CHEMBRIDGE-ZINC04964617 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 0 0 0 0 0 0999 V2000 -2.0140 1.2080 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 0.0020 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -0.1380 1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 0.6490 2.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -1.2380 1.6410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -1.7240 2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -1.0980 3.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -1.6340 4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -2.8020 4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -3.4220 3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -2.9020 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -3.6030 1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -3.0470 0.2130 O 0 5 0 0 0 0 0 0 0 0 0 0 3.8190 -3.3650 5.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -4.7230 6.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 -5.2630 7.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 -4.4540 7.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5710 -3.0810 7.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 -2.5600 6.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5520 -2.1780 8.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2750 -2.7450 9.0250 O 0 5 0 0 0 0 0 0 0 0 0 0 6.3170 -4.9340 8.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4210 -6.2010 9.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 -7.1890 8.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4940 -6.2490 10.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6490 -7.6300 10.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 2.1360 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 1.2720 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 1.1410 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 -0.9100 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 0.0860 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -1.8390 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -0.1930 4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -1.1290 5.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -4.3240 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -5.3780 5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -6.3190 7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 -1.5040 6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9370 -4.1740 9.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4460 -5.9360 9.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2320 -5.5290 11.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9260 -8.3680 10.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4290 -7.6210 11.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7150 -7.9620 11.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 -4.6700 0.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5900 -0.9500 7.8170 O 0 0 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 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 45 2 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 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 46 2 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M CHG 1 13 -1 M CHG 1 21 -1 M END