IBS-ZINC02198458 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.3030 1.0460 -1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -0.2540 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -0.7640 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -0.0280 -0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5470 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5560 -1.8010 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -2.5410 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0290 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -2.7800 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -4.1240 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -4.6900 0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -4.9240 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -6.6860 0.2640 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -7.3630 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -8.7670 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -9.8400 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -11.0580 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -10.9870 0.6440 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -9.2360 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -8.3560 0.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -7.0670 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 -6.5720 0.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -12.3440 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -12.0010 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -10.8890 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -9.5840 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 1.3320 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 1.0330 -2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 1.7660 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 0.9520 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0280 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4380 -2.2020 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 -3.5200 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -2.3330 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -4.7420 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 -4.6220 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4970 -6.3890 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -12.8430 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -13.0000 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -12.8850 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -11.6600 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -11.1540 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -10.7630 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -9.2350 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -8.8300 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 2 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 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 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END