PUBCHEM-ZINC02679922 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 -0.2970 -1.4160 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -0.4440 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 0.9860 -1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -0.7850 -0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -0.5620 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -0.0340 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 1.4960 -0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -0.4960 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -0.0630 -2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -0.6220 -3.8820 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4900 -1.7090 -3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -0.2170 -4.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 -0.8340 -5.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 -0.5760 -6.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 -1.1420 -7.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1100 -0.8780 -7.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9940 -0.0500 -7.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6340 0.5150 -5.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3890 0.2580 -5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3260 0.2300 -7.7690 N 0 3 0 0 0 0 0 0 0 0 0 0 10.6440 -0.2680 -8.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1050 0.9590 -7.1810 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6110 -0.0960 -4.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -0.9690 -3.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -2.3430 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -1.6300 -3.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 1.1580 -2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 1.6900 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 1.1300 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -1.8040 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -0.0920 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -0.7010 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 0.0240 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -1.6070 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 1.8640 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 1.8850 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 1.8270 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 -1.5790 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -0.0170 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -0.2240 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0650 -0.3930 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 1.0260 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 0.8660 -4.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 -0.5420 -3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1770 -1.7900 -7.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3930 -1.3190 -8.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3260 1.1610 -5.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1080 0.7040 -4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 0.8690 -4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -0.5510 -2.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -1.5590 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 50 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END