PUBCHEM-ZINC03611732 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.1180 2.9770 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 1.2520 -0.5110 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 1.1520 0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 0.6190 -0.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 0.4560 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 0.4020 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -0.2210 -2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -0.7940 -3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -0.7390 -3.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -0.1190 -2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -1.4070 -4.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -1.4460 -4.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 -2.5090 -4.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 -2.5460 -4.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9480 -1.5260 -4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -0.4670 -5.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 -0.4270 -5.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 -1.5690 -4.8600 N 0 3 0 0 0 0 0 0 0 0 0 0 8.9990 -2.5020 -4.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0730 -0.6710 -5.3700 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8710 3.4000 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 3.0170 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 3.5500 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 0.8480 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 -0.2620 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -1.1830 -4.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.0800 -2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -3.3050 -3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -3.3730 -3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8740 0.3290 -5.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 0.3990 -6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 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 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END