RDKit          3D

 21 21  0  0  0  0  0  0  0  0999 V2000
    2.7588   -1.6018   -0.4276 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9350   -1.2737    0.6872 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8151   -0.4571    0.4658 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8891    0.9114    0.5539 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1253    1.4869    0.8745 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2116    1.7408    0.3376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0614    3.1159    0.4440 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4172    1.1507    0.0235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5277   -0.2233   -0.0735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8307   -0.8524   -0.4126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4157   -1.0007    0.1481 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5715   -2.9163    0.0125 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.6928   -2.0558   -0.0904 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0223   -0.6893   -1.0091 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2629   -2.2914   -1.1307 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2026    2.5109    0.9456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8851    3.6800    0.2793 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3023    1.7823   -0.1523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7683   -1.9273   -0.2311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1130   -0.6826   -1.4695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5994   -0.4072    0.2249 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  4  6  1  0
  6  7  1  0
  6  8  2  0
  8  9  1  0
  9 10  1  0
  9 11  2  0
 11 12  1  0
 11  3  1  0
  1 13  1  0
  1 14  1  0
  1 15  1  0
  5 16  1  0
  7 17  1  0
  8 18  1  0
 10 19  1  0
 10 20  1  0
 10 21  1  0
M  END