PUBCHEM-ZINC05978026 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 0.4200 1.1310 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -0.2350 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.9450 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -2.3180 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -3.0030 -0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -4.3890 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -4.7500 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -6.0840 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -6.5690 2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5460 -6.0150 2.7980 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2230 -5.3520 3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1980 -7.2600 3.4500 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8120 -6.9920 4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 -8.1820 3.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -7.9060 2.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -8.6540 2.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0280 -7.9910 2.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8550 -7.4910 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4920 -5.2650 1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6850 -4.6480 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6980 -3.4570 3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5070 -2.5700 3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2500 -1.5930 2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -0.8580 2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 0.0340 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2970 0.1940 0.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 1.6200 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 1.0430 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 1.7770 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -0.8460 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -0.1140 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 -0.3260 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -1.0640 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -2.9440 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -2.2050 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -2.3890 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -3.0800 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -5.1170 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 -3.9930 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -6.7270 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -7.8940 4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3440 -9.2370 3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9690 -4.4700 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8500 -5.9310 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6270 -5.1850 2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6430 -3.0920 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6680 -2.0130 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6130 -3.1780 3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -2.1280 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0750 -0.8720 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 -0.2350 3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1290 -1.5900 2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 0.5160 1.4440 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 M CHG 1 53 -1 M END