IFLAB-ZINC05153773 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.3250 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.2030 -0.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5070 -0.6200 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.6580 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -0.5200 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -1.0960 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -1.8100 3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -1.9460 3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -1.3630 1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -1.4040 1.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -0.7490 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -0.6130 -0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -2.1100 1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -2.0860 3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -2.6960 3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -0.9540 3.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 -0.5280 5.1230 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -1.4340 5.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 -0.3560 5.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 1.0620 5.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 1.1700 5.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 2.4180 5.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 3.5560 5.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 3.4480 5.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 2.2010 5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.7020 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.6360 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.7260 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 0.0310 1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.2530 4.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -1.6090 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 -3.1420 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -1.0540 3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2620 -2.6490 3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -3.7420 3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -2.6290 4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3070 -1.1060 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 0.2810 5.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 2.5020 6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 4.5310 5.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 4.3380 4.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 2.1170 4.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 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 2 0 0 0 0 17 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 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END