NCI:168786
BBtclserve11129918032D 0   0.00000     0.00000124494
999-99-9
 17 17  0  0  0  0  0  0  0  0  2 V2000
    4.1351    0.7481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7670    1.6779    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    4.5032   -0.1816    0.0000 W   0  0  0  0  0  0  0  0  0  0  0  0
    3.6052    0.2583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3122    0.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8122    0.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6942   -0.7694    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3122   -0.7694    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7072    0.6983    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    6.1213    0.9939    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    5.1213    1.7205    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    2.7431   -0.4604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0032   -1.7205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2633   -0.4604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0032   -1.7205    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.1295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0064   -1.1295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  3  0  0  0  0
  5 10  3  0  0  0  0
  6 11  3  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
 12 16  1  0  0  0  0
 14 17  1  0  0  0  0
 13 15  1  0  0  0  0
M  CHG  4   2   1   9   1  10   1  11   1
M  END