CHEMBRIDGE-ZINC00120178
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3800    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2170   -0.6730   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4210    0.0590   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3860    1.4460   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1650    2.0990    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1240    3.5790    0.0100 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0530    4.1580    0.0230 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1620    4.2170    0.0040 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.7000   -0.6830   -0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7570   -0.0830   -0.0430 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6850   -2.0300   -0.0430 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5270   -2.5110   -0.0530 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4920   -2.7560   -0.0360 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5320   -3.7250   -0.0410 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2890   -2.1500   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2700   -2.8130   -0.0150 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9620    1.9030    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9240   -0.5600    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3050    2.0130   -0.0180 H   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 18  1  0  0  0  0
  2  3  2  0  0  0  0
  2 19  1  0  0  0  0
  3  4  1  0  0  0  0
  3 16  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5 20  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  2  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  END