IBS-ZINC05151807 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 0 0 0 0 0 0999 V2000 0.1700 1.4050 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -0.0440 -0.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.7990 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -0.3060 0.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -2.2580 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -3.0380 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -4.4070 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -5.1960 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -6.6900 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -7.1400 -0.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1970 -7.4660 0.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -8.9290 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 -9.4890 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 -8.5900 0.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -2.8510 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -4.0670 -0.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -1.9360 -0.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.5500 -0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 0.1930 -0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -2.4510 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.7430 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 1.8400 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.7650 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -2.5890 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -4.9230 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 -4.9280 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -5.0020 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -7.0760 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -9.3090 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9320 -9.2350 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -3.5420 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -2.1090 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -2.0430 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 -10.7460 0.6560 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 M CHG 1 34 -1 M END