IBS-ZINC05101088 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 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 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -4.1790 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 -2.6270 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4460 -2.8520 -1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 -2.4820 -2.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6170 -3.4620 -1.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 -3.6160 -2.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0580 -4.2020 -3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 -4.3890 -4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6480 -5.0160 -4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0020 -5.1870 -6.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1660 -4.7390 -7.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9710 -4.1170 -6.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6080 -3.9340 -5.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8920 -4.6490 -2.0720 N 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 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -3.7480 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -4.6370 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -3.5870 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -2.0100 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3020 -5.3660 -4.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9340 -5.6720 -6.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4470 -4.8760 -8.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3220 -3.7700 -7.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6770 -3.4440 -5.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6390 -4.5260 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7300 -5.0850 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END