PUBCHEM-ZINC02764115 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 0 0 0 0 0 0999 V2000 0.1850 1.0070 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.4560 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -0.7360 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.7480 2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -1.1170 3.6540 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -1.2540 2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -1.0230 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -1.0900 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4170 -1.3880 0.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 -0.7840 -0.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8620 -0.8210 -1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -2.2510 -2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 0.0970 -3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -1.5650 3.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -1.7970 4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -1.7740 5.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4970 -2.0990 4.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -2.3550 5.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5350 -2.6640 5.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2070 -2.6640 4.8870 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3710 -0.4960 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 1.3360 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 1.1650 -1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 1.6530 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -0.7330 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -1.0980 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 -0.4420 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 -2.6520 -2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 -2.3060 -3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 -2.9120 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 1.1180 -2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 0.1190 -3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -0.2210 -3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -1.6200 2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1110 -2.1100 3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4510 -2.3500 6.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -1.3250 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -0.3900 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 0.4260 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 -2.8850 7.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 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 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 40 2 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M CHG 1 20 -1 M END