PUBCHEM-ZINC04557044 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.1610 1.4430 -0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -0.0210 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.7540 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -2.1880 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -2.8130 0.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -2.7910 0.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -2.0470 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -0.6830 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -0.0240 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -0.7150 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 -2.0810 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -2.7490 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -2.8680 0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 -2.2070 0.0560 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1640 -1.4510 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1810 -3.2810 0.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.0600 -3.8030 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5740 -2.6360 0.1480 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.7290 -1.9450 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7140 -1.8790 -1.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.6900 -1.3870 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5550 -0.8870 -1.2960 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.5930 -0.2080 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 -1.6170 -1.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5420 0.0790 -2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4230 0.6250 -2.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6710 -2.8590 -2.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8540 -3.3870 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5780 -3.6490 0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4930 -4.1490 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0500 -4.2850 -0.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 -4.5070 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 1.7960 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 1.6550 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 2.0360 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -0.3180 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 1.0350 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -0.1500 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -3.8120 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6600 0.2850 -3.0530 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 31 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 40 -1 M END