PUBCHEM-ZINC05819593 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0450 1.5540 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 0.0350 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -0.5420 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -2.0630 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -2.7090 -0.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -2.6540 -2.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -1.9920 -3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -3.0660 -3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -4.3430 -3.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -4.1170 -2.4690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8920 -4.5600 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -4.7790 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -4.0810 -3.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 1.9700 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.9100 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 1.9440 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -0.2900 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -0.3510 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.2040 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -0.1800 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -1.7010 -4.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -1.1030 -3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 -2.8820 -5.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -3.1270 -3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -4.4760 -4.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -5.2290 -3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -5.9770 -2.2300 O 0 5 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 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 M CHG 1 27 -1 M END