PUBCHEM-ZINC06613146 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -4.3100 0.2160 -0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -1.0790 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -1.4990 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 -2.7000 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -3.4980 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -3.0950 -0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -1.8950 -1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -1.4620 -2.9030 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -2.9690 2.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -4.1930 3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -4.3380 4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -3.4570 5.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -5.5940 5.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -6.1190 6.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -5.2400 7.7560 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -7.4870 6.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -8.3610 7.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -7.8850 7.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -8.7650 8.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -10.1360 8.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -10.6550 7.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -9.7610 6.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -10.3120 6.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -12.1560 7.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -12.5820 6.2300 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.6620 0.9020 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 0.0360 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 0.7190 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 -0.8850 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -4.4350 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -3.7260 -1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -5.0400 2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -4.2250 2.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -6.2300 4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -7.9470 5.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -6.8270 7.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -8.3810 9.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -10.8180 9.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -10.4450 5.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -11.2640 6.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -9.6510 6.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -12.8690 8.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 9 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 31 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 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 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 2 0 0 0 0 M CHG 1 25 -1 M END