IBS-ZINC02256542 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 0.1160 1.5310 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 0.0010 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -0.4700 -1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -1.8050 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -2.5560 -0.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.3520 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -1.5330 -3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -2.2420 -4.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -3.9620 -4.2390 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -3.6960 -2.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -4.6970 -1.9230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -5.9940 -2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -6.9930 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -8.4090 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -8.7380 -2.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -9.3300 -0.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -8.9810 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -10.2180 1.4790 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -7.7150 0.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -6.6880 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -5.5420 0.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 -1.6520 -5.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 1.8940 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 1.9050 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 1.8840 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -0.3730 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -0.3620 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -0.4530 -3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -4.4690 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -6.2490 -3.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -10.2660 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -7.5320 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -1.5160 -5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -2.3250 -6.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -0.6880 -5.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 20 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 31 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 M END