     1.36272
   59    55 S   CT   _C11    59     1.53066   111.18247   173.34401
   60    59 S   HC   _H29    60     1.09664   110.29037    73.51396
   61    55 S   OH5  _O20    75     1.42911   109.85620   -65.18520
   62    61 S   HO   _H41    76     0.97239   108.25220   -63.46023
   63    59 S   CT   _C12    61     1.53191   111.28541   -49.16072
   64    63 S   HC   _H30    62     1.09709   109.03917   -71.19855
   65    59 S   OH5  _O18    73     1.42931   109.59570  -170.58577
   66    65 S   HO   _H39    74     0.97242   108.16063    61.18543
   67    63 S   CT   _C14    63     1.53244   110.69920    50.03143
   68    67 S   HC   _H32    64     1.09823   110.99647    64.36470
   69    63 S   OH5  _O19    71     1.42589   109.69397   171.96579
   70    69 S   HO   _H40    72     0.97256   108.21542   -58.08099
   71    51 S   OS1  _O17    65     1.42804   109.74869   -71.98271
   72    67 S   CT   _C17    66     1.53006   111.44915  -174.71732
   73    72 S   HC   _H36    67     1.09507   110.98464    69.08885
   74    72 S   HC   _H37    68     1.09396   111.54688   -53.27328
   75    72 S   OH5  _O21    69     1.42488   109.09913  -172.26208
   76    75 S   HO   _H42    70     0.97234   107.02990  -178.15030
  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   8   4   3   8   4   6   2   6   3   8
   5   3  13   6   3   2  12   7   1   1  13   7   4   1  12   7
   3   1   9   6   3   1   4   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    57    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    46    53    57    58    39    40    41    44    45    48  
   38    42    57    39    40    41    44  
   36    37  
   37  
    0  
   42    43    46    47    49    53    54    57    58    39    40    41    44  
   40    41    44    45    48    51    42    57  
   41    44    45    48  
   44    45    48  
   43    46    47    49    50    53    57    58  
   46    47    49    57  
   45    48    51    52    55    71  
   48    51  
   47    49    50    53    54    57  
   49    50    53  
   51    52    55    56    59    67    71    61  
   50    53    54    57    58  
   53    54    57  
   52    55    56    59    60    63    67    68    71    72    65    61    62  
   55    56    59    67    71    61  
   54    57    58  
   57    58  
   56    59    60    63    64    67    71    69    65    66    61    62  
   59    60    63    71    65    61    62  
   58  
    0  
   60    63    64    67    68    71    72    69    70    65    66    61    62  
   63    64    67    69    65    66    61  
   62    63    65    71  
    0  
   64    67    68    71    72    73    74    75    69    70    65    66  
   67    68    71    72    69    70    65  
   66    67    69  
    0  
   68    71    72    73    74    75    76    69    70  
   71    72    73    74    75    69  
   70    71    72  
    0  
   72    73    74    75  
   73    74    75    76  
   74    75    76  
   75    76  
   76  
    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   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.3810   1.2100   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   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   47   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   48   2.9000   0.1400  -0.280000   1.7660   1.5600   0.020110767  -0.896042159
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.100000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   67   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   69   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   71   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   72   3.5000   0.0660   0.145000   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
   75   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   76   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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    57   469.000  1.400
   42    43   367.000  1.080
   42    46   469.000  1.400
   46    47   367.000  1.080
   46    49   469.000  1.400
   49    50   367.000  1.080
   49    53   469.000  1.400
   53    54   367.000  1.080
   53    57   469.000  1.400
   57    58   367.000  1.080
   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    48   214.000  1.327
   48    51   370.000  1.399
   51    52   360.000  1.097
   51    55   255.000  1.525
   51    71   370.000  1.399
   55    56   340.000  1.090
   55    59   268.000  1.529
   55    61   355.000  1.421
   59    60   340.000  1.090
   59    63   268.000  1.529
   59    65   355.000  1.421
   63    64   340.000  1.090
   63    67   268.000  1.529
   63    69   355.000  1.421
   67    68   340.000  1.090
   67    71   335.000  1.422
