IBS-ZINC00509885 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.5930 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 4.0950 1.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9940 3.6710 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 5.6100 1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 6.3260 1.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 5.9950 2.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 4.9450 2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 5.0790 3.2760 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 3.7690 2.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 7.3910 2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 7.6120 3.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 9.0700 4.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 9.3850 3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 9.1640 1.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 7.7060 1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -2.0390 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -0.4910 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9700 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 3.9720 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 3.9450 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 2.8830 2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 8.0470 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 6.9560 4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 7.3880 4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 9.2280 5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 9.7260 3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 8.7290 3.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 10.4240 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 9.3880 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 9.8200 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 7.5480 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 7.0500 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -2.4280 -0.9060 H 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 M END