IFLAB-ZINC04031706 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 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 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5470 -1.7850 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -0.3040 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 -0.4850 -2.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6880 0.2630 -0.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 0.4420 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1730 0.9900 0.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3950 1.0990 2.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5060 1.6440 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7580 1.7670 3.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8710 2.3130 4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6900 2.2240 5.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4940 1.6360 6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9310 1.3670 4.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -0.2030 1.3780 S 0 0 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 1.2230 -1.7590 -0.0180 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 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2810 0.5530 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2370 2.0030 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7240 2.7310 3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3800 2.5610 6.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0580 1.4220 7.0590 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 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 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 M END