NIH-ZINC00893812 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.9480 1.4170 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -0.0670 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -0.9290 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -2.2900 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -2.7920 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -1.9230 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -0.5640 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1670 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -4.8900 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -4.7860 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -4.1690 -0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -5.3790 1.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 -5.2780 1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0490 -6.0210 2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4070 -5.4990 3.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0100 -6.5420 4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 -7.6380 3.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4070 -7.3150 2.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -4.9810 -1.3780 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -6.1600 -1.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -4.0210 -2.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 -5.5100 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -6.7420 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 -7.1570 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8060 -6.3400 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 -5.1090 -1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -4.6960 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 1.6880 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 1.9540 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 1.6820 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 -0.5380 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.9620 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -2.3110 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 0.1130 -1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -5.9390 1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -4.4540 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -5.8720 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 -4.2290 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6610 -5.7130 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2610 -4.4800 4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 -6.4710 5.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3680 -8.6120 4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -7.3800 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -8.1190 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8220 -6.6640 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3860 -4.4700 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -3.7350 -1.9200 H 0 0 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 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 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 M END