IFLAB-ZINC05044078 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 -0.2510 1.4360 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -0.0060 0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -0.6230 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 0.0190 2.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -2.1180 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -2.5440 2.2800 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0930 -2.1580 3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -4.0460 2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -4.6530 2.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -4.7410 2.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -4.1480 1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 -2.7090 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -2.0130 2.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -0.9360 2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 -0.2640 2.5240 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -0.3900 3.7610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 0.6210 4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 1.0370 4.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 1.2320 5.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 2.3320 6.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 3.6290 5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 4.6380 6.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 4.3520 7.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 3.0540 8.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 2.0460 7.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 5.6190 8.4270 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 1.8970 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 1.8080 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 1.6850 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -2.6080 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -2.4060 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -5.7080 2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 -4.1510 2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -4.7380 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 -2.2050 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -2.7110 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -0.7230 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 1.6440 5.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 0.4670 6.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 3.8520 4.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 5.6510 6.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 2.8300 8.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 1.0340 7.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END