PUBCHEM-ZINC04214787 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.6290 1.4440 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -0.0170 -0.4770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5850 -0.3670 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 0.3410 0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 0.1110 -0.3660 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0550 -0.9680 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 0.3950 -1.6940 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7940 1.4570 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -0.4230 -1.6610 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0580 -1.4770 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -0.4210 -2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -1.1340 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -0.8740 -0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -1.2890 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 0.0670 -2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 0.7400 -2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0140 0.3950 -1.5950 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0740 -0.7030 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 0.8460 -0.3250 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0320 0.3960 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 0.8140 0.9430 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0120 0.3060 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 0.4930 -0.3690 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2290 0.9830 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 0.9100 -1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 2.2080 1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1850 2.4060 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 2.3820 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 2.1640 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 1.6980 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 1.6190 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -0.0930 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -1.4520 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 1.4120 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -0.0280 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 0.5970 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -0.9580 -3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 -0.7180 -2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -2.2130 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -1.0190 -3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 0.3810 -3.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 0.3950 -3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1640 1.8240 -3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 0.7920 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 -0.6990 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9720 0.5350 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4740 2.0030 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 2.6970 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 2.9340 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 2.7440 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5360 -0.9760 -0.4430 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6860 -1.5560 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 -1.2760 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0370 -1.2080 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 13 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 7 1 0 0 0 0 5 19 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 51 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 51 54 1 0 0 0 0 M CHG 1 51 1 M END