IFLAB-ZINC05255532 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.6130 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 0.0510 1.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -1.9580 1.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -2.6470 2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -3.4440 2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -4.2150 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -3.9190 0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -5.0200 -0.0970 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -5.8820 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -5.3540 2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -5.8730 3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -6.2860 4.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 -6.9700 1.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 -7.4150 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 -6.8610 -0.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 -8.5740 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 -9.2120 1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 -10.2950 1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -10.7490 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0370 -10.1220 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -9.0340 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 -8.2440 -2.2220 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.7900 -11.0900 3.2780 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.7850 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -3.3250 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -1.9120 2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -4.1430 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -2.7610 3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -7.4120 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 -8.8600 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8840 -11.5970 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5590 -10.4820 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -2.1830 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -3.1890 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 3 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 M END