PUBCHEM-ZINC04845496 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 -0.2110 3.0910 -2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 1.8200 -2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 0.7420 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 0.9350 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 2.2050 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 3.2840 -1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 2.4520 -0.4710 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 3.7670 0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 1.2950 0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 2.4520 -1.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 1.3060 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 1.2510 -3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 0.1160 -4.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 -0.9660 -3.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 -0.9140 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 0.2210 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 -2.2730 -1.8310 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 0.0460 -6.0990 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -0.6190 -2.2340 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.7890 -2.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -1.5680 -1.7400 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7240 3.9320 -3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 1.6690 -3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 0.0930 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 4.2760 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 3.2490 -1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 2.0940 -4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 -1.8520 -4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 0.2630 -0.7610 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 29 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