NCI:326153
BBtclserve11129919042D 0   0.00000     0.00000174477
85044-77-5
 18 19  0  0  0  0  0  0  0  0  2 V2000
    4.5032   -0.1739    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.5032   -0.1739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5032   -0.1739    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5032    0.8261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5032   -1.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6942    1.4139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3122    1.4139    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372   -1.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3692   -1.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7431    1.1048    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.0032    2.3649    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0032    2.3649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372   -2.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3692   -2.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.7740    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5352    0.1267    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.4154    3.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5032   -3.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4  7  1  0  0  0  0
  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  2  0  0  0  0
  8 13  1  0  0  0  0
  9 14  2  0  0  0  0
 10 15  2  0  0  0  0
 10 16  1  0  0  0  0
 11 17  1  0  0  0  0
 13 18  2  0  0  0  0
 11 12  1  0  0  0  0
 14 18  1  0  0  0  0
M  CHG  2  10   1  16  -1
M  END