IBS-ZINC05047126 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 2.5510 1.4030 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 0.7600 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -0.2920 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -1.4100 1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -1.5190 -1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -2.1610 -2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -2.4260 -4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -3.0510 -5.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -3.3520 -6.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -3.0450 -6.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -3.3440 -8.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -3.9590 -8.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -4.2750 -8.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -3.9750 -7.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -4.3380 -7.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -4.8770 -8.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -4.0360 -5.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -3.4010 -4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 -3.1590 -3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -2.5540 -2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -2.2940 -1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -3.5600 -3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 1.6900 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 0.7250 -1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 2.3090 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 1.4160 -1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 0.5180 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -0.2160 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 0.6600 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -1.4810 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -1.2160 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -2.3820 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -0.9770 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -2.3140 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -2.1340 -4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -2.5640 -6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -3.0940 -8.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -4.1920 -9.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -4.7580 -9.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -2.8050 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 -2.7450 -3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 -4.4490 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 -3.7860 -4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -0.5220 -0.8910 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9180 -1.0070 -0.7960 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 26 1 0 0 0 0 2 27 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 44 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 20 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 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 2 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END