IBS-ZINC02667123 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -0.8080 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -1.2720 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -1.4220 3.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -1.1080 3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.6450 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -0.3340 2.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -0.5020 3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -0.1100 3.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 0.2740 2.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -1.8710 4.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -1.6010 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 -2.0030 3.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 -1.4400 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3430 -1.8420 1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 -3.0290 0.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1010 -3.2450 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 -4.4360 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1840 -4.4400 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8410 -3.2760 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1390 -2.0980 1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7690 -2.0740 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5890 -0.7680 1.5230 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -0.6920 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -1.2210 4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -1.5450 4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 0.1300 4.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -1.1690 5.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -2.0740 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 -0.3990 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3510 -5.3510 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7420 -5.3600 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9030 -3.2940 1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6500 -1.1920 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -0.1870 4.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 0.0750 4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 32 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 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 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 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 42 43 1 0 0 0 0 M END