ALFAAESAR-ZINC00084947
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
    0.0180    1.3570    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0150   -0.0510    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2470   -0.7230   -0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4390    0.0090   -0.0230 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    1.4100   -0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2080    2.0940    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1770    3.4780    0.0110 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7230   -0.6970   -0.0410 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.7070   -1.9360   -0.0500 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7580   -0.0130   -0.0470 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.2870   -0.8200    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3600   -0.1400    0.0260 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9380    1.8810    0.0240 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2510   -1.8130   -0.0220 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3520    1.9780   -0.0210 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2910    3.9650    0.0240 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0300    4.0200    0.0060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2060   -2.0870    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 13  1  0  0  0  0
  2  3  2  0  0  0  0
  2 11  1  0  0  0  0
  3  4  1  0  0  0  0
  3 14  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 11 12  1  0  0  0  0
 11 18  2  0  0  0  0
M  CHG  1   8   1
M  CHG  1  10  -1
M  CHG  1  12  -1
M  END