IFLAB-ZINC04166894 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -2.3110 -1.2670 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -2.8040 -0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -2.8270 -1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -2.7060 -2.6650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -2.3500 -2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -3.1320 -4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 -2.7650 -4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9570 -3.6860 -4.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4990 -2.8620 -4.4100 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6580 -1.3160 -4.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -1.5220 -4.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3000 0.0040 -4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6880 0.1060 -4.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2400 1.3630 -4.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4090 2.4690 -4.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1040 2.3430 -4.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 1.1670 -4.6940 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 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -3.1730 -3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -1.2810 -3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -2.5960 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -4.2010 -3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -2.8860 -4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 -4.7520 -4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3140 -0.7750 -4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3080 1.4800 -5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8370 3.4520 -5.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 1.1040 -4.5900 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 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 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 20 37 1 0 0 0 0 M END