CHEMBRIDGE-ZINC04913326 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.5120 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -2.4550 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -1.9270 0.0390 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4720 -2.2280 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5000 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -2.5020 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -2.5130 2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -4.0300 2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -4.3320 1.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -5.6460 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -6.0110 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 -7.3470 -0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 -8.3200 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -7.9590 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -6.6240 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 -9.7510 0.0250 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9640 -10.0700 -0.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -10.6080 0.7460 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -0.1840 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -0.1150 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -2.0890 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -3.5450 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -3.5900 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 -2.1260 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -2.1990 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -2.2800 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 -2.0590 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -4.4360 3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -4.4750 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -5.2510 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 -7.6320 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -8.7200 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -6.3420 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -1.9810 1.2700 N 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 8 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END