IFLAB-ZINC04496041 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5020 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0050 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -0.6880 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.0520 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.7520 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.0870 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -4.7910 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -4.1360 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -2.7200 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 -2.1110 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -2.0570 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -0.6960 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 -4.9000 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 -6.1130 -0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 -4.2590 0.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9970 -5.0270 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1640 -4.0800 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8640 -3.5930 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8950 -2.7380 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0320 -2.5310 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8150 -3.4530 1.8690 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8790 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8540 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8630 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -0.1380 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -2.5910 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -5.8700 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -0.1620 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -3.2890 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1230 -5.6520 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -5.6580 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 -3.8460 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5390 -2.2740 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7780 -1.8970 1.4510 H 0 0 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 2 12 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 M END