PUBCHEM-ZINC03030586 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3300 0.0090 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 1.6660 -0.5740 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 1.0780 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 1.9310 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 3.6800 0.0070 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 4.2990 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 5.8290 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 6.3510 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 7.8580 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 8.4530 0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 1.4670 -0.0250 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5600 0.6100 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0060 2.6450 -0.0210 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9340 1.8980 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -0.6380 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 3.9440 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 3.9360 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 6.1830 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 6.1920 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 5.9970 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 5.9880 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 8.5390 0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 9.5040 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END