PUBCHEM-ZINC03622753 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 0.3490 1.2550 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 2.9320 2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 3.1640 1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 3.8530 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 4.7270 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 5.3750 3.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 6.2920 2.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 7.1400 4.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0430 6.9460 4.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3370 7.6960 6.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 8.6640 6.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 8.8970 5.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 8.1310 4.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 8.5670 3.9770 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 9.7500 5.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 9.8350 6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 10.7810 7.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 11.5910 7.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 11.4820 6.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 10.5640 5.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 0.5640 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 1.8210 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 0.7000 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 3.5940 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 2.1760 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 3.4930 3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 2.5560 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 3.8780 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 3.1140 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 4.4820 3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 5.4750 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 4.1190 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2690 6.9380 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 5.7310 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7590 6.1920 4.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2680 7.5310 6.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6850 9.2400 7.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8090 10.8810 7.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 12.3080 8.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 12.1150 6.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 10.4800 4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 2.2230 1.9490 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4700 1.6570 2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 42 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END