PUBCHEM-ZINC05757086 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0040 1.3180 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.0590 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -0.7200 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 0.0210 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.4020 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0490 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 2.1270 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 2.0320 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 2.6510 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3980 2.5520 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 1.8380 -3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 1.2200 -3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 1.3100 -2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 0.4560 -4.5210 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9990 0.3710 -5.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 -0.0890 -4.5140 O 0 5 0 0 0 0 0 0 0 0 0 0 7.7230 3.2120 -2.2530 N 0 3 0 0 0 0 0 0 0 0 0 0 8.0980 3.8420 -1.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4370 3.1260 -3.2360 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3160 -2.1900 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -2.9020 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -4.3640 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -4.9370 0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -5.0760 0.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -6.5390 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -7.0880 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -7.4210 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 -7.8880 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 -7.8130 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -7.3330 1.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.8270 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -0.6270 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -0.4830 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 3.1270 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9210 3.2100 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 1.7620 -4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 0.8230 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -2.6980 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -2.3940 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -4.6200 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -6.9230 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -6.8460 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -7.3460 -1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -8.2390 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 -8.0940 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M CHG 1 17 1 M CHG 1 19 -1 M END