NCID-ZINC05606505
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0330    1.3490   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0210   -0.0340   -0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2400   -0.6800   -0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4200    0.0650    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3580    1.4590    0.0260 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1330    2.0930    0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0650    3.5710    0.0280 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.0160    4.1320    0.0140 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0910    4.2270    0.0560 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.7300   -0.6200    0.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9740   -1.4450    0.8870 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6540   -0.3310   -0.9100 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2960   -2.1580   -0.0390 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.2700   -2.8080    0.0540 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3680   -2.7260   -0.1460 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9900    1.8500   -0.0370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8930   -0.6090   -0.0620 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2680    2.0410    0.0520 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4600    0.3260   -1.5960 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5140   -0.7810   -0.8990 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 16  1  0  0  0  0
  2  3  2  0  0  0  0
  2 17  1  0  0  0  0
  3  4  1  0  0  0  0
  3 13  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 18  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 19  1  0  0  0  0
 12 20  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  13   1
M  CHG  1  15  -1
M  END