IBS-ZINC01292265 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 0.3760 0.3770 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -0.5590 -0.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -1.0620 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -1.9760 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -2.4930 1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -2.0910 3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -1.1670 3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -0.6550 1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.7720 4.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 0.0830 4.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 -2.6360 4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 -1.8330 5.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -0.4500 5.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 0.4920 5.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 1.6600 5.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 1.5150 4.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 0.2470 4.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9500 -0.4300 3.2800 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 0.2380 6.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 1.2020 7.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 0.5680 7.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -0.7530 7.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -1.4470 8.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -0.9330 7.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 1.1990 8.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 0.4260 9.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 1.0200 10.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 2.3800 9.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 3.1520 9.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 2.5700 8.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -3.3880 1.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 -3.7510 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 1.2420 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 0.7000 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -0.0950 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -2.2850 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 0.0600 1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -0.4460 3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 0.3700 5.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 0.9760 3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -3.7040 4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -0.6860 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 2.2560 6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -0.6360 9.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 0.4230 10.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 2.8400 10.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 4.2120 9.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 3.1740 7.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -4.4700 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 -4.1980 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 -2.8620 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 M END