IBS-ZINC02401796 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.0530 1.4640 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0410 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -0.7940 1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -2.1740 1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.8000 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -2.0470 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -0.6670 -0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -2.7300 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -4.5590 -0.0200 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -4.8790 -1.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -5.0330 1.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -5.0570 -0.5130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -5.4030 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -5.7830 -1.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 -5.6620 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -5.2300 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -5.0510 1.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -5.2810 2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -5.0970 3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 -5.3380 4.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3260 -5.7670 3.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1910 -5.9560 2.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9530 -5.7160 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 -5.8880 0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -4.9290 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 -5.5020 -2.7860 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4220 -6.5450 -3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3090 -4.6690 -3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7130 -4.6490 -3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5430 -5.4720 -1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1340 -5.3860 -1.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 1.8580 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 1.8570 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 1.7630 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -0.3040 2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -2.7620 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -0.0790 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -2.8400 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -2.1300 -3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -3.7140 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -4.5420 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -6.2420 -2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -4.7650 4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 -5.1960 5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2800 -5.9520 3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0340 -6.2890 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -3.9220 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -4.8940 -3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9130 -3.6570 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3450 -5.1500 -4.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0110 -3.6270 -2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4430 -5.1190 -3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1370 -5.0400 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8300 -6.5100 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 31 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END