IBS-ZINC04733398 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2460 -0.6510 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 0.1250 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 1.4390 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 2.0730 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -2.1200 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -2.7310 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 -4.1920 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -4.8570 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -4.8600 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -4.1000 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3240 -4.7300 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -6.1130 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 -6.8760 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -6.2590 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5660 -3.9240 -0.0910 N 0 3 0 0 0 0 0 0 0 0 0 0 7.5030 -2.7080 -0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6510 -4.4780 -0.1040 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9560 1.9120 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -0.5710 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -0.3580 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 3.1530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -2.7100 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 -2.1410 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 -3.0220 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3650 -6.5980 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 -7.9540 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -7.0070 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -7.2230 -0.9300 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 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 16 2 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END