IBS-ZINC00507178 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2130 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.5660 0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0840 4.1580 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 4.1910 0.0030 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2340 -2.0390 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -2.6680 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -4.1880 -0.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6970 -4.4930 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -4.8900 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 -5.6730 1.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -5.4740 1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -6.0000 2.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -4.6430 1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9040 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 3.3480 -0.4910 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9700 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 -2.3620 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -2.3710 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -5.5470 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -4.1570 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 -6.2410 1.3700 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END