Mrv1909 09112017562D          

  8  5  0  0  0  0            999 V2000
    2.0531    0.0066    0.0000 Al  0  3  0  0  0  0  0  0  0  0  0  0
    2.4656    0.7211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4656   -0.7079    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4656   -0.2728    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    0.0535   -0.0065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4661    0.7079    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.4661   -0.7211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7714   -0.0065    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
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
M  CHG  4   1   1   4   1   6  -1   8  -1
M  END