PUBCHEM-ZINC05896068 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2180 3.9410 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 4.1120 -1.4250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3690 3.8140 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 5.6380 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 6.0320 -0.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 3.5470 -2.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 3.4290 -3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 3.7910 -4.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 2.8600 -4.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 2.4430 -3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 1.9130 -3.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9590 1.7920 -5.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 2.2030 -6.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 2.7300 -5.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 3.2380 -6.4140 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.3720 1.1230 -6.0070 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 4.0800 0.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 6.0020 -2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 6.0620 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 6.9880 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 3.2590 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 2.5370 -2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 1.5910 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 2.1070 -7.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 3.8080 0.4360 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END