IBS-ZINC04140847 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2020 -0.6840 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 1.4250 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 1.8800 -0.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0240 2.4650 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 0.6750 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -0.3980 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 -1.5530 -0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 2.6800 -1.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9640 3.7600 -1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 4.0740 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4720 5.1400 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7240 5.8960 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 5.5880 -2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 4.5180 -2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 4.2120 -3.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6640 7.0360 -0.9690 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2160 7.3090 0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8860 7.7030 -1.9640 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.7640 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 2.4620 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 3.4860 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9630 5.3840 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2960 6.1810 -3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 4.6620 -3.6080 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 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 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 27 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 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 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 30 1 0 0 0 0 18 19 1 0 0 0 0 19 31 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END