IFLAB-ZINC04138272 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 1.1540 1.1140 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -0.3800 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -1.0890 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -2.4930 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -3.6840 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -4.8650 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -4.8920 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -3.7300 -1.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -2.5150 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -1.2150 -1.5710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -0.9320 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -6.1490 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -6.3990 1.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -7.8980 1.8980 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -7.8080 2.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -8.8340 1.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -8.1850 3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -7.8050 4.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -8.0280 5.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -8.6350 5.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -9.0160 4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -8.7940 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -8.8630 7.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -9.1460 8.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -9.2980 8.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -9.2730 9.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 1.3510 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 1.4910 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 1.5800 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -0.6990 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -3.6700 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -5.8340 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -3.7610 -2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -6.9740 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -6.0680 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -5.6870 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 -7.3330 4.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -7.7310 6.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -9.4880 4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -9.0940 2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -8.8170 7.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -9.1050 9.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -8.5330 10.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -10.2730 10.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END