CHEMBRIDGE-ZINC02984236 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1590 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4560 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.8360 -3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.6060 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.9960 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.7520 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -4.1710 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -4.8480 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -4.5650 0.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -5.1540 2.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0430 -4.7870 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 -5.3740 0.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9100 -5.1430 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6560 -4.3670 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9940 -4.1330 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5900 -4.6720 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8490 -5.4460 -0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5090 -5.6780 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5770 -6.6440 -1.7680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -10.0230 -4.4200 -0.3080 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.6770 -3.7380 0.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5490 -4.8940 -1.2990 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3910 0.3790 -4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 0.6710 -3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 0.3620 -4.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2370 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -2.3120 -4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -3.6840 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -4.4830 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -4.4590 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -5.9260 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -4.4700 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -6.2380 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -4.7820 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 -5.1610 2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 -3.7030 1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1920 -3.9460 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5750 -3.5300 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3170 -5.8650 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -0.1650 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 1.3160 -4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 1.1340 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -0.1020 -5.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8090 0.5710 -4.5180 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 1 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END