IBS-ZINC05346226 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.0040 1.3640 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0100 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -0.5310 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 0.7880 0.0070 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 1.9510 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -1.9080 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 -2.3030 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 -3.6270 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -4.5980 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 -3.7490 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 -2.6410 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7130 -2.5850 -0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3670 -1.2760 -0.0480 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3660 -5.0740 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 -5.5270 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -4.8130 -2.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 -6.7260 -1.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1910 -7.1850 -3.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4160 -6.2910 -4.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4980 -6.7460 -5.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3570 -8.1000 -5.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1330 -9.0030 -4.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0530 -8.5540 -3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 -9.5110 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -9.1080 -1.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 -8.5370 -6.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 1.9290 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -0.6190 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 3.0190 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -2.6470 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3370 -5.0250 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 -5.7830 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 -7.2680 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5270 -5.2380 -3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6740 -6.0460 -6.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0230 -10.0540 -4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3340 -8.7730 -7.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -10.8340 -2.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6370 -11.4230 -1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 26 37 1 0 0 0 0 38 39 1 0 0 0 0 M END