IBS-ZINC05477863 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 0.4520 1.2940 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.1730 -0.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0350 -0.2320 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -0.9020 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -1.8400 -1.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.7890 1.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -1.3070 2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -1.2920 2.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -1.8800 3.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -2.4730 4.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -2.8890 5.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -2.4900 5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 -3.0890 6.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -3.9060 7.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -3.8160 6.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -4.5390 6.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -5.3390 7.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -5.4260 8.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -4.7220 8.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 -2.8950 6.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -1.6520 2.5160 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -0.8420 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -0.2480 -0.2090 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 1.3530 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 1.7530 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 1.8220 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -2.6360 4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -1.8030 4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -4.4730 6.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -5.9010 8.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -6.0560 9.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -4.7960 8.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 -2.0600 7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 -3.8010 7.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 -2.6810 5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -0.5080 -2.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -1.0070 -3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 36 37 1 0 0 0 0 M END