PUBCHEM-ZINC01009573 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -1.1160 -0.8300 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 0.0230 0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -0.5790 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 0.3010 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -0.1770 3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -1.5490 3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -2.4300 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -1.9500 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -2.1210 4.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -1.4420 5.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -0.2220 5.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 -2.3660 6.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4570 -3.2300 6.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 -2.8390 5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4150 -1.9240 5.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6430 -2.3680 4.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9270 -3.7310 4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9700 -4.6490 5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7330 -4.2130 5.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2620 -6.0840 5.0820 N 0 3 0 0 0 0 0 0 0 0 0 0 8.4050 -6.4290 4.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3450 -6.8650 5.3730 O 0 5 0 0 0 0 0 0 0 0 0 0 5.1600 -2.2650 8.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2780 -1.3890 9.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 -1.1080 10.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -0.5230 9.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 -1.4130 8.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -1.4600 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -0.1960 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -1.4360 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 1.3740 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 0.5570 3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -3.5070 2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -2.6750 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 -3.1360 4.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2290 -0.8500 5.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3810 -1.6460 4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8890 -4.0530 4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -4.9390 5.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -2.3530 8.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 -3.2620 8.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -1.8770 10.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 -0.4390 9.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 -2.0380 10.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 -0.4140 11.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -0.3970 9.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 0.4750 9.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -2.4000 8.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -0.9370 7.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -1.6290 7.6160 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5680 -0.6930 7.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 50 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 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 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 50 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 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 50 1 M END