IBS-ZINC05577847 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 1.8590 1.2050 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -0.2170 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -0.9640 1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -2.1960 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -3.2800 1.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -4.3320 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -5.3780 0.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -4.1980 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -4.9700 -1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -4.6830 -3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -5.7260 -4.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -5.4510 -5.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -4.1400 -5.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -3.1000 -5.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -3.3630 -3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -3.8730 -7.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -3.1740 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -3.2910 -2.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.0770 -0.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.9680 -1.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 1.2090 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 1.7120 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 1.7250 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -0.6790 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -5.7880 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -6.7440 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -6.2530 -6.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -2.0850 -5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -2.5550 -3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -3.6970 -7.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -4.1140 -3.3920 H 0 0 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 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 M END