IBS-ZINC06660317 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2030 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0960 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -0.6780 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 0.0180 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -0.6660 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2530 0.0360 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6200 -0.4910 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8610 -1.6840 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5730 0.4260 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2400 1.7220 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0060 2.6670 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 1.7980 -0.0670 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9820 0.0270 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4530 -0.1040 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6860 0.1160 -2.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7250 -0.4640 -1.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1820 -0.5910 -3.1720 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3650 -0.9590 -3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3660 -1.5880 -3.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3610 -0.8100 -4.5700 S 0 0 0 0 0 0 0 0 0 0 0 0 16.7320 -0.7070 -4.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9540 -1.2590 -5.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6990 0.8310 -4.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6220 0.7480 -3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7610 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 1.9940 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -1.7580 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 1.0980 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 -1.7460 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5800 0.7810 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0940 -0.9310 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3380 -0.6390 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9150 -1.6120 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0300 -2.5850 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1140 1.7330 -4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0530 1.6350 -3.4380 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 28 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 2 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M END