PUBCHEM-ZINC02165044 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0320 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4210 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 2.1830 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6260 3.4010 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 1.5920 -0.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9390 -0.8260 -0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 -2.5690 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 -3.4600 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 -4.9290 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 -5.9860 -0.0790 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 -5.8720 -1.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 -5.8830 1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -2.7790 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -2.7710 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 -3.2490 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2810 -3.2580 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 -5.1400 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -5.1310 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -7.4050 -0.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -8.0910 -0.0900 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 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 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 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 27 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END