IBS-ZINC04090860 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 0.0930 1.1040 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.3070 1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -0.7840 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -0.0060 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 -0.5970 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -1.9930 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -2.8080 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -2.1840 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -4.1790 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 -4.1290 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 -2.8260 -0.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -2.5540 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0260 -5.2010 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 -6.3980 -0.8090 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.0170 -5.3880 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -6.0120 1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -7.2310 1.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -7.2210 2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -6.2080 2.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -8.5790 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -8.7210 3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -10.0100 3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -11.0360 2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -12.2340 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 -12.3970 3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -11.3880 4.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -10.1920 4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 -11.6980 6.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 -10.7000 7.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 -13.5760 4.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 1.3180 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 1.5710 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 1.5310 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 1.0790 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 0.0130 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 -2.7850 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -6.1290 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -5.1160 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -5.3020 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -6.2830 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -8.1000 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -9.4250 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -7.8480 3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -10.9110 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -13.0300 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -9.3860 5.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -11.0960 7.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 -9.7930 6.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -10.4790 7.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -13.4630 5.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1290 -4.8280 -1.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 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 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 51 2 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 M CHG 1 14 -1 M END