IBS-ZINC05323343 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -1.4450 0.9780 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -0.3530 0.8870 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7890 -0.4060 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -0.5920 1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 -2.6040 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -4.1130 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 -4.8010 1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -4.1720 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 -4.9070 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3620 -6.2920 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -6.9430 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -6.2200 1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -6.9140 2.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -6.2390 2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -4.8480 2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -4.0870 3.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -4.7560 3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 -3.6980 3.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -3.6040 3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -2.6100 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 -1.7100 4.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -1.7860 5.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -2.7800 4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 -0.7520 4.9890 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -1.4360 1.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -1.2230 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 1.8120 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 1.1200 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 1.0110 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -0.0430 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -0.3600 2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.3000 3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -2.0940 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 -3.0920 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -4.3910 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2130 -6.8670 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -8.0320 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -8.0040 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -6.8350 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -5.4410 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -5.3160 4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -4.3010 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -2.5330 3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 -1.0750 6.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -2.8370 5.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -2.0570 1.3860 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0980 -2.5040 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.3370 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 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 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 25 26 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 46 1 M END