IBS-ZINC00530715 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 33 0 0 0 0 0 0 0 0999 V2000 0.0440 1.3050 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.0200 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -0.4320 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 0.5990 0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 1.6430 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -1.7030 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 -1.9320 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -0.9780 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9740 0.2150 -0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 -1.4390 -0.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 -2.7860 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -3.4960 -0.2910 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 -3.0660 -0.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5910 -1.9280 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 -0.9130 -0.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0670 -1.8310 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8350 -2.9870 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2080 -2.8920 -0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8230 -1.6510 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0630 -0.5000 -0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6890 -0.5840 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1680 -1.5630 -0.8900 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 1.9370 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -0.6040 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 2.6020 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -2.4940 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3570 -3.9550 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8040 -3.7870 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5470 0.4660 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 0.3140 -0.4720 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 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 25 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 12 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 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 13 14 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 21 2 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 30 1 0 0 0 0 M END