OTAVA-ZINC05374510 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 0 0 0 0 0999 V2000 0.1480 1.4160 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 0.0300 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -0.7370 -1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -0.0620 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 1.3270 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 2.0760 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 1.6530 -1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 0.4730 -1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 -0.5530 -1.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 -1.5320 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 2.9710 -1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 3.3890 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 4.8190 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 5.6810 -1.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3390 5.0380 -0.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9260 3.9750 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9670 2.5010 -0.4740 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1680 3.7880 0.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2000 4.7160 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3920 4.2470 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4640 5.1030 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3500 6.4440 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1830 6.9550 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1140 6.0800 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1260 8.4210 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1970 9.0560 0.3270 O 0 5 0 0 0 0 0 0 0 0 0 0 13.4110 7.2800 1.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 1.9930 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -0.4640 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -1.8160 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 3.1570 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 0.2620 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 3.7340 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3820 2.8370 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5010 3.1970 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3750 4.7270 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2190 6.4960 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0980 8.1960 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0790 8.8930 -0.5150 O 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 39 2 0 0 0 0 27 38 1 0 0 0 0 M CHG 1 26 -1 M END