IFLAB-ZINC00213998 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8180 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -3.1410 -3.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -3.9970 -4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -4.1990 -4.9330 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -4.8480 -6.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -5.2200 -6.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -5.0320 -6.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -5.5060 -7.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -6.1740 -8.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -6.3690 -8.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -5.8950 -7.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -5.9440 -7.9830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -6.3570 -8.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -5.3170 -6.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -5.0930 -6.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -5.4860 -7.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -4.4400 -5.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -4.1980 -4.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8480 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -4.5130 -5.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -5.3600 -7.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -6.5430 -9.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -6.8900 -9.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1930 -3.2460 -5.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 -5.0010 -5.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8310 -4.1680 -3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M END