IBS-ZINC04956887 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.0530 1.6540 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 0.1320 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -0.5240 1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -1.9810 1.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -2.7330 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -2.3650 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 -3.3260 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -4.6630 -0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -5.0480 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -4.0870 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -4.1580 1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -5.2300 1.9610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -6.5000 1.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -7.5940 1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -7.4790 2.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -8.9600 1.4750 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0720 -8.9790 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -9.2920 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -10.5980 1.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -11.5710 1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -12.9030 1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -13.9020 1.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -13.5770 1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -12.2520 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -11.2450 1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -9.9450 1.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -2.7600 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -2.3800 2.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 1.9820 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 2.1210 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 1.9410 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -0.1960 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -0.1550 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -0.1950 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -0.2360 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -1.3250 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 -3.0320 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -5.4060 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -6.0900 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -6.5920 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -8.5610 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -9.2790 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -13.1590 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -14.9380 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -14.3600 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -12.0010 1.7700 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 M END