IBS-ZINC05209672 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 1.3830 -0.1640 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -1.6640 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -1.8860 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -3.3850 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -3.6080 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -5.1070 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -5.3200 -0.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6830 -5.3520 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -5.2070 -2.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1390 -5.5680 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9210 -5.6140 -2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3870 -5.2980 -3.4750 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1790 -5.4620 -4.6970 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.2240 -5.2330 -4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6560 -4.5100 -5.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8840 -3.0850 -5.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 -2.1260 -5.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5760 -0.9900 -4.8210 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1640 -0.1280 -4.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8830 -1.2950 -4.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0600 -2.5490 -4.9840 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0640 -6.8840 -5.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 -7.6780 -4.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7250 -5.7350 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9200 -5.9180 0.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9010 -5.6800 1.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5830 -5.4840 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8950 -5.4490 2.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -0.0060 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 0.3390 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 0.2420 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -2.0700 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -2.1670 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -1.4800 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -1.3830 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -3.7920 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -3.8880 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -3.2010 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -3.1050 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -5.5140 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -5.6100 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9590 -5.9020 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 -4.9620 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5900 -4.6790 -5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1860 -4.6940 -6.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 -2.2320 -5.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6540 -0.6140 -4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 -5.7870 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7100 -7.2670 -6.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6060 -8.1890 -6.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 49 50 1 0 0 0 0 M END