IBS-ZINC00530061 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.2150 -0.6670 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 0.0010 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.3290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 2.0620 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 2.0370 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 3.3380 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1110 3.6070 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8110 2.4930 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 1.4570 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 0.1220 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5680 2.3630 -0.0520 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0130 4.1180 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5130 4.2560 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1930 4.3260 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5720 4.4530 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2700 4.5090 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5920 4.4390 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2130 4.3180 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 4.2550 2.3110 F 0 0 0 0 0 0 0 0 0 0 0 0 9.5110 4.2710 -2.4260 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9240 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.5620 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -1.7460 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 3.1410 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2830 -0.2300 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0560 -0.0660 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 4.6020 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 4.5910 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1020 4.5080 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3450 4.6080 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1390 4.4820 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 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 25 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 M END