IFLAB-ZINC04062980 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0920 1.2330 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -0.1830 0.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -0.7970 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -0.0560 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 -0.6800 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -2.0470 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -2.8070 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -2.1840 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -2.9810 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -3.4580 0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -3.1820 -1.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -3.8430 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -4.6500 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 -5.3030 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 -5.1540 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 -4.3430 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -3.6880 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 -5.8540 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 -5.7810 -0.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5400 -6.4770 -0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6610 -6.5680 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7260 -7.3530 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6770 -8.0330 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 -7.9390 -2.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5720 -7.1970 -1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -6.9090 -2.5910 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -4.1490 -0.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9560 -4.7130 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 1.5970 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 1.7120 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 1.4700 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 1.0130 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 -0.0950 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 -2.5240 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -2.8680 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -4.7650 -3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -5.9310 -3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 -4.2250 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -3.0560 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 -6.0320 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5940 -7.4390 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5130 -8.6480 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -4.5100 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 -4.2690 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -5.7900 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 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 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 M END