PUBCHEM-ZINC05647643 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.2990 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0040 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -0.4290 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 0.7040 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 1.7750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 3.1850 0.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5150 3.3350 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 3.6530 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 4.2850 -1.9370 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3120 3.7480 -2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 4.1250 -0.7510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8900 3.2200 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 4.0190 0.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 5.3500 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 5.1320 0.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 5.6670 -2.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 0.5280 -0.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 1.3060 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 -0.6440 -0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -1.7370 -0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -1.7320 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -2.7720 -0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 1.9090 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 4.3950 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 2.8030 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 6.2260 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 5.5120 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 5.8700 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 5.8260 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 M END