IFLAB-ZINC04064067 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 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 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.7500 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -2.2020 2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -0.7020 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -1.1640 2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 -1.3760 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 -1.1270 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -0.6640 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -0.4590 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2770 -1.3530 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8650 -1.7560 1.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 -1.1130 -0.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3240 -1.3260 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0370 -1.7490 0.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3610 -1.9060 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3450 -2.3520 1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6570 -2.4490 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0400 -2.1120 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0920 -1.6740 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7560 -1.5700 -0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3300 -1.0620 -1.6130 S 0 0 0 0 0 0 0 0 0 0 0 0 14.3430 -2.2120 -0.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2680 -2.6710 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6740 -2.7180 -0.1720 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 -1.0200 -0.3810 0.0100 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 0.6260 -0.5790 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -0.0820 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -2.3960 3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -2.3730 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -2.8710 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -1.3550 3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -1.7330 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -0.4720 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -0.1060 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4870 -0.7920 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0630 -2.6170 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4000 -2.7910 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3880 -1.4120 -2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2580 -1.9900 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9800 -3.6690 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6840 -3.3990 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9620 -1.7200 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3790 -3.0680 0.5820 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 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M END