IBS-ZINC05478283 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 0.1400 2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -0.4710 3.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -1.8570 3.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -2.6230 2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0010 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -4.0370 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -5.1580 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -6.4660 2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -7.5030 2.6960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -5.0110 0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -4.8940 -0.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -3.9960 3.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -4.9580 4.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -2.7060 4.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -2.2510 5.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -2.1130 6.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -1.6450 7.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -0.2920 7.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 0.1370 9.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -0.7860 9.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -2.1390 9.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -2.5680 8.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.2180 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1310 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -2.5940 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -2.9760 5.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 -1.2840 5.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -1.3880 6.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -3.0790 6.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 0.4290 7.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 1.1940 9.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 -0.4500 10.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 -2.8600 10.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -3.6250 8.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 3 0 0 0 0 13 14 3 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 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END