IFLAB-ZINC04167387 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 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 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8010 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -2.5480 -0.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.3610 -2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -4.1690 -2.4960 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -4.5460 -3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -5.7370 -4.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -5.7770 -5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -4.6340 -6.1840 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -3.4330 -5.1460 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -7.0680 -6.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -7.0820 -7.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -8.2860 -8.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 -9.4770 -7.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -9.4680 -6.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -8.2700 -5.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -10.7880 -8.0690 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -2.0270 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -2.0110 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 -6.1530 -7.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 -8.2990 -8.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -10.4010 -5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -8.2650 -4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6620 -11.0940 -7.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -11.5480 -7.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 -10.6710 -9.1520 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 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 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 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 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 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 M END