PUBCHEM-ZINC05997475 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.3980 1.2490 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.1160 -0.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -0.8800 -1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -0.5610 -2.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -2.2270 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -3.0160 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -4.3330 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -4.8860 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -4.0770 -1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -2.7390 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -1.9030 -3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -0.6700 -2.8530 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4640 -6.2850 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -6.7160 0.4600 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9380 -5.1190 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -5.9590 0.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -4.6800 1.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -5.4140 2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 1.6920 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 1.3350 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 1.7930 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -2.6090 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -4.4930 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -5.2640 2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -6.4790 2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -5.0370 3.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -2.5010 -4.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -6.9150 -1.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 2 0 0 0 0 13 14 1 0 0 0 0 13 28 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 M CHG 1 12 -1 M CHG 1 14 -1 M END