IFLAB-ZINC04340641 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 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 0.0240 -0.7740 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -0.1570 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -0.9080 3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.2690 3.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -2.8850 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -2.1490 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -2.7420 0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.1830 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -2.8760 -1.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.7140 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.0300 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -0.1440 -3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 0.4960 -4.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 1.2490 -4.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 1.3650 -4.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 0.7260 -2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 2.1220 -6.6220 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.3150 4.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -1.1480 5.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -0.3240 7.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 0.8570 7.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -0.9000 8.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -0.0450 9.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 0.8980 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -2.8470 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -3.9420 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -0.7310 -3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 0.4080 -5.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 1.9540 -4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 0.8140 -2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -1.9440 5.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -1.5840 6.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -0.6350 10.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 0.7510 9.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 0.3910 9.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END