IBS-ZINC02112569 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.6410 0.7510 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 1.1400 2.4920 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3380 0.0630 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.5550 3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 3.0570 3.8650 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0490 3.6330 4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 3.5630 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 2.9960 1.3130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1490 3.3480 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 3.1890 1.3500 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2390 3.1790 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 1.9890 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 4.4120 1.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 4.4910 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 3.3130 4.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 3.3400 6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 3.1440 6.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 3.6030 7.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2000 2.7440 7.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 4.8820 6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 4.6400 5.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 4.2940 4.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 3.6700 8.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 2.6980 9.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 2.7450 10.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 3.7620 11.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 4.7340 10.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 4.6900 9.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -0.3150 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 0.9540 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 1.0990 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 0.9690 3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 1.2960 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 3.3010 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 4.6600 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 2.2760 3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 1.4070 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 5.2340 7.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 5.6970 6.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 1.8940 9.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 1.9870 11.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 3.7970 12.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 5.5260 10.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 5.4550 8.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 1.4840 1.3950 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8050 1.2450 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 2 45 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END