PUBCHEM-ZINC05833931 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 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 0 0 0 0 0 0 0 0 0 0 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -0.0920 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 0.6120 -0.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 -0.4920 -2.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 -0.0790 -2.6200 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4330 -0.4960 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 -0.5880 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 -2.0950 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 -2.8020 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 -4.1870 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -4.8150 -1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9820 -4.0380 -2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 -2.7220 -2.0440 N 0 3 0 0 0 0 0 0 0 0 0 0 5.0570 -6.1720 -1.5550 O 0 5 0 0 0 0 0 0 0 0 0 0 4.1200 1.4250 -2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 2.0940 -2.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 2.0270 -3.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 3.4890 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1850 3.9130 -4.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 5.4400 -4.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 5.9710 -3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 5.5480 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 4.0210 -1.9550 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 0.2320 -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 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -1.0540 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 -0.2070 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -0.2430 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 -2.2800 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -4.7640 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8220 -4.5150 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 -2.2000 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 1.4920 -3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 3.8970 -3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1830 3.5050 -4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7870 3.5340 -5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9140 5.7420 -5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 5.8480 -4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8170 5.5640 -2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8740 7.0590 -3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 5.9270 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 5.9560 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 3.7190 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8240 3.6130 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 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 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 M CHG 1 17 1 M CHG 1 18 -1 M END