* LIGAND DATABASE FILE (OPLS2005)
*
001      76    77    144    227     434
    1     0 S   NP   _N1_     1    29.00260    92.73401   -21.16758
    2     1 S   H    _HN1     2     1.02800    85.88180   -87.51693
    3     1 S   H    _H1_     3     1.02868   103.36662    20.19513
    4     1 S   H    _H2_     4     1.02961    25.31554   122.50344
    5     1 S   CT   _CA1     5     1.50475   132.18432   156.20560
    6     5 S   HC   _HA1     6     1.09690   104.68976    48.45845
    7     5 S   CO3  _C1_     7     1.54483   110.83674   -67.57786
    8     7 S   O2Z  _O11     8     1.26088   116.68125  -114.73215
    9     7 S   O2Z  _O12     9     1.26531   113.76511    63.99984
   10     5 S   CT   _CB1    10     1.53089   107.03984   164.43712
   11    10 S   HC   HB11    11     1.09829   109.94597   -44.14044
   12    10 S   HC   HB12    12     1.09783   110.18037    72.43890
   13    10 S   CT   _CG1    13     1.53069   112.31607  -164.82073
   14    13 S   HC   HG11    14     1.09474   110.77000   -52.59493
   15    13 S   HC   HG12    15     1.09631   110.07130    66.09387
   16    13 S   C    _CD1    16     1.51800   111.77404  -174.21904
   17    16 S   O    _OE1    17     1.22766   122.93367   -22.08906
   18    16 S   N    _N2_    18     1.38487   111.91964   159.27756
   19    18 S   H    _HN2    19     1.01566   119.17550     0.09891
   20    18 S   CT1  _CA2    20     1.46182   123.55614  -178.57536
   21    20 S   HC   _HA2    21     1.09726   109.38285   -13.32145
   22    20 S   C    _C2_    22     1.53496   108.56886  -128.94236
   23    22 S   O    _O2_    23     1.23020   122.23421  -149.65902
   24    20 S   CT   _CB2    32     1.53222   111.01986   108.84984
   25    24 S   HC   HB21    33     1.09429   109.96436    52.04417
   26    24 S   HC   HB22    34     1.09497   111.07269   170.47337
   27    22 S   N    _N3_    24     1.38522   113.47543    38.04195
   28    27 S   H    _HN3    25     1.01519   118.85269    -0.80479
   29    24 S   S    _SG2    35     1.82303   112.15729   -70.03235
   30    27 S   CT   _CA3    26     1.45445   123.52944   175.17822
   31    30 S   HC   HA31    27     1.09517   109.34896    22.36735
   32    30 S   HC   HA32    28     1.09499   107.09537   139.37331
   33    29 S   OS   _O36    36     1.66336    98.57538   152.40566
   34    30 S   CO3  _C3_    29     1.52906   113.03267  -101.19743
   35    34 S   O2Z  _O31    30     1.26410   115.36751   -45.52702
   36    34 S   O2Z  _O32    31     1.26349   115.01856   135.41951
   37    33 S   CT   _C11    37     1.46445   120.96018  -126.12087
   38    37 S   CT   _C12    38     1.54273   112.21396    58.94449
   39    38 S   HC   _H4_    39     1.09437   109.28067   177.22639
   40    37 S   CT   _C10    49     1.58419   104.74115  -179.61033
   41    38 S   CM   _C13    40     1.50340   118.63672    56.56383
   42    41 S   HC   _H17    41     1.09215   110.29912  -162.03567
   43    40 S   CT   _C9_    50     1.56099   103.66049    81.12722
   44    43 S   HC   _H15    51     1.09629   112.66095  -113.30374
   45    43 S   HC   _H16    52     1.09634   111.45221   127.46493
   46    40 S   CT   _C18    68     1.54559   116.79209  -161.12462
   47    46 S   HC   _H22    69     1.09258   113.08623    61.10223
   48    46 S   HC   _H23    70     1.09160   112.57916   -61.32568
   49    46 S   HC   _H24    71     1.09731   110.28746  -179.73607
   50    38 S   OH   _O35    75     1.42967   110.36638   -68.64670
   51    50 S   HO   _H21    76     0.97641   107.67352  -159.81185
   52    41 S   CM   _C14    42     1.34732   132.18183    23.76411
   53    43 S   CT   _C8_    53     1.52418   107.40538     7.40115
