PUBCHEM-ZINC05500894 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 24 0 0 1 0 0 0 0 0999 V2000 -0.5100 1.9730 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 0.5770 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 -0.5870 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -0.3010 -1.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 2.1040 0.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6260 1.5170 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 3.5640 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 4.1990 -0.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 4.0600 1.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 5.4260 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 5.6400 3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 4.5950 3.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 2.2550 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 2.6810 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 0.3390 1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 0.6030 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 3.5090 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 5.5960 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 6.1130 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -1.6850 0.4840 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4580 6.8040 3.5030 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0480 1.5500 -1.3400 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4940 0.6130 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 1.3370 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 2.1710 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 M CHG 1 20 -1 M CHG 1 21 -1 M CHG 1 22 1 M END