PUBCHEM-ZINC02904719 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 1.7940 1.4500 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 0.0630 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6890 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -0.0480 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 1.3450 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 2.0980 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 3.5550 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 4.2300 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 5.7090 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 6.4020 0.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 6.1530 -0.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 5.1900 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 5.3910 -1.5450 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 3.5950 -0.3840 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 7.5920 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 8.0180 -2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 7.1120 -2.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -0.8250 2.7220 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3240 -0.2260 3.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -2.0510 2.7600 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3900 2.0220 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -0.4280 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 1.8530 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 4.1000 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 7.8720 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 8.1600 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 9.2370 -2.3920 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4450 -2.0390 0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -2.4630 1.6120 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M CHG 1 27 -1 M END