IBS-ZINC02198432 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.1970 1.4240 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -0.0990 -0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0630 -0.5480 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -0.5960 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -2.1180 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -2.4890 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -1.9380 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 0.1000 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.1950 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -1.2530 -4.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -1.2040 -5.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -0.0320 -5.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 0.5930 -4.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 1.8700 -3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 1.6220 -2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 0.4950 -2.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 2.7800 -2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 0.2730 -6.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 1.2950 -6.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -0.5810 -7.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -1.7120 -7.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -2.4590 -8.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -2.0410 -6.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -3.2830 -6.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 -0.2710 -8.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 1.8780 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 1.7650 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 1.7140 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -0.1360 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -0.3270 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -2.4710 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -2.5800 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -2.0600 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -3.5740 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -2.1890 -2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -2.3780 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 1.1790 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -0.3360 -2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 2.5090 -4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 2.3620 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 3.3120 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 2.4080 -1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 3.4590 -2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -3.0910 -7.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -4.0270 -7.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -3.6570 -5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.6940 -8.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -0.6980 -9.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3330 0.8100 -8.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -0.4790 -1.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 50 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 50 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 M END