ACROSORGANICS-ZINC03875804 MOE2007 3D Structure written by MMmdl. 30 32 0 0 0 0 0 0 0 0999 V2000 -0.1580 1.0410 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 1.7320 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 3.1100 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 3.8220 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 3.1120 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 1.7280 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 3.8690 0.2650 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 2.7470 -0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 4.3570 1.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 5.2570 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 6.0110 0.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 5.8600 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 7.2010 1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 7.8060 2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 7.0660 2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 5.7210 1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 5.1140 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 3.7800 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 3.2290 0.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 4.8220 1.9150 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 5.7080 2.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6990 3.5840 2.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -0.0250 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 1.1960 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 1.1720 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 7.7800 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 8.8420 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 7.5400 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 4.8490 -0.8110 O 0 5 0 0 0 0 0 0 0 0 0 0 5.6490 4.7330 0.5600 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 29 1 0 0 0 0 10 11 2 0 0 0 0 10 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 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 30 1 0 0 0 0 M CHG 1 29 -1 M CHG 1 30 -1 M END