PUBCHEM-ZINC05840278 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.4030 1.5810 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 0.3100 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 0.3420 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 0.3380 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -1.8990 1.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3450 -2.1650 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -2.6920 1.7250 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0850 -2.0900 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -3.1110 3.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -2.6490 3.5580 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0710 -1.7530 4.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -2.2290 2.3320 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7020 -1.3260 2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -3.2430 1.8390 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8600 -3.5890 4.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -4.9560 4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -5.5140 5.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -4.4570 6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -3.2500 5.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -2.0180 6.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -2.0820 7.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 -3.1750 7.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -4.3980 7.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -5.5200 8.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -3.9550 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -4.5280 1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -4.6630 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 1.3660 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 2.0310 3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 2.3290 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 0.5130 3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -0.3670 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -0.1490 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 1.3730 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -0.6780 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 0.8390 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 0.8720 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -5.4830 3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 -1.1290 7.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -6.4300 7.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -5.4020 8.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -3.7240 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -4.7150 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -0.3740 1.1940 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0330 -0.3010 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 44 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 5 44 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 14 -1 M CHG 1 44 1 M END