IBS-ZINC04816297 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 28 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.2080 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0170 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 1.3960 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 3.5660 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 4.3100 0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 4.0630 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 5.6170 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 6.8180 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 7.9690 0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 8.0460 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 6.9120 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 5.6680 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 4.3630 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.1620 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1710 -2.7810 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -2.7620 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9580 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 3.3400 -0.5190 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 1.9410 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 6.8030 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 9.0170 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 6.9880 -0.0070 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 17 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 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END