CHEMBRIDGE-ZINC01161348 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.2770 1.7640 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 0.3050 -1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -0.5010 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 0.0380 -0.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -1.9390 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -2.6910 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -4.0380 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -4.6530 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -3.9120 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -2.5650 -2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -5.9820 -2.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -6.8240 -1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -6.3880 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -8.2740 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -9.1480 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -10.5010 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -10.9980 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -10.1310 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -8.7780 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -12.3320 -1.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -13.1140 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -14.4710 -2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -15.2640 -2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -14.7070 -2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -13.3560 -2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -12.5590 -2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -15.5600 -2.9570 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5380 -16.7510 -3.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -15.0700 -3.0380 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4420 1.8180 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 2.1660 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 2.3470 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -0.0970 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 0.2520 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -2.2140 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -4.6180 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -4.3940 -3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -1.9910 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -8.7640 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -11.1780 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -10.5210 -3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -8.1060 -3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -14.9060 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -16.3200 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -12.9230 -2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -11.5040 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 2 0 0 0 0 3 5 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 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END