IFLAB-ZINC02711596 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.7000 -0.6320 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -0.3510 1.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 -0.3380 -1.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -2.2790 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -3.1430 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -4.5570 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -4.3330 -0.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -3.0710 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -2.4260 -2.7480 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -3.9600 -3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -3.6460 -5.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -3.3810 -5.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -3.0920 -7.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -3.0680 -7.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7310 -3.3330 -7.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -3.6280 -5.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -3.9680 -4.9640 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -2.8880 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 -3.0680 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -5.0060 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -5.1860 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -4.4460 -3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -4.6260 -3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -3.4000 -5.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -2.8850 -7.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -2.8420 -8.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -3.3140 -7.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 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 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 M END