IFLAB-ZINC05258941 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 0.2100 1.1810 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -0.2000 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.8390 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -2.1460 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -3.0060 0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -2.2160 0.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -1.0150 -0.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -0.6830 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -3.2970 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -3.7820 -0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -4.8500 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -5.4380 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -4.9580 1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -3.8930 1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -0.3390 0.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -1.0140 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 -2.0950 -0.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 -0.4260 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9380 -1.3860 -0.9640 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8580 -2.3670 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3380 -0.8570 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0150 -0.6020 -1.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 -2.7800 -2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 -2.8640 -4.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 -1.8570 -5.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 1.5920 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 1.1250 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 1.8240 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 0.3470 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -1.3520 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 -0.7980 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -3.3240 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -5.2270 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -6.2730 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -5.4180 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -3.5220 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 0.4910 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9590 0.5290 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 -0.2710 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6370 -3.6030 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 -2.8470 -2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 -3.8470 -4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 -2.7090 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 -1.8510 -6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8330 -0.6680 0.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6370 -1.5020 -2.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -1.3880 -2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7350 -0.3270 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 46 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 45 48 1 0 0 0 0 46 47 1 0 0 0 0 M END