IBS-ZINC03985019 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 1.0050 2.6600 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 1.1900 -0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 1.0070 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 0.3660 -1.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -0.0920 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 0.1870 -0.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 -0.9540 -2.5680 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4960 -1.8560 -2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -0.1770 -3.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -1.0780 -4.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 -1.1810 -5.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -2.1010 -6.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8140 -2.3470 -6.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -2.6270 -6.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -2.0140 -5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -2.3600 -5.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -3.2970 -6.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -3.9080 -7.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -3.5750 -7.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 -2.3890 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -2.6890 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0680 -1.7910 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9150 -0.7550 -1.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2840 -2.1490 -0.7320 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4660 -3.2880 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5870 -3.5520 0.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4790 -4.1500 0.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2090 -3.9190 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 -4.7070 0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 2.7900 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 2.9570 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 3.2790 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 0.8930 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 1.3050 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -0.0400 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 1.6260 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 0.1730 -4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 0.6780 -3.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -0.6200 -5.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -1.8900 -5.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -3.5650 -6.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -4.6460 -8.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -4.0570 -8.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2080 -0.7960 -2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -3.0090 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0430 -1.5700 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6800 -4.9570 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -1.3210 -2.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 48 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 44 48 1 0 0 0 0 M END