IBS-ZINC00093642 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.9110 0.5480 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 1.9270 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 2.9920 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 3.3970 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 3.4590 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 3.8860 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 4.2700 -2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 4.2360 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 3.8070 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 3.7820 -1.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 4.1650 -2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 4.1420 -3.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 4.5960 -3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 4.6400 -3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 5.0940 -4.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 4.1590 -5.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 4.5870 -6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 5.9470 -6.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 6.8820 -6.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 6.4590 -4.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 3.9430 -0.3000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 3.0730 1.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -0.1430 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 0.2530 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 0.5880 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 1.7070 2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.1710 3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 2.9170 3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 2.6170 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 3.8770 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 4.6000 -2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 4.8790 -4.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 3.0960 -5.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 3.8610 -7.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 6.2780 -7.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 7.9410 -6.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 7.2000 -4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 3.2420 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 1.9130 1.8650 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8610 2.1780 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 39 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 39 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 22 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 22 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END