PUBCHEM-ZINC05856011 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 0.5330 1.8980 -0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 0.3860 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -0.2990 -1.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -1.6400 -1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -2.2230 -0.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -2.4190 -3.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -3.8940 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -4.5820 -2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -5.9350 -2.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -6.6010 -2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -5.9130 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -4.5590 -2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -3.8220 -3.3250 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9110 -4.4250 -3.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -2.6120 -3.4580 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2770 -8.0500 -1.8930 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2650 -8.6560 -1.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -8.6360 -2.0300 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5690 2.2050 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 2.1530 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 2.4120 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 0.1300 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 0.0780 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -2.1940 -3.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.1420 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -4.0620 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -6.4720 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -6.4330 -2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 16 1 M CHG 1 18 -1 M END