CHEMBRIDGE-ZINC00471669 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 0 0 0 0 0999 V2000 0.0800 1.3860 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -0.1330 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1240 -0.3940 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -0.7860 1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -1.5720 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -2.1700 3.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -1.9830 3.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -1.1970 2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -0.6020 1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -2.6230 4.6020 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6460 -3.3140 5.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -2.4570 4.8380 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6250 -0.6160 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -1.4120 -1.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.1640 -2.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -0.5250 -3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -0.6830 -4.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -1.0400 -5.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -1.2310 -5.8480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 -1.0920 -4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -0.7310 -3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 1.6470 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 1.8580 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 1.7360 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -1.7180 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -2.7840 3.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 -1.0500 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 0.0090 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 0.4120 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -0.5280 -4.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -1.1650 -6.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -1.2580 -4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -0.6140 -2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END