IBS-ZINC02290804 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.8580 2.4640 -1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 1.1720 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 0.1470 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 0.4040 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 1.7060 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 2.7300 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -0.7050 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -1.1910 -1.4570 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0030 -0.3620 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -2.1240 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 -3.3600 -0.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -1.9280 -2.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 -1.3510 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 -0.1640 -3.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -2.2900 -4.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -2.0830 -5.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -0.7880 -5.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -0.5780 -6.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -1.6610 -7.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -2.9710 -7.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -3.2100 -6.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -4.5690 -5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -5.6240 -6.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -5.3600 -7.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -4.0420 -7.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 3.2600 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 0.9610 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -0.8580 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 1.9230 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 3.7340 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 -0.3360 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 -1.5500 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -2.9260 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -3.2310 -3.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 0.0930 -5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 0.4350 -7.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -1.4710 -8.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -4.8450 -4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -6.6510 -6.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -6.1770 -8.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -3.8570 -8.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4740 -1.5490 -0.1880 O 0 5 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 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 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 1 42 -1 M END