   54    53 S   HC   _H13    54     1.09214   112.40123   146.65791
   55    53 S   HC   _H14    55     1.09843   108.49507   -97.56226
   56    52 S   CT   _C15    43     1.52707   132.67080    -1.37942
   57    56 S   OM   _O33    44     1.32856   106.54757  -127.17142
   58    56 S   HC   _H5_    45     1.10245   102.73905   107.06653
   59    37 S   CT   _C7_    56     1.58067   107.17592   -70.41357
   60    59 S   HC   _H3_    57     1.09651   109.95629    43.60122
   61    52 S   CO4  _C17    72     1.51350   110.75223   170.99207
   62    61 S   O    _O34    73     1.22630   124.19918  -159.84370
   63    61 S   HC   _H20    74     1.10361   115.90236    18.37147
   64    56 S   CT   _C16    46     1.56188   122.14507    -7.93588
   65    64 S   HC   _H18    47     1.10380   106.46100   153.60251
   66    64 S   HC   _H19    48     1.10228   111.46368   -95.31216
   67    59 S   CT   _C5_    58     1.56434   117.09344   165.53270
   68    67 S   HC   _H9_    59     1.09097   110.45495    11.29859
   69    67 S   CT   _C4_    60     1.53275   115.56215   132.21520
   70    69 S   HC   _H6_    61     1.09506   111.59935    60.19747
   71    69 S   HC   _H7_    62     1.09377   111.48865   -61.90468
   72    69 S   HC   _H8_    63     1.09611   110.51824   179.57525
   73    67 S   CT   _C6_    64     1.53871   110.26857  -105.67854
   74    73 S   HC   _H10    65     1.09567   111.10835   -63.85901
   75    73 S   HC   _H11    66     1.09566   110.72443   176.41144
   76    73 S   HC   _H12    67     1.09160   111.90473    56.84511
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   6   3   2   7   4   5   5   4   3
  13   2   1   1  28  16   7  22  12   4  16   7   6   9   3   2
   1   3   1   9   9   4   3   8   5   4  12   4   3   1   1   2
   1   1   9   8   7   3   2   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    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    59  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    64    40    43    53    59    60    67    46    50  
   35    36  
   36  
    0  
   38    39    41    42    52    56    64    65    66    40    43    44    45    53    54    55    59    60    67    68    69    73    46    47    48    49    50    51  
   39    41    42    52    56    64    40    43    53    59    60    67    46    61    50    51  
   41    42    52    40    59    50    51  
   43    44    45    53    54    55    59    60    67    46    47    48    49    50    41    52    56    57    58    64    65    66  
   42    52    56    57    58    64    59    61    62    63    50    51  
   52    56    61    50  
   44    45    53    54    55    59    60    67    46    47    48    49    56    64    65    66  
   45    53    54    55    59    46    64  
   53    54    55    59    46    64  
   47    48    49    53    56    59    64    65    66  
   48    49    64  
   49    64  
   64  
   51    52    59  
    0  
   56    57    58    64    65    66    61    62    63  
   54    55    59    60    67    68    69    73    64  
   55    59    60    67  
   59    60    67  
   57    58    64    65    66    61    62    63  
   58    64    65    66    61  
   64    65    66    61  
   60    67    68    69    70    71    72    73    74    75    76    64  
   67    68    69    73  
   62    63    64  
   63  
    0  
   65    66  
   66  
    0  
   68    69    70    71    72    73    74    75    76  
   69    70    71    72    73    74    75    76  
   70    71    72    73    74    75    76  
   71    72    73  
   72    73  
   73  
   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   0.047500   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   2.9000   0.1400  -0.415000   1.5900   1.4000   0.020110767  -0.896042159
