CHEMDIV-ZINC03048116 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 0 0 0 0 0 0999 V2000 0.0020 1.5040 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0020 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.8880 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.6790 2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -1.7520 3.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -3.0450 2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -3.2720 1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -2.1970 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.1040 -0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -0.8140 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -0.3550 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 0.8350 -2.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -1.2540 -3.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -0.8220 -4.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 0.3810 -5.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 0.8040 -6.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 0.0330 -7.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -1.1640 -7.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -1.5970 -5.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -3.2390 -5.1960 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -1.4910 5.1350 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -2.6600 5.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -0.1880 5.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -1.4430 5.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -2.6720 6.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -2.4610 7.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -1.2100 7.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 0.0160 7.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -0.1710 5.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 -1.3690 6.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8930 -1.2650 7.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 -0.5000 8.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -1.0240 8.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 1.8840 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8640 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 1.8550 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 0.3250 2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -3.8840 3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -4.2830 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.2000 -3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 0.9840 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 1.7390 -6.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 0.3670 -8.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -1.7640 -7.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -2.8920 5.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -3.5010 6.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 -3.3280 7.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -2.3350 8.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 0.9060 7.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 0.1310 7.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 0.6510 5.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -0.1870 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6300 -0.6950 6.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2780 -2.2540 7.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 0.5740 8.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1440 -0.7380 9.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 10 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 37 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 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 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 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 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 27 33 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 M END