PUBCHEM-ZINC05131938 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 -0.5890 1.7470 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 0.2130 -0.1990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0230 -0.1590 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -0.4380 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -2.6710 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -2.1070 -2.3650 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9030 -2.6690 -3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 -1.1050 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -4.0210 -1.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -4.4970 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -4.6050 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -0.1200 0.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -1.0960 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 2.4820 -0.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2380 2.2760 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 4.0020 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 4.3530 0.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 2.0310 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 2.0930 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -0.1840 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -0.0860 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -1.9220 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -2.4210 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 4.6300 -1.0460 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6920 1.9980 0.6900 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6640 1.9250 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 1.1010 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 2.8000 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 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 12 1 0 0 0 0 4 20 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 9 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 22 23 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 6 1 M CHG 1 24 -1 M CHG 1 25 1 M END