   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   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   38   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   57   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   58   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   63   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   655.000  1.490
   33    37   320.000  1.410
   37    38   268.000  1.529
   37    40   268.000  1.529
   37    59   268.000  1.529
   38    39   340.000  1.090
   38    41   317.000  1.510
   38    50   320.000  1.410
   41    42   340.000  1.080
   41    52   549.000  1.340
   52    56   317.000  1.510
   52    61   320.000  1.462
   56    57   570.000  1.307
   56    58   340.000  1.090
   56    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    40   268.000  1.529
   40    43   268.000  1.529
   40    46   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    59   268.000  1.529
   59    60   340.000  1.090
   59    67   268.000  1.529
   67    68   340.000  1.090
   67    69   268.000  1.529
   67    73   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   340.000  1.090
   61    62   570.000  1.229
   61    63   340.000  1.090
   50    51   553.000  0.945
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   110.00000  101.00000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37   100.00000  113.00000
   33    37    38    50.00000  109.50000
   33    37    40    50.00000  109.50000
   33    37    59    50.00000  109.50000
   37    38    39    37.50000  110.70000
   37    38    41    70.00000  112.02700
   37    38    50    50.00000  109.50000
   37    40    64    58.35000  112.70000
   37    40    43    58.35000  112.70000
   37    40    46    58.35000  112.70000
   37    59    53    58.35000  112.70000
   37    59    60    37.50000  110.70000
   37    59    67    58.35000  112.70000
   38    41    42    35.00000  117.00000
   38    41    52    70.00000  124.00000
   38    50    51    55.00000  108.50000
   41    38    39    35.00000  109.50000
   41    52    56    70.00000  124.00000
   41    52    61    65.00000  118.96000
   52    41    42    35.00000  120.00000
   52    56    57    85.00000  110.90400
   52    56    58    35.00000  109.50000
   52    56    64    70.00000  112.02700
   52    61    62    80.00000  123.72100
   52    61    63    40.00000  115.75000
   56    64    65    37.50000  110.70000
   56    64    66    37.50000  110.70000
   56    64    40    58.35000  112.70000
   58    56    57    45.00000  125.66300
   64    56    57    50.00000  109.50000
   64    56    58    37.50000  110.70000
   64    40    43    58.35000  112.70000
   64    40    46    58.35000  112.70000
   66    64    65    33.00000  107.80000
   40    37    38    58.35000  112.70000
   40    64    65    37.50000  110.70000
   40    64    66    37.50000  110.70000
   40    43    44    37.50000  110.70000
   40    43    45    37.50000  110.70000
   40    43    53    58.35000  112.70000
   40    46    47    37.50000  110.70000
   40    46    48    37.50000  110.70000
   40    46    49    37.50000  110.70000
   43    53    54    37.50000  110.70000
   43    53    55    37.50000  110.70000
   43    53    59    58.35000  112.70000
   45    43    44    33.00000  107.80000
   53    43    44    37.50000  110.70000
   53    43    45    37.50000  110.70000
   53    59    60    37.50000  110.70000
   53    59    67    58.35000  112.70000
   55    53    54    33.00000  107.80000
   59    37    38    58.35000  112.70000
   59    37    40    58.35000  112.70000
   59    53    54    37.50000  110.70000
