ALFAAESAR-ZINC00478190
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  0  0  0  0  0  0999 V2000
   -0.0180    1.4610    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0240   -0.8050    1.1140 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0340   -0.5540    2.4840 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0570   -1.5970    3.3660 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0700   -2.9110    2.9140 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0600   -3.1870    1.5780 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0360   -2.1360    0.6540 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0210   -2.0670   -0.8030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0040   -0.8090   -1.1420 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0940   -4.0220    3.8920 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1030   -3.7820    5.0860 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1050   -5.1760    3.5030 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0050    1.8380    0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5450    1.8220   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5280    1.8120    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0250    0.4630    2.8480 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0650   -1.3970    4.4270 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0710   -4.2110    1.2350 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0260   -2.9080   -1.4800 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  2 10  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 11  1  0  0  0  0
  7  8  1  0  0  0  0
  7 19  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 20  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  13  -1
M  END