PUBCHEM-ZINC05843531 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 0.0020 1.5120 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.0180 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -1.9720 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 -2.4380 2.4400 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5020 -1.9770 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -2.0950 3.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -3.4560 4.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -4.3590 3.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -3.9770 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -5.6940 3.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -6.1490 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -7.4810 3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -8.3480 4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -7.8740 4.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -6.5640 4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -6.1060 5.4050 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -9.7570 4.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -10.5510 5.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -10.1650 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -9.2230 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -7.9500 2.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -7.0150 1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -6.8870 2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 -7.6070 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -11.5530 3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -11.8800 3.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 1.8860 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8720 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.8680 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -0.3920 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -0.3740 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -2.3410 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -2.3590 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -1.4670 4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -1.5940 3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -3.3670 5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -3.8220 4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -4.4250 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -4.2790 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -5.4710 2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -8.5430 5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -9.5230 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -6.1150 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 -7.4990 3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -5.9040 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -7.0980 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -8.6920 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -0.1180 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -12.4640 4.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -13.3650 4.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 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 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 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 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 48 49 1 0 0 0 0 50 51 1 0 0 0 0 M END