   59    53    55    37.50000  110.70000
   59    67    68    37.50000  110.70000
   59    67    69    58.35000  112.70000
   59    67    73    58.35000  112.70000
   67    59    60    37.50000  110.70000
   67    69    70    37.50000  110.70000
   67    69    71    37.50000  110.70000
   67    69    72    37.50000  110.70000
   67    73    74    37.50000  110.70000
   67    73    75    37.50000  110.70000
   67    73    76    37.50000  110.70000
   69    67    68    37.50000  110.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   73    67    68    37.50000  110.70000
   73    67    69    58.35000  112.70000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   46    40    43    58.35000  112.70000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    33.00000  107.80000
   61    52    56    65.00000  116.34900
   63    61    62    35.00000  123.00000
   50    38    39    35.00000  109.50000
   50    38    41    90.00000  110.39200
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   0.00000  1.0 1.0
   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  -2.50000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   0.37500  1.0 3.0
   29    33    37    40   0.37500  1.0 3.0
   29    33    37    59   0.37500  1.0 3.0
   33    37    38    39   0.23400  1.0 3.0
   33    37    38    41   0.61850  1.0 1.0
   33    37    38    41  -0.22750 -1.0 2.0
   33    37    38    41   0.15300  1.0 3.0
   33    37    38    50   3.69350  1.0 1.0
   33    37    38    50  -1.82950 -1.0 2.0
   33    37    40    64   0.62750  1.0 1.0
   33    37    40    64  -0.30950 -1.0 2.0
   33    37    40    64   0.27300  1.0 3.0
   33    37    40    43   0.62750  1.0 1.0
   33    37    40    43  -0.30950 -1.0 2.0
   33    37    40    43   0.27300  1.0 3.0
   33    37    40    46   0.62750  1.0 1.0
   33    37    40    46  -0.30950 -1.0 2.0
   33    37    40    46   0.27300  1.0 3.0
   33    37    59    53   0.62750  1.0 1.0
   33    37    59    53  -0.30950 -1.0 2.0
   33    37    59    53   0.27300  1.0 3.0
   33    37    59    60   0.23400  1.0 3.0
   33    37    59    67   0.62750  1.0 1.0
   33    37    59    67  -0.30950 -1.0 2.0
   33    37    59    67   0.27300  1.0 3.0
   37    38    41    42   0.00000  1.0 1.0
   37    38    41    52   0.09850  1.0 1.0
   37    38    41    52   0.15250 -1.0 2.0
   37    38    41    52  -0.50650  1.0 3.0
   37    38    50    51  -0.11600  1.0 1.0
   37    38    50    51  -0.09450 -1.0 2.0
   37    38    50    51   0.21250  1.0 3.0
   37    40    43    44   0.15000  1.0 3.0
   37    40    43    45   0.15000  1.0 3.0
   37    40   -43    53   0.56750  1.0 1.0
   37    40   -43    53  -0.07550 -1.0 2.0
   37    40   -43    53   0.20000  1.0 3.0
   37    40    46    47   0.15000  1.0 3.0
   37    40    46    48   0.15000  1.0 3.0
   37    40    46    49   0.15000  1.0 3.0
   37    59    67    68   0.15000  1.0 3.0
   37    59    67    69   0.56750  1.0 1.0
   37    59    67    69  -0.07550 -1.0 2.0
   37    59    67    69   0.20000  1.0 3.0
   37    59    67    73   0.56750  1.0 1.0
   37    59    67    73  -0.07550 -1.0 2.0
   37    59    67    73   0.20000  1.0 3.0
   38    37    40    64   0.56750  1.0 1.0
   38    37    40    64  -0.07550 -1.0 2.0
   38    37    40    64   0.20000  1.0 3.0
   38    37    40    43   0.56750  1.0 1.0
   38    37    40    43  -0.07550 -1.0 2.0
   38    37    40    43   0.20000  1.0 3.0
   38    37    40    46   0.56750  1.0 1.0
   38    37    40    46  -0.07550 -1.0 2.0
   38    37    40    46   0.20000  1.0 3.0
   38    37    59    53   0.56750  1.0 1.0
   38    37    59    53  -0.07550 -1.0 2.0
   38    37    59    53   0.20000  1.0 3.0
