CHEMBRIDGE-ZINC04312071 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 0.1080 0.5130 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 0.8520 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 0.4090 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -0.3850 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -0.7230 1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -0.2720 1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 -0.8630 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 0.0250 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 1.5280 -0.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3650 1.7910 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3850 2.0260 -0.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2330 0.9860 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4260 1.0700 -0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -0.2840 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 -1.3990 -0.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 3.3580 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9300 3.7870 -0.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0810 5.0900 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 5.7960 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 4.6710 -0.5540 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 2.1110 1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 2.5880 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 3.1220 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 3.1800 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 2.7020 3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3450 2.1640 2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 3.7530 4.7720 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9380 4.1740 4.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 3.8040 5.7480 O 0 5 0 0 0 0 0 0 0 0 0 0 4.3930 -2.1700 0.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 0.8670 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 1.4640 -1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 0.6740 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -1.3360 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.5320 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0380 5.5480 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8670 6.8690 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 2.5420 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 3.4950 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 2.7480 4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 1.7870 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -2.3880 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 42 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END