IBS-ZINC04089868 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 29 0 0 1 0 0 0 0 0999 V2000 0.1330 1.6210 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 0.3070 0.3020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7200 0.5250 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -0.6380 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -0.0860 1.0660 P 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 1.0400 2.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -1.5350 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -1.2530 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3280 -0.5540 3.7000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7600 -1.0940 4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8310 -0.4720 4.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2690 0.7200 3.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 0.0350 -0.3300 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0770 -0.3020 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -1.2240 0.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 2.2050 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 2.2450 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 1.4470 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -0.8120 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -1.6140 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -1.8850 2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 -2.3320 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7620 -2.2180 2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 -0.6700 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3840 -1.5350 4.4720 O 0 5 0 0 0 0 0 0 0 0 0 0 4.7600 0.8300 3.6420 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3720 1.1570 4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 1.0040 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 1.4360 3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 0.2040 -0.7880 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 M CHG 1 13 -1 M CHG 1 25 -1 M CHG 1 26 1 M CHG 1 30 -1 M END