PUBCHEM-ZINC06621332 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.0060 1.4500 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -0.0500 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.4480 1.2130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4870 0.0450 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -0.0110 2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 0.2910 2.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.8940 1.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -2.8800 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -2.8580 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -4.0880 1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -5.2930 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -5.3000 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -4.0740 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -3.8410 1.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -2.5270 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -1.8470 1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 -1.8470 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -2.9160 3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -2.9360 4.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0720 -1.8930 5.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 -0.8310 4.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 -0.8080 3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 1.7940 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 1.6900 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 2.0160 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -0.3620 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -0.5630 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -1.9280 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 -4.0990 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -6.2340 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -6.2320 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 -2.3800 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -0.8280 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -3.7470 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -3.7730 4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 -1.9130 6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -0.0250 5.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 0.0170 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 0.0410 3.5250 O 0 5 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 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 7 8 1 0 0 0 0 7 15 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 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 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 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M CHG 1 39 -1 M END