IBS-ZINC06759121 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.0310 1.4130 0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 0.0250 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6680 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0240 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 1.4270 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 2.1160 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 1.8440 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 0.6950 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.3810 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -1.3050 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 3.2140 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 3.4520 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 4.7440 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7150 5.8080 0.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 4.6670 0.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2250 3.5000 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 2.2720 0.0800 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5760 3.2740 0.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5240 4.3920 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4670 4.1020 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0750 1.7200 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1150 1.9060 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1220 2.5390 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9080 1.2800 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6150 1.5000 0.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 1.9440 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -0.5160 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7480 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 3.1960 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 0.6510 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 4.0380 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1010 4.4860 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9770 5.3160 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2440 4.8650 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9020 4.1120 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5160 1.7670 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5680 0.7510 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2990 1.1880 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6530 1.7570 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6560 2.4040 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8000 3.3920 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6190 1.0490 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2190 0.4450 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1360 0.7410 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0840 2.7820 1.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 45 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 21 45 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END