   38    37    59    60   0.15000  1.0 3.0
   38    37    59    67   0.56750  1.0 1.0
   38    37    59    67  -0.07550 -1.0 2.0
   38    37    59    67   0.20000  1.0 3.0
   38    41    52    56   7.00000 -1.0 2.0
   38    41    52    61   7.00000 -1.0 2.0
   39    38    41    42   0.33100  1.0 3.0
   39    38    41    52   0.00000  1.0 1.0
   39    38    50    51   0.19450  1.0 3.0
   41    38    50    51  -0.07800  1.0 1.0
   41    38    50    51  -0.21500 -1.0 2.0
   41    38    50    51  -0.03150  1.0 3.0
   41    52    56    57   0.39000  1.0 1.0
   41    52    56    57  -0.05800 -1.0 2.0
   41    52    56    57  -0.55150  1.0 3.0
   41    52    56    58   0.00000  1.0 1.0
   41    52    56    64   0.09850  1.0 1.0
   41    52    56    64   0.15250 -1.0 2.0
   41    52    56    64  -0.50650  1.0 3.0
   41    52    61    62   1.00000 -1.0 2.0
   41    52    61    63  -0.79650  1.0 1.0
   41    52    61    63   1.60950 -1.0 2.0
   41    52    61    63  -0.26250  1.0 3.0
   42    41    52    56   7.00000 -1.0 2.0
   42    41    52    61   7.00000 -1.0 2.0
   52    56    64    65   0.15000  1.0 3.0
   52    56    64    66   0.15000  1.0 3.0
   52    56    64    40   0.34400  1.0 1.0
   52    56    64    40   0.09450 -1.0 2.0
   52    56    64    40   0.11100  1.0 3.0
   56    52    61    62  -0.64400  1.0 1.0
   56    52    61    62   0.26850 -1.0 2.0
   56    52    61    63  -0.07900  1.0 1.0
   56    52    61    63   0.77700 -1.0 2.0
   56    52    61    63   0.13200  1.0 3.0
   56    64    40    37   0.56750  1.0 1.0
   56    64    40    37  -0.07550 -1.0 2.0
   56    64    40    37   0.20000  1.0 3.0
   56    64    40    43   0.56750  1.0 1.0
   56    64    40    43  -0.07550 -1.0 2.0
   56    64    40    43   0.20000  1.0 3.0
   56    64    40    46   0.56750  1.0 1.0
   56    64    40    46  -0.07550 -1.0 2.0
   56    64    40    46   0.20000  1.0 3.0
   57    56    64    65   0.23400  1.0 3.0
   57    56    64    66   0.23400  1.0 3.0
   57    56    64    40   0.62750  1.0 1.0
   57    56    64    40  -0.30950 -1.0 2.0
   57    56    64    40   0.27300  1.0 3.0
   58    56    64    65   0.15000  1.0 3.0
   58    56    64    66   0.15000  1.0 3.0
   58    56    64    40   0.15000  1.0 3.0
   64    40    43    44   0.15000  1.0 3.0
   64    40    43    45   0.15000  1.0 3.0
   64    40    43    53   0.56750  1.0 1.0
   64    40    43    53  -0.07550 -1.0 2.0
   64    40    43    53   0.20000  1.0 3.0
   64    40    46    47   0.15000  1.0 3.0
   64    40    46    48   0.15000  1.0 3.0
   64    40    46    49   0.15000  1.0 3.0
   65    64    40    37   0.15000  1.0 3.0
   65    64    40    43   0.15000  1.0 3.0
   65    64    40    46   0.15000  1.0 3.0
   66    64    40    37   0.15000  1.0 3.0
   66    64    40    43   0.15000  1.0 3.0
   66    64    40    46   0.15000  1.0 3.0
   40    37    38    39   0.15000  1.0 3.0
   40    37    38    41   0.34400  1.0 1.0
   40    37    38    41   0.09450 -1.0 2.0
   40    37    38    41   0.11100  1.0 3.0
   40    37    38    50   0.86500  1.0 1.0
   40    37    38    50  -0.17500 -1.0 2.0
   40    37    38    50   0.20800  1.0 3.0
   40    37   -59    53   0.56750  1.0 1.0
   40    37   -59    53  -0.07550 -1.0 2.0
   40    37   -59    53   0.20000  1.0 3.0
   40    37    59    60   0.15000  1.0 3.0
   40    37    59    67   0.56750  1.0 1.0
   40    37    59    67  -0.07550 -1.0 2.0
   40    37    59    67   0.20000  1.0 3.0
   40    43    53    54   0.15000  1.0 3.0
   40    43    53    55   0.15000  1.0 3.0
   40    43   -53    59   0.56750  1.0 1.0
   40    43   -53    59  -0.07550 -1.0 2.0
   40    43   -53    59   0.20000  1.0 3.0
   43    40    46    47   0.15000  1.0 3.0
