ALFAAESAR-ZINC01610714
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0360    1.3680    0.0970 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0100   -0.0290    0.1310 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2320   -0.7170    0.0180 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4050    0.0430   -0.0970 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3580    1.4440   -0.1760 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1370    2.1040   -0.0690 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7150   -0.5880   -0.0480 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.5520   -0.1720   -0.8690 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9540   -1.3620    0.8880 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.2310   -2.2130   -0.0600 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0430   -2.7270   -0.8870 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9910    1.8790    0.1820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9160   -0.5940    0.2310 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0980    3.1880   -0.1180 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4640    2.2320   -0.3640 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3930   -2.8250    0.6690 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1920    1.6770   -0.7150 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  2  0  0  0  0
  3 10  1  0  0  0  0
  4  5  1  0  0  0  0
  4  7  1  0  0  0  0
  5  6  2  0  0  0  0
  5 15  1  0  0  0  0
  6 14  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 11  1  0  0  0  0
 10 16  2  0  0  0  0
 15 17  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  11  -1
M  END