CHEMDIV-ZINC06832612 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -0.5960 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -0.0060 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3210 -0.8260 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 -2.1510 0.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -2.8000 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.0940 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -2.7680 -0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -4.1460 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -4.8500 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -4.1830 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -5.0050 -1.1460 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -6.2430 -1.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -4.0700 -1.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -5.3720 0.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -6.2970 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 -6.7480 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -6.1390 3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 -6.7360 3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 -7.8300 3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -8.1610 1.9010 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.8530 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8650 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 0.9970 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 0.0530 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -0.8660 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -0.3630 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -2.2170 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -5.9270 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -4.7380 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -4.9750 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -5.7940 1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -7.1640 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -5.2470 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 -6.3460 4.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -8.4250 3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 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 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 M END