PUBCHEM-ZINC06379153 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 0.1310 0.4840 1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 2.8020 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 3.1880 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 4.6170 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 4.9030 2.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 6.2140 3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 7.2400 2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 6.9540 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 5.6430 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 1.0740 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 1.7720 -0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6650 2.8490 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 1.4510 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 2.1940 -0.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3430 2.0220 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0800 2.7130 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4480 2.5370 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0830 1.6740 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3520 0.9850 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9820 1.1530 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5500 1.4880 -1.2700 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.1950 2.0940 -2.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1100 0.7280 -0.5010 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2800 1.3100 -1.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 0.6610 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 0.6470 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.5440 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 2.9060 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 3.4560 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 2.5330 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 3.0840 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 4.1010 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 6.4370 4.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 8.2640 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 7.7560 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 5.4190 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 1.4080 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -0.0050 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 0.3840 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 1.7220 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5840 3.3870 -2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0220 3.0740 -2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8500 0.3110 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4110 0.6110 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.3580 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.4080 1.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 45 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END