PUBCHEM-ZINC05561194 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.4740 -1.9570 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -0.8880 -0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 0.4520 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 1.0320 -0.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 1.7550 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 1.9680 -2.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 2.2790 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 3.0450 -2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 3.6230 -1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 3.7340 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0730 4.2780 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 4.7160 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 4.6130 -2.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 4.0640 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 3.9570 -3.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0230 4.4260 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4870 4.2270 -6.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7450 5.2250 -6.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 5.0430 -8.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5050 3.8640 -8.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2480 2.8660 -8.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7430 3.0500 -6.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 3.6680 -10.2150 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3220 4.5470 -10.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 2.6290 -10.8100 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0650 1.6830 0.4480 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 0.8400 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 0.2060 1.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -2.9140 -1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 1.0900 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 0.3760 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 3.2280 -3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 3.3940 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3460 4.3630 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 5.1410 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2990 4.9570 -3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2130 5.4860 -4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9520 3.8670 -4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 6.1460 -6.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 5.8220 -8.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 1.9450 -8.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3270 2.2720 -6.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END