PUBCHEM-ZINC06762828 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 0.4350 2.3270 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 0.7010 -0.5160 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.2450 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -1.7200 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -2.5950 -2.7250 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1350 -2.4460 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -4.0640 -2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 -4.5990 -1.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 -2.3120 -3.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -1.3550 -4.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -0.6130 -4.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -1.3220 -4.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 -0.3930 -5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0620 -0.2550 -4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7490 0.6990 -5.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2170 0.8630 -5.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1460 -0.0910 -5.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5040 0.0570 -5.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9450 1.1570 -4.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0300 2.1090 -4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6710 1.9620 -4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 2.6540 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 2.2960 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 3.0520 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.1320 -2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 0.1860 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -1.8250 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -2.0860 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -2.9380 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4770 -1.9850 -3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 -0.7700 -6.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0740 0.5790 -5.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 0.1060 -3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 -1.2430 -4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6380 0.3330 -6.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2570 1.6800 -5.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8150 -0.9570 -6.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2180 -0.6850 -5.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0020 1.2720 -4.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3750 2.9670 -3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9710 2.7120 -4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -4.5410 -2.2160 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 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 42 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 M CHG 1 42 -1 M END