PUBCHEM-ZINC03612969 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.0090 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -0.4850 -2.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 0.0320 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -0.4410 -0.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0040 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -2.6820 -2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -4.0640 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -4.7690 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -4.0910 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -2.7090 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -6.2490 -1.2890 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3220 -6.8460 -2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -6.8700 -0.3740 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 1.0990 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.3420 -3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -0.2030 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -0.3190 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 1.1220 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 -0.1440 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -2.1310 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -4.5930 -3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -4.6420 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -2.1800 0.5960 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 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END