IBS-ZINC06757511 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.2380 1.2120 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -0.1390 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -1.0450 1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -2.4870 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -2.8910 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -4.5670 -0.2390 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -4.7850 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -3.6050 2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -3.5850 3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -4.7160 4.0090 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3160 -6.0090 1.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -7.2330 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -7.5450 0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -8.3460 2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -8.6930 2.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -8.8660 3.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -9.8810 4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -9.4190 5.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -9.0000 5.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -7.9680 4.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -8.4670 3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -1.9840 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -0.7030 -0.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 0.1220 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 1.7200 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 1.8730 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 1.0820 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -0.7240 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -0.9510 2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -5.9160 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -10.8000 3.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -10.1030 4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -10.2200 6.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -8.5660 5.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -9.8830 5.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -8.5860 6.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -7.7490 4.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -7.0320 4.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -7.6990 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -9.3510 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -1.8410 -1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -2.3850 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.6820 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -0.8060 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 0.6930 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -2.4850 4.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 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 9 10 1 0 0 0 0 9 46 2 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 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 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M CHG 1 10 -1 M END