PUBCHEM-ZINC04556701 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 33 0 0 1 0 0 0 0 0999 V2000 0.5870 0.5790 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -0.1350 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 0.6710 1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -0.3560 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -1.2070 -0.3840 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8280 -0.7770 -1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -1.4040 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -1.3650 1.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -1.8870 -1.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 -3.0370 -1.1200 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5830 -2.9620 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 -3.0480 -2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -2.7920 -3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4830 -3.3870 -4.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -4.3680 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -4.1890 -0.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 0.7920 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -0.0370 -1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 1.5290 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -1.1060 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 0.1560 2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 0.8050 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 1.6640 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -0.8170 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 0.6190 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -1.5820 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 -3.9900 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5750 -2.2430 -2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -1.9670 -3.5660 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.7810 -5.4430 -0.9560 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2800 -2.5700 -0.4530 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0050 -2.9450 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -2.6660 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -3.3190 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 31 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 26 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 M CHG 1 29 -1 M CHG 1 30 -1 M CHG 1 31 1 M END