IBS-ZINC05305754 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 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 -1.2000 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 0.1170 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -0.4880 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -1.8910 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 -2.5490 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -3.9090 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -4.6640 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -4.0610 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6580 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -2.0020 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.8000 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -3.8510 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -4.1100 2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -5.2470 3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -5.4910 4.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -4.5880 5.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 -3.4430 4.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -3.2140 3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -4.8420 6.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -5.8390 7.3890 O 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 -2.3190 1.1960 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 0.1080 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 -1.9780 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -4.4120 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 -5.7420 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -4.6590 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -3.7430 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -2.2330 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 -3.2910 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -4.8010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -5.9450 2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -6.3780 5.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -2.7400 5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -2.3310 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -3.0730 1.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -2.2160 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0830 -3.9690 7.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 -4.1780 8.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 40 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 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 M END