PUBCHEM-ZINC00472864 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -1.0310 1.0920 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -0.2880 0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.5410 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 0.2940 -1.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -1.9840 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -2.9150 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -4.2680 -0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -4.6960 -1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -3.7780 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -2.4210 -2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -4.3030 -3.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -3.6070 -4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -2.3990 -4.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -4.5190 -5.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -4.0560 -6.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 -5.0050 -7.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1130 -6.2310 -6.9260 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1230 1.6790 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 1.4720 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 1.1770 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -2.6060 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -4.9920 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -5.7580 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -1.6830 -2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -5.3080 -3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -5.5820 -5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 -2.9950 -6.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -4.4310 -8.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 2 0 0 0 0 M CHG 1 17 -1 M END