IBS-ZINC01816076 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.5200 1.8420 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 1.9540 -2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 1.3620 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 0.6300 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 0.5240 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 1.1270 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 0.0160 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 0.1700 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 -0.7410 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3280 -0.2290 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3580 -1.0910 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1550 -2.4620 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9160 -2.9770 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 -2.1300 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 1.4130 1.1700 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 2.7240 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 3.9390 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3890 4.9610 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 4.7850 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0620 3.5810 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 2.5500 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1120 6.0760 -1.0050 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 -0.7890 -2.2880 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0210 -1.2970 -2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -0.9970 -3.3890 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4410 2.3190 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 2.5130 -3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 1.4500 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 -0.0310 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 1.0490 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4890 0.8390 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3280 -0.6990 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9680 -3.1320 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 -4.0460 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 -2.5330 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0310 4.0770 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4370 5.9010 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6330 3.4490 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2410 1.6110 -1.1440 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END