IBS-ZINC02161046 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 -2.5790 2.3070 -1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 0.8350 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 0.6330 0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5430 1.3370 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 0.8740 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -0.7970 0.4060 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8270 -0.9780 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -0.9840 1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -1.7470 2.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -1.7420 -0.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -2.9980 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -3.3280 -0.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -3.9920 -0.9600 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9560 -3.5610 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 -4.3300 0.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8670 -4.8530 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 -3.0380 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 -5.2240 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9290 -6.5940 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -5.2120 -1.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -6.0000 -0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -7.0950 -0.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -7.5350 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -8.7130 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -9.1210 -3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -8.3760 -4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -7.2100 -4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -6.7790 -3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -5.5470 -2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -4.8530 -3.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 2.4510 -2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 2.5920 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 2.9260 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 0.2160 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 0.5500 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 0.1700 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 0.7300 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 1.8930 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -1.4650 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5520 -2.5290 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6820 -3.2780 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 -2.3900 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2810 -5.3470 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9390 -4.7640 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 -6.9850 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7420 -7.2790 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2710 -6.4920 -1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -5.7000 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -9.3000 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -10.0330 -3.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -8.7120 -5.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -6.6340 -5.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -0.3020 2.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -0.4540 3.5630 H 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 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 53 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 53 54 1 0 0 0 0 M END