NCI:173696
BBtclserve11129918062D 0   0.00000     0.00000128013
94443-25-1
 16 19  0  0  0  0  0  0  0  0  2 V2000
    3.8240   -1.0016    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    3.8083   -2.0015    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.9659   -0.4881    0.0000 Mn  0  0  0  0  0  0  0  0  0  0  0  0
    4.6664   -2.5150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9345   -2.4878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1373   -0.2943    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    3.6828    1.5707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9659    0.9261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7071   -1.4540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.7469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2588    0.2190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6730    0.2190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5583    0.6128    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.0117    2.5150    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    6.5544    0.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9833    1.4309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  9  1  0  0  0  0
  3 10  1  0  0  0  0
  3 11  1  0  0  0  0
  3 12  1  0  0  0  0
  6 13  2  0  0  0  0
  7 14  3  0  0  0  0
 13 15  1  0  0  0  0
 13 16  1  0  0  0  0
  9 10  1  0  0  0  0
  8 11  1  0  0  0  0
 10 11  2  0  0  0  0
  8 12  1  0  0  0  0
  9 12  2  0  0  0  0
M  CHG  3   1   1   6   1  14   1
M  END
$$$$