PUBCHEM-ZINC01171242 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 0.0390 0.4210 1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -0.4910 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -0.8150 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 -1.6830 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -2.2410 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -1.9380 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -1.0730 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -2.4810 -2.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -1.9080 -3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -0.9910 -4.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -0.6080 -3.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -0.6430 -5.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 0.1560 -6.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.7370 -5.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 1.5120 -6.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 1.7120 -8.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 1.1350 -8.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 0.3500 -7.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -0.2800 -8.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -0.9780 -7.1880 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7830 -3.9340 -2.1800 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -4.0280 -3.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -4.1410 -0.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -5.1170 -2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -0.1610 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 0.9830 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 1.1530 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -0.3880 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -1.9200 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -2.9000 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -0.8460 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -2.7110 -4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -1.3280 -3.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -0.9950 -5.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 0.5970 -4.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 1.9590 -6.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 2.3150 -8.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 1.2970 -9.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -4.9210 -3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -6.1110 -2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -5.0560 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -0.0770 -9.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 2 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M CHG 1 20 -1 M END