PUBCHEM-ZINC04690995 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 2.0430 2.7370 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 1.3960 -0.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4770 1.6000 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 0.4900 -1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.9460 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 1.8200 -1.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.2230 -3.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 0.3610 -4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.4910 -5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -0.4140 -6.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 0.5150 -6.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 1.3680 -5.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 1.2900 -4.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 0.4880 -7.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 1.4220 -8.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 1.2130 -9.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1680 2.1600 -9.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 3.4200 -10.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0260 4.3060 -10.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3060 3.9440 -9.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5220 2.6960 -9.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4580 1.8080 -9.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 0.6760 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 1.4050 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 1.8210 2.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 2.5930 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 3.2610 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 3.4010 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 0.4020 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -0.5200 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -0.4880 -3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -1.2270 -5.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -1.0840 -7.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 2.1080 -5.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 1.9750 -3.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 1.2500 -7.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 2.4480 -8.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2830 1.3330 -10.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 0.1750 -9.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 3.7180 -10.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8560 5.2810 -10.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1350 4.6350 -10.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5190 2.4150 -9.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6400 0.8390 -8.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -0.3080 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 0.4930 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 1.4840 2.5260 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 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 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 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 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 M CHG 1 47 -1 M END