PUBCHEM-ZINC03752620 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.1990 1.5990 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 0.0960 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.5240 1.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -1.8930 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -2.7380 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -4.1230 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -4.6700 1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -3.8390 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.4490 2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -4.4070 3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -5.3740 3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 -5.5630 5.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 -6.4030 5.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -6.3570 7.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 -5.4520 7.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -4.6050 7.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -4.6890 5.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -4.0020 4.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -3.2940 5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5670 -7.2670 7.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2810 -8.0700 7.2740 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9390 -6.1210 2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 -5.2250 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3910 -4.4140 1.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 1.8800 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 2.1240 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 1.9380 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -0.1580 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -0.2170 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -2.3540 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -4.7820 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -5.7510 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -1.7860 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 -7.0970 5.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -5.4060 8.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -3.9150 7.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 -6.7340 2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 -6.8220 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -7.1670 9.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 -5.4410 0.2770 O 0 5 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 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 39 2 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 40 -1 M END