PUBCHEM-ZINC00319550 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.4080 1.6970 0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 0.2720 0.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.6140 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -1.8850 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -1.7410 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -0.3870 -0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 0.0910 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -0.8300 -3.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -2.1810 -2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -2.6470 -1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -3.1790 1.6760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0580 -4.0070 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -3.2950 2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -4.6800 3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -4.9460 4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -6.2270 5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -7.2530 4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -7.0000 3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -5.7200 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -3.2890 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -3.5310 1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -4.3820 0.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 2.2060 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 1.9810 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 1.9510 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -0.2800 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 1.1450 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -0.4840 -4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -2.8830 -3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -3.7010 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -2.5730 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -3.0080 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -4.1570 5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -6.4240 6.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -8.2510 4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -7.7990 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -5.5370 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -2.3920 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -4.1410 3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 -2.8770 1.5200 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 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 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 M CHG 1 40 -1 M END