   43    40    46    48   0.15000  1.0 3.0
   43    40    46    49   0.15000  1.0 3.0
   43    53   -59    37   0.56750  1.0 1.0
   43    53   -59    37  -0.07550 -1.0 2.0
   43    53   -59    37   0.20000  1.0 3.0
   43    53    59    60   0.15000  1.0 3.0
   43    53    59    67   0.56750  1.0 1.0
   43    53    59    67  -0.07550 -1.0 2.0
   43    53    59    67   0.20000  1.0 3.0
   44    43    53    54   0.15000  1.0 3.0
   44    43    53    55   0.15000  1.0 3.0
   44    43    53    59   0.15000  1.0 3.0
   45    43    53    54   0.15000  1.0 3.0
   45    43    53    55   0.15000  1.0 3.0
   45    43    53    59   0.15000  1.0 3.0
   53    59    67    68   0.15000  1.0 3.0
   53    59    67    69   0.56750  1.0 1.0
   53    59    67    69  -0.07550 -1.0 2.0
   53    59    67    69   0.20000  1.0 3.0
   53    59    67    73   0.56750  1.0 1.0
   53    59    67    73  -0.07550 -1.0 2.0
   53    59    67    73   0.20000  1.0 3.0
   54    53    59    37   0.15000  1.0 3.0
   54    53    59    60   0.15000  1.0 3.0
   54    53    59    67   0.15000  1.0 3.0
   55    53    59    37   0.15000  1.0 3.0
   55    53    59    60   0.15000  1.0 3.0
   55    53    59    67   0.15000  1.0 3.0
   59    37    38    39   0.15000  1.0 3.0
   59    37    38    41   0.34400  1.0 1.0
   59    37    38    41   0.09450 -1.0 2.0
   59    37    38    41   0.11100  1.0 3.0
   59    37    38    50   0.86500  1.0 1.0
   59    37    38    50  -0.17500 -1.0 2.0
   59    37    38    50   0.20800  1.0 3.0
   59    37    40    64   0.56750  1.0 1.0
   59    37    40    64  -0.07550 -1.0 2.0
   59    37    40    64   0.20000  1.0 3.0
   59    37   -40    43   0.56750  1.0 1.0
   59    37   -40    43  -0.07550 -1.0 2.0
   59    37   -40    43   0.20000  1.0 3.0
   59    37    40    46   0.56750  1.0 1.0
   59    37    40    46  -0.07550 -1.0 2.0
   59    37    40    46   0.20000  1.0 3.0
   59    67    69    70   0.15000  1.0 3.0
   59    67    69    71   0.15000  1.0 3.0
   59    67    69    72   0.15000  1.0 3.0
   59    67    73    74   0.15000  1.0 3.0
   59    67    73    75   0.15000  1.0 3.0
   59    67    73    76   0.15000  1.0 3.0
   60    59    67    68   0.15000  1.0 3.0
   60    59    67    69   0.15000  1.0 3.0
   60    59    67    73   0.15000  1.0 3.0
   68    67    69    70   0.15000  1.0 3.0
   68    67    69    71   0.15000  1.0 3.0
   68    67    69    72   0.15000  1.0 3.0
   68    67    73    74   0.15000  1.0 3.0
   68    67    73    75   0.15000  1.0 3.0
   68    67    73    76   0.15000  1.0 3.0
   69    67    73    74   0.15000  1.0 3.0
   69    67    73    75   0.15000  1.0 3.0
   69    67    73    76   0.15000  1.0 3.0
   73    67    69    70   0.15000  1.0 3.0
   73    67    69    71   0.15000  1.0 3.0
   73    67    69    72   0.15000  1.0 3.0
   46    40    43    44   0.15000  1.0 3.0
   46    40    43    45   0.15000  1.0 3.0
   46    40    43    53   0.56750  1.0 1.0
   46    40    43    53  -0.07550 -1.0 2.0
   46    40    43    53   0.20000  1.0 3.0
   61    52    56    57   0.09700  1.0 1.0
   61    52    56    57   0.15600 -1.0 2.0
   61    52    56    57  -0.50800  1.0 3.0
   61    52    56    58   0.15000  1.0 3.0
   61    52    56    64   0.09700  1.0 1.0
   61    52    56    64   0.15600 -1.0 2.0
   61    52    56    64  -0.50800  1.0 3.0
   50    38    41    42   0.00000  1.0 1.0
   50    38    41    52   0.67800  1.0 1.0
   50    38    41    52   0.47050 -1.0 2.0
   50    38    41    52  -0.62500  1.0 3.0
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
   38    42    41    52   1.10000 -1.0 2.0
   61    56    52    41   1.10000 -1.0 2.0
   52    63    61    62  10.50000 -1.0 2.0
END
