PUBCHEM-ZINC05458833 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.5000 1.5030 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 0.0080 0.0760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7570 -0.3890 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -0.1410 2.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -0.8260 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -0.8870 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -2.0280 -0.5610 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2150 0.3410 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.3380 -3.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -1.4970 -4.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -2.1490 -5.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -1.6550 -5.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -0.5090 -5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 0.1460 -4.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 2.1070 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 1.8200 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 1.7530 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -1.4450 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 0.1960 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -0.9130 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.2830 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 1.3700 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 0.3660 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -1.9040 -3.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -3.0460 -5.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -2.1640 -6.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -0.1270 -5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 1.0360 -3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.3560 -1.2130 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5410 -0.5260 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -1.3240 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 8 29 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 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 7 -1 M CHG 1 29 1 M END