PUBCHEM-ZINC05159461 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 -0.8890 0.9100 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 1.2480 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 2.6080 -0.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 0.3150 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 0.7100 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 1.9040 -3.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 -0.3810 -3.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -0.3730 -5.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 0.7830 -5.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 0.6950 -7.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3100 -0.5470 -7.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -0.5940 -8.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1150 -1.8110 -9.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -3.0060 -8.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 -2.9750 -7.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 -1.7460 -6.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -1.6190 -5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0170 -4.5780 -6.7920 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -4.5260 -6.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 -4.4950 -5.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6340 -1.7870 -10.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -0.1710 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 1.3160 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 1.3400 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -0.7390 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 2.7120 -1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -1.3040 -3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 1.7700 -5.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 1.6190 -7.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0570 0.3220 -9.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -3.9550 -9.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -2.5220 -5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7690 -2.7020 -11.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 -5.5600 -7.7880 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 34 1 0 0 0 0 21 33 1 0 0 0 0 M CHG 1 34 -1 M END