PUBCHEM-ZINC04824161 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.1930 1.0810 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -0.1700 0.2560 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 0.4530 1.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.9070 0.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.1790 -0.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 -0.7320 -0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -0.5740 -2.3850 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9240 0.0500 -2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -0.0310 -2.7530 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4980 0.6770 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -1.2850 -2.9270 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2300 -1.6040 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 -2.3320 -3.4210 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0940 -3.2810 -2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -1.8780 -2.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 -2.6510 -4.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -1.8960 -5.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -2.4640 -7.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -3.6420 -6.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 -3.7830 -5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 -4.8190 -4.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 -5.7440 -5.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 -5.7390 -7.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -4.6780 -7.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -4.6610 -8.9910 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 -1.0170 -3.8060 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0370 0.6570 -4.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 0.3360 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 1.6270 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 0.6050 -1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 1.7660 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -1.9050 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 0.2060 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -1.5010 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 -0.9440 -5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8480 -6.6100 -5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -3.8740 -9.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -5.4420 -9.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 35 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 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 26 -1 M END