PUBCHEM-ZINC06904718 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.1870 1.6770 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 0.1530 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -0.4030 -1.5000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1270 -1.4760 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 1.6930 -1.7600 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6350 2.0510 -2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 2.2600 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 2.1160 -1.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 3.4140 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 4.3180 -2.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4350 3.6520 -2.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7660 3.6090 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7330 5.0530 -2.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8930 4.1690 -3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5480 2.8030 -3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -0.2900 -2.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -0.9340 -2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -1.7050 -2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -0.5450 -4.2970 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0370 0.4630 -4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 -1.5250 -4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -1.1530 -7.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -0.1830 -6.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 2.0230 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 2.0310 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -0.1730 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -0.2510 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 3.3520 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 2.0350 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 1.4240 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3150 5.1910 -3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 5.8480 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9680 4.3660 -3.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5410 4.2550 -4.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9900 2.0120 -3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0040 2.7170 -2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 0.2650 -3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -2.5640 -4.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -1.4510 -3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -0.8290 -7.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -2.1750 -7.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -0.2110 -7.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 0.8440 -6.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 0.2350 -1.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -0.0320 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 5.2580 -2.9290 N 0 3 0 0 0 0 0 0 0 0 0 0 7.4110 6.1690 -3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6410 5.3110 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 2.5570 -2.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 2.4830 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -1.1960 -6.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0430 -1.8820 -6.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -0.2830 -5.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -0.4780 -5.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -1.3800 -5.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 3 44 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 44 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 49 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 46 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 54 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 51 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 54 1 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 46 1 M CHG 1 51 1 M END