NCI:48742
BBtclserve11129917032D 0   0.00000     0.00000 41835
4602-49-7
 16 17  0  0  0  0  0  0  0  0  1 V2000
    5.4921    1.0093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2353    1.6785    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7000    0.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5411    1.3184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1863    1.3694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    0.7306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2321    2.2694    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9230    1.3184    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.2694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2321    2.2694    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.2694    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -2.2694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  2  0  0  0  0
  9 11  2  0  0  0  0
  9 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
 13 16  2  0  0  0  0
  8 10  1  0  0  0  0
 14 16  1  0  0  0  0
M  END