IFLAB-ZINC05251267 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.3750 1.5690 -1.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 0.1250 -2.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6020 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -0.0440 0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0730 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -2.8290 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -4.2020 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -4.8390 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -4.0900 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -2.7160 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -6.2290 -1.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -6.9750 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -6.4400 0.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -8.4590 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -8.9940 -1.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -9.2050 0.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -10.6620 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -11.2530 1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -11.6500 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -12.1640 3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -12.1840 4.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -11.5340 3.4160 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 1.8410 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 1.9170 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 2.0310 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -2.3350 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -4.7870 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -4.5870 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -2.1360 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -6.6600 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -8.7780 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -11.0670 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -10.9120 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -11.5750 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -12.5200 3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -12.5480 5.1930 H 0 0 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 3 4 2 0 0 0 0 3 5 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 6 26 1 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 11 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 M END