CHEMBRIDGE-ZINC04894538 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 0.0700 1.7150 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.2350 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.5350 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -2.0340 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -2.6610 -0.2730 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5050 -2.7950 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -1.7560 0.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2700 -1.6570 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -0.3530 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 -2.2810 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -1.6560 -0.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 -3.4770 0.7430 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 -4.0890 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3100 -3.4570 1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7250 -3.9770 1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1280 -5.0480 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4350 -5.5340 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3560 -4.9590 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9580 -3.8820 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6460 -3.4010 0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9180 -3.3700 -0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5220 -2.3360 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6570 -5.3750 1.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0860 -6.4760 2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -4.0690 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -4.3250 1.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -0.0230 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 2.0970 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 1.9500 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 2.2660 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -2.5110 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -2.2530 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 0.3220 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -0.3680 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -3.9600 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 -3.9880 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 -5.1570 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 -3.6430 2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 -2.3640 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4270 -5.5130 3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7030 -6.3650 3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3050 -2.5730 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2230 -1.4360 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7280 -2.6740 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3890 -2.0760 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1330 -6.6760 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5120 -7.3780 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0370 -6.2400 3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 1.0610 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -0.4540 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.3100 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -4.8120 -0.2110 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 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 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M CHG 1 52 -1 M END