CHEMDIV-ZINC02944600 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.9010 0.9780 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -0.3450 0.2100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8750 -1.1670 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -0.4540 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -1.4390 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.9560 1.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -1.6960 -0.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1890 -2.6530 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.5420 -1.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3750 0.3680 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.9300 -2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 0.2720 -2.9530 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1850 1.1670 -3.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 0.2720 -3.0680 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0630 -1.6560 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -3.0130 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -4.0170 -1.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 1.8260 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 1.0080 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 1.1210 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 0.4930 1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -0.8340 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -1.3350 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -1.6640 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -1.3470 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -0.9210 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0310 -2.9530 -1.2650 O 0 5 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 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 27 -1 M END