IBS-ZINC04811671 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 26 0 0 0 0 0 0 0 0999 V2000 -0.5250 -0.3740 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -0.1580 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 0.5340 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 1.2480 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 1.3960 2.4700 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2700 -0.7610 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.0810 -2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 1.3710 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 1.9280 -3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 3.3050 -3.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 4.0830 -3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 3.5870 -2.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 2.2430 -1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -2.3230 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -2.8070 -2.3860 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9740 0.5800 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -1.0030 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -0.8700 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.6090 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.6360 -3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 1.2950 -4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 3.7570 -4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 5.1600 -3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 1.8770 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 1.6350 1.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -2.9500 -0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 25 2 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 26 2 0 0 0 0 M CHG 1 5 -1 M CHG 1 15 -1 M END