CHEMBRIDGE-ZINC04913459 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.1640 1.1030 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -0.4140 -0.0460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5690 -0.9080 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.8140 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -0.6320 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -0.2340 1.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0240 0.8520 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -0.8100 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 -0.7470 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.5180 3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 0.3370 3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 1.7150 3.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 2.6150 4.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9320 2.1810 4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9560 3.0980 4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 4.4470 4.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 4.8820 4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 3.9690 4.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 4.4360 4.0860 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6770 5.6250 4.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 3.6300 3.9680 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2110 1.4050 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 1.3880 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 1.5980 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -1.8990 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -0.4640 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -0.1500 3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -1.7150 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 -0.3110 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 -0.4640 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 -1.8330 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -1.5730 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.3050 4.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 0.0410 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 0.1920 2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 1.1280 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9820 2.7610 4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 5.1630 4.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 5.9360 4.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.2040 2.3920 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 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