PUBCHEM-ZINC02796491 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8300 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1150 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1020 -0.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7660 -1.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -3.2790 -1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -3.7080 -1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -4.8840 -2.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -5.4410 -3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -4.9670 -2.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -6.6190 -3.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -7.2780 -4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 -8.3350 -5.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -8.2760 -5.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -7.2370 -4.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -9.2200 -5.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -8.7160 -7.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -9.4540 -8.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -10.6380 -7.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -11.3870 -8.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -10.9560 -9.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -9.7760 -10.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -9.0260 -9.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -7.5480 -9.8950 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -3.3400 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.3790 2.5400 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.2080 3.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -0.1790 3.1100 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -3.0330 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -4.0940 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -3.9530 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -2.8930 -2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -5.2620 -2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 -7.0340 -4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -9.0600 -5.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -9.3060 -5.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -10.2010 -5.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -10.9750 -6.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -12.3090 -7.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -11.5430 -10.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -9.4420 -11.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -3.6500 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -4.1460 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -3.1110 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END