PUBCHEM-ZINC06192128 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 2.6650 -1.0500 1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -1.8530 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -1.3960 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -0.3320 -0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -0.1360 1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -1.9170 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -1.4710 -2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 -0.3620 -3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 0.0000 -4.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 0.1550 -2.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 1.0880 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 1.6920 -4.2280 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 1.4500 -1.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 1.9470 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2020 2.5080 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4450 2.9860 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5570 2.9000 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4270 2.3320 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1650 1.8480 -2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5840 2.1940 -2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2210 3.2510 -2.8330 O 0 5 0 0 0 0 0 0 0 0 0 0 11.0670 3.4560 0.3040 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -1.1290 3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -2.6830 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 0.6770 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -2.7850 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -2.0170 -3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 -0.2090 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1380 1.3660 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 2.5910 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5400 3.4170 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1120 1.3570 -2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8060 1.0270 -2.9870 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 2 0 0 0 0 M CHG 1 21 -1 M END