PUBCHEM-ZINC05116664 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 -0.6670 1.3520 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 0.0110 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -0.7090 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -0.4620 2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -1.4500 3.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -2.6420 2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -2.8480 1.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -1.9340 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9060 -0.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -0.7680 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -0.4150 -2.3870 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0320 -1.2290 -3.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.7980 -4.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 0.5710 -4.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 0.9990 -6.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 0.0780 -7.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -1.2790 -6.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -1.7230 -5.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 0.8450 -2.6340 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1550 -1.2380 4.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 -2.2290 5.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -2.0260 6.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -0.8430 7.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 0.1440 6.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -0.0450 5.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 2.0970 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 1.4530 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 1.5030 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 0.4690 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -3.4080 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 1.2910 -4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 2.0560 -6.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 0.4190 -8.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -1.9920 -7.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -2.7820 -5.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -3.1530 5.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -2.7930 7.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -0.6890 8.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 1.0660 7.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 0.7280 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M CHG 1 11 1 M CHG 1 19 -1 M END