PUBCHEM-ZINC05932436 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0090 1.4060 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 1.0650 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 0.3890 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0510 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 0.3950 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 1.0710 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 -0.8130 -0.0510 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 0.4830 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 1.8080 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 2.8230 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9820 2.5220 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4020 1.2050 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4770 0.1800 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -1.1550 -0.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0880 -1.4920 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8270 -0.6300 0.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -2.9400 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7890 -3.0390 0.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3100 -4.2870 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 -5.4010 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1720 -6.6520 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4190 -6.7510 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0660 -5.6740 1.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5590 -4.4660 1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2630 -3.3880 1.9920 N 0 3 0 0 0 0 0 0 0 0 0 0 11.7980 -2.2700 1.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3600 -3.5390 2.4990 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9480 1.9390 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 1.3280 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 0.1220 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 0.1340 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 1.3400 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 2.0460 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 3.8530 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7050 3.3190 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4500 0.9740 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 -1.8370 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7740 -3.4950 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5400 -3.3570 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 -5.2940 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6500 -7.5400 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8700 -7.7240 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 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 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END