IBS-ZINC04825631 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 4.0680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 5.4820 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 6.1310 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 6.1180 -1.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 5.4560 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 4.0450 -1.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 3.9310 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 5.8590 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 5.7090 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 6.5990 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 6.5770 -2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 5.8400 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 5.6630 -1.7110 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 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END