PUBCHEM-ZINC05968116 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 0.0510 1.4940 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -0.0130 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -0.6830 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -2.0620 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.7810 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -2.1000 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.7200 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -4.2620 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -4.9460 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -6.4080 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -7.1670 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -8.5370 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -9.1700 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -8.4230 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -7.0510 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -9.1040 -0.9620 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6900 -8.4500 -0.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 -10.3180 -1.0530 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0880 -4.9740 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -5.5390 1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 1.8530 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 1.8460 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.8730 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -0.1250 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -2.5840 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -2.6510 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.1920 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -4.4130 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -6.6760 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 -9.1230 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -6.4710 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -10.5230 -0.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -10.8500 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 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 8 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 3 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END