PUBCHEM-ZINC05974872 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 0.0510 1.4270 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.1620 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -0.4920 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 0.1520 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 1.4100 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 2.0840 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 1.7360 0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 2.5890 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 0.7040 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 -0.2660 -0.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8590 0.7320 -0.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6710 1.8270 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1520 1.6090 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9710 1.9650 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3380 1.6130 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5040 0.9910 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0460 0.8310 1.2300 S 0 0 0 0 0 0 0 0 0 0 0 0 11.7930 0.5320 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9520 -0.2720 1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6130 -0.6020 2.2170 S 0 0 0 0 0 0 0 0 0 0 0 0 13.9990 0.3460 0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9730 0.8830 0.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3500 0.4390 0.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0180 -0.0450 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8130 1.1650 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9810 1.8420 -1.3210 N 0 3 0 0 0 0 0 0 0 0 0 0 13.9750 1.7980 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3090 2.3900 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1430 1.2200 -0.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 17.5100 1.7560 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8140 0.7320 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 1.9130 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -0.3240 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -1.4730 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 3.0650 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3570 -0.0750 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 2.7430 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 2.0150 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6090 2.4620 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1370 1.8100 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2060 -0.6820 2.6360 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 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 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 26 1 M END