PUBCHEM-ZINC05976180 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.1820 1.0510 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.0780 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -0.3550 -1.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -0.8140 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -2.1430 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8350 -2.4850 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -3.6210 0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -1.2990 -0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -0.1440 -0.1660 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7780 0.4450 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 0.6990 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 0.1390 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 0.9480 -3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 2.3280 -3.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 2.8850 -2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 2.0880 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 4.2300 -2.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -1.2120 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4230 -1.1220 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4590 -0.9290 3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9470 -1.2520 2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0830 -2.3900 2.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0220 -2.6590 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -3.0670 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 1.0340 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 2.0020 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 0.9430 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 -0.9330 -2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 0.5000 -4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 2.9450 -4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 2.5690 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 4.6680 -3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3440 -0.3520 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 -2.1150 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 -1.9980 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0290 -0.2160 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2570 0.0810 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9410 -1.6750 3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3570 -1.4820 3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5050 -0.4220 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -3.9390 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9100 -1.0580 1.6310 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.2900 -0.3050 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3530 -1.9310 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 24 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 42 1 M END