PUBCHEM-ZINC05116528 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.8210 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.0950 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.0660 -0.6960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.8120 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.3610 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -1.2360 -3.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.8160 -4.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -1.4020 -5.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -0.9750 -7.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 0.0360 -7.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 0.6220 -6.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 0.1980 -5.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 0.4540 -8.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3950 2.5120 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0180 0.7900 2.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -1.2300 3.3990 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.9850 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 0.6950 -2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -2.1880 -5.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -1.4270 -7.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 1.4080 -6.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 0.6510 -4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -0.0280 -9.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END