PUBCHEM-ZINC00498285 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.5670 1.5110 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 0.0200 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -0.6650 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -2.0340 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.7250 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -2.0520 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -0.6720 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 0.0540 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.2680 -2.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -0.6290 -3.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 0.0610 -4.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 1.2700 -4.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 1.9490 -6.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.4250 -7.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 0.2210 -7.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -0.4650 -5.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -0.3360 -8.2740 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5460 -1.3960 -8.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 0.2660 -9.3330 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5780 2.2810 -8.7590 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 2.0190 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 1.7810 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 1.8100 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -0.1320 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.5650 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -3.7930 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.5930 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -1.5990 -3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 1.6800 -4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 2.8900 -6.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -1.4080 -5.8270 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 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 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 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END