PUBCHEM-ZINC05997308 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.8840 0.9520 0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -0.4570 0.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.8060 0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -0.0390 1.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -2.3090 1.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2350 -2.7620 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -2.6700 2.3500 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9340 -2.2830 3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -4.1620 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 -4.3320 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -2.9300 1.3370 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6720 -2.7530 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -1.8460 3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 -1.0000 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 -0.0130 4.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 0.4820 3.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -2.5770 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -2.8030 -0.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3610 -3.8810 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -2.1560 -1.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -2.8030 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -3.8750 -2.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -2.0370 -3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -2.5680 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -1.8800 -6.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -0.6590 -5.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -0.1250 -4.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.8110 -3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 1.4110 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 1.1120 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 1.4100 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -4.4580 3.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -4.7960 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 -4.7240 2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -5.0480 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 -2.8330 4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -1.3770 4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5930 -1.5310 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 0.1120 5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 0.1150 5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 0.9420 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 0.9410 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -1.5330 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -3.1780 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -3.5210 -5.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -2.2950 -7.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -0.1240 -6.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 0.8270 -4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -0.3710 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -2.0360 2.3140 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7680 -1.0670 1.9320 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 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 50 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 50 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 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 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END