   67    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    75   355.000  1.421
   75    76   580.000  0.967
   69    70   580.000  0.967
   65    66   580.000  0.967
   61    62   580.000  0.967
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    57    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    57    53    63.00000  120.00000
   38    57    58    35.00000  120.00000
   42    46    47    35.00000  120.00000
   42    46    49    63.00000  120.00000
   46    42    43    35.00000  120.00000
   46    49    50    35.00000  120.00000
   46    49    53    63.00000  120.00000
   49    46    47    35.00000  120.00000
   49    53    54    35.00000  120.00000
   49    53    57    63.00000  120.00000
   53    49    50    35.00000  120.00000
   53    57    58    35.00000  120.00000
   57    38    42    63.00000  120.00000
   57    53    54    35.00000  120.00000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    44    45    80.00000  120.40000
   39    44    48    81.00000  111.40000
   41    39    40    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    41    35.00000  109.50000
   44    48    51    83.00000  116.90000
   48    44    45    83.00000  123.40000
   48    51    52    60.00000  105.75400
   48    51    55    90.00000  109.70700
   48    51    71   110.00000  113.16000
   51    55    56    45.00000  109.54000
   51    55    59    70.00000  111.10000
   51    55    61    90.00000  109.42000
   51    71    67    90.00000  112.10700
   55    51    52    45.00000  111.65000
   55    59    60    37.50000  110.70000
   55    59    63    58.35000  112.70000
   55    59    65    90.00000  111.45300
   55    61    62    65.00000  108.53500
   59    55    56    37.50000  110.70000
   59    63    64    37.50000  110.70000
   59    63    67    58.35000  112.70000
   59    63    69    90.00000  111.45300
   59    65    66    65.00000  108.53500
   63    59    60    37.50000  110.70000
   63    67    68    37.50000  110.70000
   63    67    71    95.00000  107.88500
   63    67    72    58.35000  112.70000
   63    69    70    65.00000  108.53500
   67    63    64    37.50000  110.70000
   67    72    73    37.50000  110.70000
   67    72    74    37.50000  110.70000
   67    72    75    90.00000  111.45300
   71    51    52    60.00000  105.75400
   71    51    55    90.00000  109.70700
   71    67    68    55.00000  108.98800
   72    67    68    37.50000  110.70000
   72    67    71    95.00000  107.88500
   72    75    76    65.00000  108.53500
   74    72    73    33.00000  107.80000
   75    72    73    60.00000  109.39000
   75    72    74    60.00000  109.39000
   69    63    64    60.00000  109.39000
   69    63    67    90.00000  111.45300
   65    59    60    60.00000  109.39000
   65    59    63    90.00000  111.45300
   61    55    56    60.00000  109.39000
   61    55    59    90.00000  111.45300
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    57  -0.16000  1.0 1.0
   29    33    38    57  -0.03200 -1.0 2.0
   29    33    38    57   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    57    53   3.62500 -1.0 2.0
   33    38    57    58   3.62500 -1.0 2.0
   33    39    44    45   0.30150 -1.0 2.0
   33    39    44    48   0.36750  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    57   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    47   3.62500 -1.0 2.0
   38    42    46    49   3.62500 -1.0 2.0
   42    38    57    53   3.62500 -1.0 2.0
   42    38    57    58   3.62500 -1.0 2.0
   42    46    49    50   3.62500 -1.0 2.0
   42    46   -49    53   3.62500 -1.0 2.0
   43    42    46    47   3.62500 -1.0 2.0
   43    42    46    49   3.62500 -1.0 2.0
   46    49    53    54   3.62500 -1.0 2.0
   46    49    53    57   3.62500 -1.0 2.0
   47    46    49    50   3.62500 -1.0 2.0
   47    46    49    53   3.62500 -1.0 2.0
   49    53   -57    38   3.62500 -1.0 2.0
   49    53    57    58   3.62500 -1.0 2.0
   50    49    53    54   3.62500 -1.0 2.0
   50    49    53    57   3.62500 -1.0 2.0
   54    53    57    38   3.62500 -1.0 2.0
   54    53    57    58   3.62500 -1.0 2.0
   57    38    42    43   3.62500 -1.0 2.0
   57    38   -42    46   3.62500 -1.0 2.0
   39    33    38    42   0.04150 -1.0 2.0
   39    33    38    57   0.04150 -1.0 2.0
   39    44    48    51   1.63150  1.0 1.0
   39    44    48    51   2.92000 -1.0 2.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    48   0.00000  1.0 1.0
   41    39    44    45   0.00000  1.0 1.0
   41    39    44    48   0.00000  1.0 1.0
   44    48    51    52   0.08050  1.0 3.0
   44    48    51    55  -0.25900  1.0 1.0
   44    48    51    55  -0.47000 -1.0 2.0
