CHEMBRIDGE-ZINC01084557 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 1.5470 1.5640 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.1210 1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -0.6140 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -0.0630 0.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -2.0860 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -2.8500 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -4.2230 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -4.8520 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -4.0950 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -2.7210 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -6.2430 1.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -6.9810 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -6.2120 -0.9770 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -8.3240 0.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -9.1260 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -9.4900 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -10.6570 -1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -10.9920 -2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -10.1600 -3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -8.9940 -3.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -8.6620 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -8.9820 1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -9.1170 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -10.2460 2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -10.3710 3.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -9.3660 4.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -8.2370 4.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -8.1150 3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 1.8930 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 2.0340 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 1.8500 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -2.3620 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -4.8140 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -4.5860 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -2.1340 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -6.6810 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -10.0340 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -8.5490 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -11.3060 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -11.9020 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -10.4210 -4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 -8.3440 -4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -7.7520 -2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -9.9700 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -8.3840 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -11.0310 2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -11.2520 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -9.4630 5.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -7.4520 5.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -7.2350 3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 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 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 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 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 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 22 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 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 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END