IFLAB-ZINC04163737 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.0050 1.4900 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0170 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.7880 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -2.1810 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -3.4140 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -4.5690 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -4.5260 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -3.3190 -1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -2.1310 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.8020 -1.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.4720 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -5.9000 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -6.3500 1.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -7.5240 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -8.2080 2.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -7.9810 2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -7.2540 2.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -9.3040 2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -10.5010 2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -11.5020 3.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -12.4340 2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -11.0210 4.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -9.6330 4.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -8.8810 5.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -9.5080 6.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -10.8790 6.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -11.6340 5.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -10.6610 0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 1.8670 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 1.8460 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 1.8460 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.4460 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -3.4560 2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -5.4470 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -3.2960 -2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -6.6310 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -5.7970 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -5.8030 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -7.8130 5.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -8.9280 7.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -11.3600 7.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 -12.7010 5.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -10.9230 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -11.4510 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -9.7240 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 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 33 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 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 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 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 M END