PUBCHEM-ZINC05985965 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0830 1.1490 -2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 0.4800 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 2.7800 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 3.6150 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 4.9140 -0.6510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 6.1630 -1.1660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1070 6.0790 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 7.1350 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 8.5900 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 9.2120 -0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 10.3350 -1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 10.9380 -1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 10.5060 -1.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 9.4250 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 8.7440 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 9.2890 -0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 6.5440 0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 7.0980 1.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 5.0960 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 4.2610 1.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 6.4630 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 6.5320 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 6.8220 -4.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 7.0450 -5.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 6.9770 -4.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 6.6920 -3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 7.1880 -5.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.0770 -2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 1.5910 -2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 1.6330 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 0.8260 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -0.5610 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 0.5830 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 3.1780 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 2.7670 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 3.7610 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 3.0820 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 10.7330 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 11.8130 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 9.1180 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 7.9020 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 6.3660 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 6.3680 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1770 6.8790 -4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 7.2690 -6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 6.6560 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 7.4580 -6.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 1.3290 -1.1080 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2450 0.9700 -0.8910 H 0 0 0 0 0 0 0 0 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 1 48 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 16 2 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 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 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 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END