PUBCHEM-ZINC02046808 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 0.2960 1.5560 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 1.9410 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 1.8410 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 2.2370 -2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 2.7390 -3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 2.7870 -3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 2.3950 -2.6180 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0290 3.1610 -4.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 4.0010 -5.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 3.3420 -7.0740 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 2.9330 -7.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 2.1420 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 3.1910 -1.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8980 4.0580 -1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7790 4.2690 -2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7100 5.2640 -2.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3700 5.7520 -1.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8960 6.5000 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2930 5.0810 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 5.2680 0.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 1.4280 -0.2150 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1790 0.5000 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 1.7020 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 2.1740 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 3.1350 -4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 2.2730 -5.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 3.7570 -4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 2.1830 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 1.1630 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3660 3.2560 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8650 3.7480 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 2.4440 -2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 4.4810 -7.6860 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8050 2.1790 -6.5800 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 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 12 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 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 M CHG 1 7 1 M CHG 1 21 -1 M CHG 1 33 -1 M CHG 1 34 -1 M END