CHEMBRIDGE-ZINC00679588 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.1630 1.0450 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 0.8970 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 1.4780 3.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 1.2420 3.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 1.8670 2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 1.2860 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 1.6960 4.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 1.5640 4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 2.0120 6.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 2.5950 7.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 2.7270 6.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 2.2740 5.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7310 3.0500 8.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 4.1350 8.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 4.7760 8.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 4.5430 10.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5240 5.6160 10.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3770 5.6300 12.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 4.5760 11.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9230 3.9280 10.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 4.1030 13.1290 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.0360 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 1.2930 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 1.5240 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 1.0970 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -0.1790 2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 0.9950 4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 2.5500 3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 1.6670 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 2.9430 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 0.2140 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 1.7690 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 1.1110 4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8690 1.9100 6.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 3.1800 7.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 2.3730 5.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5180 2.5850 8.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 6.3180 10.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3650 6.3460 12.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.5220 1.3260 N 0 0 0 0 0 0 0 0 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 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 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 20 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 M END