ALFAAESAR-ZINC01680683
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0420    1.5500   -0.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0070    0.0210    0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4160   -0.5140    0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9820   -0.9540    1.1970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2740   -1.4450    1.2050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0010   -1.4940    0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4360   -1.0530   -1.1520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1450   -0.5580   -1.1580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5420   -0.0810   -2.4230 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.2150   -0.0280   -3.4370 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3730    0.2590   -2.4500 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9770    1.9360   -0.0480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5580    1.8720   -0.9470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5700    1.9300    0.8320 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5200   -0.3590   -0.8680 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5090   -0.3020    0.9110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4130   -0.9160    2.1150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7150   -1.7900    2.1280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0110   -1.8780    0.0360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0040   -1.0920   -2.0690 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  2 15  1  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  2  0  0  0  0
  4 17  1  0  0  0  0
  5  6  1  0  0  0  0
  5 18  1  0  0  0  0
  6  7  2  0  0  0  0
  6 19  1  0  0  0  0
  7  8  1  0  0  0  0
  7 20  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END