IFLAB-ZINC02698119 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 0 0 0 0 0 0999 V2000 -0.4790 1.2840 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 0.9000 1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 3.1280 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 3.5590 1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 4.9940 2.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 5.5990 3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 4.6910 4.0440 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 6.9190 3.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 7.5680 4.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 8.5020 5.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7140 9.1450 6.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0820 8.8580 6.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 7.9190 5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 7.2840 4.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 9.5440 6.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5590 10.3600 7.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 0.2150 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 1.5030 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 1.8340 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 1.0510 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -0.1560 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 1.2210 2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 3.6830 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 3.3320 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 3.3550 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8270 3.0040 2.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 5.5080 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 7.4170 2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 8.7230 5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 9.8700 6.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6390 7.6950 5.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 6.5620 3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 1.6890 0.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3140 9.2670 6.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8730 9.7420 7.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 33 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 29 1 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 15 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 34 35 1 0 0 0 0 M END