IBS-ZINC02241694 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3160 0.0090 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 1.3030 -0.7810 -0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1410 -0.0880 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -1.7270 -1.2220 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0770 -2.4840 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.3760 -1.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -1.9180 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -2.7410 -1.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -3.7350 -1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -3.5510 -2.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -0.7580 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -0.9410 -2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -1.1390 -3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 -0.2930 -4.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 0.5940 -4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 0.3750 -3.0880 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -1.5810 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -2.7900 1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -0.9540 2.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -1.7320 3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -0.8000 4.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -0.4650 5.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 0.3900 6.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 0.9100 7.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 0.5730 6.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -0.2850 5.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8680 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8430 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -4.5580 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.4920 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -1.9030 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 -0.3450 -5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 1.3300 -5.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 0.0120 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -2.4270 3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -2.2900 3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -0.8700 5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 0.6530 7.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 1.5780 7.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 0.9790 6.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 -0.5500 4.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 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 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 M END