IBS-ZINC04828230 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.9430 1.2890 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -0.0630 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -0.5720 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 0.2710 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 1.6220 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 2.1320 -1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -0.2840 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 -0.6820 -1.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 0.1840 -2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 1.3270 -1.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0930 -0.3360 -3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9620 0.3180 -4.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4370 1.6590 -3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 1.9460 -2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2450 3.2080 -2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3350 4.1940 -3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9790 3.9250 -4.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5350 2.6610 -4.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6290 3.5110 -0.9090 N 0 3 0 0 0 0 0 0 0 0 0 0 7.5510 2.6470 -0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0230 4.6250 -0.6140 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5360 -2.0170 -3.6270 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -1.9250 -2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -3.1860 -1.5530 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 1.6860 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -0.7210 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -1.6280 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 2.2800 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 3.1880 -1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 0.4780 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -1.1530 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3030 -0.1490 -5.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 1.1810 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6850 5.1800 -3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0520 4.7000 -5.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1910 2.3940 -6.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2610 2.5650 -6.4240 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END