IFLAB-ZINC04243467 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0030 1.5600 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 0.2720 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -0.4430 -0.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 0.1370 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 1.4560 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 2.1650 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 1.9530 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 1.2110 -0.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 -0.0200 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 -0.5980 -0.9630 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 3.2090 0.5490 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 3.9080 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 5.3750 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 6.0740 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 5.2800 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 3.8290 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 7.5580 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 8.1050 -0.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 2.1430 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -0.2330 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3950 -0.6020 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 3.8440 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5730 3.4640 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 5.8900 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2350 5.4290 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 6.0790 1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 5.7280 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 5.3130 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 3.2910 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 3.8060 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 8.0800 1.3490 O 0 5 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 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 17 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 15 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 M CHG 1 31 -1 M END