IBS-ZINC06760732 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0580 1.5220 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -0.0020 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -0.5350 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -2.0030 1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -2.6220 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -4.2850 1.0990 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -4.2170 2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -2.9360 2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -2.6130 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 -3.5890 3.7050 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3110 -5.3340 2.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -6.6350 2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -7.0450 2.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -7.7300 3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -7.3190 4.2270 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3680 -1.9550 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -0.5230 -0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -0.3090 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 2.0210 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 1.9300 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 1.7870 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -0.3060 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -0.0350 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -5.1480 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -2.2410 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -2.2170 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 0.2070 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -1.3790 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 0.0020 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -1.3980 3.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -8.9190 3.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 2 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 2 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 M CHG 1 10 -1 M CHG 1 15 -1 M END