IBS-ZINC00545317 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 1 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0330 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -0.6870 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 0.0140 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1900 -0.6140 -0.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8020 -0.1410 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -2.0390 -0.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8970 -2.7200 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 -3.9620 -0.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 -4.1120 -0.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 -2.9840 -0.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 -2.0880 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8380 -0.4210 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0310 0.2710 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 0.4480 2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0270 -0.0660 3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 -0.7570 3.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2370 -0.9300 2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6640 0.1230 5.0900 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7160 0.7310 5.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1370 -0.3300 6.0900 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9850 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 1.0920 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -2.5930 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 0.6730 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5580 0.9880 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3670 -1.1590 4.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 -1.4670 2.3550 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END