PUBCHEM-ZINC05632668 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.1360 1.3600 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.1470 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -0.7330 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -0.8010 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -0.1880 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -0.7880 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -2.0010 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -2.6140 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -2.0170 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.3930 -1.2720 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7680 0.1280 -1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 0.0720 -2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -0.3880 -3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -0.4380 -5.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -0.0320 -5.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 0.4260 -4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 0.4850 -3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -0.0840 -6.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 0.3480 -7.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -1.2020 -2.2210 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8450 1.8330 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 1.7770 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 1.5430 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -0.5500 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -1.8060 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 -0.2600 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 0.7600 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 -0.3090 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 -2.4700 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -3.5620 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -2.4980 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 0.6040 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -0.7050 -3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -0.7940 -6.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 0.7400 -4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 0.8460 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.3890 -6.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7140 -0.2700 -6.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 0.2560 -8.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 M CHG 1 10 1 M CHG 1 20 -1 M END