NCI:33522
BBtclserve11129916542D 0   0.00000     0.00000 29331
79929-21-8
 17 18  0  0  0  0  0  0  0  0  2 V2000
    4.0823    1.2795    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.0823    0.2795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9483    1.7795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2733   -0.3083    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.8913   -0.3083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8619    1.3727    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.0529    2.7740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823   -1.2594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5823   -1.2594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5310    2.1159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0310    2.9819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9945   -2.0684    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    7.5255    2.0114    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.4013   -2.9819    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.9638    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    8.1133    2.8204    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9323    1.0978    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
 10 13  1  0  0  0  0
 12 14  2  0  0  0  0
 12 15  1  0  0  0  0
 13 16  2  0  0  0  0
 13 17  1  0  0  0  0
  8  9  2  0  0  0  0
 10 11  2  0  0  0  0
M  CHG  4  12   1  13   1  15  -1  17  -1
M  END