IBS-ZINC05070487 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -4.7990 8.3400 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0680 6.9540 -1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 6.1490 -2.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7810 4.4470 -2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 5.0320 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0460 5.1670 -2.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2850 6.4000 -1.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1200 3.6000 -3.2480 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 2.4020 -2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 1.7480 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 1.9420 -0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 3.1100 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 3.2710 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 2.2650 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.0900 -0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 0.9340 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 0.0320 -1.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 0.1550 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2850 1.9990 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 0.7610 -2.3410 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7400 8.5880 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 9.0460 -1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0620 8.4790 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 0.9780 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 3.9030 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 4.1850 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 2.4310 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 0.0190 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.9970 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 0.2430 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -0.7590 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0860 2.9880 -2.3530 O 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 1 0 0 0 0 2 7 2 0 0 0 0 3 5 2 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 2 0 0 0 0 M CHG 1 20 -1 M END