IBS-ZINC00528533 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.4280 1.4670 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -0.0210 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.6870 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -2.0850 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -2.7080 2.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.7200 -0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -3.6770 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -2.0310 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -2.8560 -2.6920 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -0.7040 -1.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -0.2260 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 0.0470 2.4710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1210 1.1170 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -0.2200 3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -0.4360 3.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -1.2880 3.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 0.0820 4.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -0.4300 5.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 1.9890 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 1.7540 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 1.7330 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 0.3120 4.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -1.2890 3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.1300 2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -0.2430 5.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -1.5030 5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 0.0710 6.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 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 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 14 24 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 18 25 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 M END