IBS-ZINC05426144 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 0.5490 -1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 0.0340 1.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.5500 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -1.5460 2.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 0.0340 3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -0.8130 4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 -0.2290 5.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 0.6250 6.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 0.9380 7.7870 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 1.5370 8.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 0.2750 7.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -0.4800 6.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 -1.2580 5.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9330 -1.2800 6.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1800 -0.5340 7.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1860 0.2350 8.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 0.8310 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 1.0550 3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 0.0410 3.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -1.8330 4.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -0.8200 4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 1.0090 6.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5170 -1.8410 4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7220 -1.8820 5.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1590 -0.5620 7.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 0.8130 8.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 -0.5470 -2.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -0.2680 -3.2410 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 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 8 9 1 0 0 0 0 8 30 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 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 40 41 1 0 0 0 0 M END