PUBCHEM-ZINC04096465 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -0.1110 1.5000 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 0.0200 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -0.5050 1.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -0.6780 -0.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -2.1420 -0.1860 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0730 -2.5410 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -2.6980 -1.6300 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6580 -2.0850 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -4.1080 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -4.7200 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -4.0830 0.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -2.6410 0.5570 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1280 -2.3210 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -2.1380 2.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4990 -1.0510 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -2.7640 2.7300 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5690 -3.8560 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -2.4190 4.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8610 -2.9230 4.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 -2.8660 5.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 -2.2860 2.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 -2.5690 2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.4090 2.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -1.7400 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -6.2200 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -6.8710 -1.6780 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3030 -2.6350 -2.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 1.9120 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 1.7130 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 1.9750 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -0.1710 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -4.6470 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 -2.8770 4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -1.3360 4.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -3.3320 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -6.6130 0.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 36 2 0 0 0 0 27 35 1 0 0 0 0 M CHG 1 26 -1 M END