   44    48    51    55   0.11750  1.0 3.0
   44    48    51    71  -0.24150  1.0 1.0
   44    48    51    71  -0.46200 -1.0 2.0
   44    48    51    71   0.11700  1.0 3.0
   45    44    48    51   3.00000 -1.0 2.0
   48    51    55    56   0.23400  1.0 3.0
   48    51    55    59   0.62750  1.0 1.0
   48    51    55    59  -0.30950 -1.0 2.0
   48    51    55    59   0.27300  1.0 3.0
   48    51    55    61   1.51850  1.0 1.0
   48    51    71    67  -0.70400  1.0 1.0
   48    51    71    67  -0.90350 -1.0 2.0
   51    55    59    60   0.15000  1.0 3.0
   51    55    59    63   0.56750  1.0 1.0
   51    55    59    63  -0.07550 -1.0 2.0
   51    55    59    63   0.20000  1.0 3.0
   51    55    59    65  -0.47750  1.0 1.0
   51    55    61    62   0.29150  1.0 1.0
   51    55    61    62  -0.28350 -1.0 2.0
   51    55    61    62   0.43600  1.0 3.0
   52    51    55    56   0.15000  1.0 3.0
   52    51    55    59   0.15000  1.0 3.0
   52    51    55    61   0.23400  1.0 3.0
   52    51    71    67   0.37050  1.0 3.0
   55    51    71    67   0.06250  1.0 1.0
   55    51    71    67  -0.01100 -1.0 2.0
   55    51    71    67   0.28050  1.0 3.0
   55    59    63    64   0.15000  1.0 3.0
   55    59   -63    67   0.56750  1.0 1.0
   55    59   -63    67  -0.07550 -1.0 2.0
   55    59   -63    67   0.20000  1.0 3.0
   55    59    63    69  -0.47750  1.0 1.0
   55    59    65    66   0.29150  1.0 1.0
   55    59    65    66  -0.28350 -1.0 2.0
   55    59    65    66   0.43600  1.0 3.0
   56    55    59    60   0.15000  1.0 3.0
   56    55    59    63   0.15000  1.0 3.0
   56    55    59    65   0.23400  1.0 3.0
   56    55    61    62   0.19450  1.0 3.0
   59    55    61    62   0.29150  1.0 1.0
   59    55    61    62  -0.28350 -1.0 2.0
   59    55    61    62   0.43600  1.0 3.0
   59    63    67    68   0.15000  1.0 3.0
   59    63    67    71   0.62750  1.0 1.0
   59    63    67    71  -0.30950 -1.0 2.0
   59    63    67    71   0.27300  1.0 3.0
   59    63    67    72   0.56750  1.0 1.0
   59    63    67    72  -0.07550 -1.0 2.0
   59    63    67    72   0.20000  1.0 3.0
   59    63    69    70   0.29150  1.0 1.0
   59    63    69    70  -0.28350 -1.0 2.0
   59    63    69    70   0.43600  1.0 3.0
   60    59    63    64   0.15000  1.0 3.0
   60    59    63    67   0.15000  1.0 3.0
   60    59    63    69   0.23400  1.0 3.0
   60    59    65    66   0.19450  1.0 3.0
   63    59    65    66   0.29150  1.0 1.0
   63    59    65    66  -0.28350 -1.0 2.0
   63    59    65    66   0.43600  1.0 3.0
   63    67   -71    51   0.06250  1.0 1.0
   63    67   -71    51  -0.01100 -1.0 2.0
   63    67   -71    51   0.28050  1.0 3.0
   63    67    72    73   0.15000  1.0 3.0
   63    67    72    74   0.15000  1.0 3.0
   63    67    72    75  -0.47750  1.0 1.0
   64    63    67    68   0.15000  1.0 3.0
   64    63    67    71   0.23400  1.0 3.0
   64    63    67    72   0.15000  1.0 3.0
   64    63    69    70   0.19450  1.0 3.0
   67    63    69    70   0.29150  1.0 1.0
   67    63    69    70  -0.28350 -1.0 2.0
   67    63    69    70   0.43600  1.0 3.0
   67    72    75    76   0.29150  1.0 1.0
   67    72    75    76  -0.28350 -1.0 2.0
   67    72    75    76   0.43600  1.0 3.0
   68    67    71    51   0.37050  1.0 3.0
   68    67    72    73   0.15000  1.0 3.0
   68    67    72    74   0.15000  1.0 3.0
   68    67    72    75   0.23400  1.0 3.0
   71    51    55    56   0.23400  1.0 3.0
   71    51   -55    59   0.62750  1.0 1.0
   71    51   -55    59  -0.30950 -1.0 2.0
   71    51   -55    59   0.27300  1.0 3.0
   71    51    55    61   1.51850  1.0 1.0
   71    67    72    73   0.23400  1.0 3.0
   71    67    72    74   0.23400  1.0 3.0
   71    67    72    75   1.51850  1.0 1.0
   72    67    71    51   0.06250  1.0 1.0
   72    67    71    51  -0.01100 -1.0 2.0
   72    67    71    51   0.28050  1.0 3.0
   73    72    75    76   0.19450  1.0 3.0
   74    72    75    76   0.19450  1.0 3.0
   69    63    67    68   0.23400  1.0 3.0
   69    63    67    71   1.51850  1.0 1.0
   69    63    67    72  -0.47750  1.0 1.0
   65    59    63    64   0.23400  1.0 3.0
   65    59    63    67  -0.47750  1.0 1.0
   65    59    63    69   3.77950  1.0 1.0
   61    55    59    60   0.23400  1.0 3.0
   61    55    59    63  -0.47750  1.0 1.0
   61    55    59    65   3.77950  1.0 1.0
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    57    38    33   4.00000 -1.0 2.0
   46    43    42    38   1.10000 -1.0 2.0
   49    47    46    42   1.10000 -1.0 2.0
   53    50    49    46   1.10000 -1.0 2.0
   57    54    53    49   1.10000 -1.0 2.0
   53    58    57    38   1.10000 -1.0 2.0
   39    48    44    45  10.50000 -1.0 2.0
END
