IFLAB-ZINC05146639 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6880 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9270 -0.1170 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8620 -1.1440 -0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2290 -1.2980 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7310 -2.5210 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 -3.6100 -0.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -2.3010 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -2.0270 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1370 -0.0960 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3280 0.3860 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 -0.1910 -2.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1070 1.4570 -1.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3140 1.9520 -3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7140 3.3550 -3.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1530 4.2000 -2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0620 5.5800 -2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4380 6.4120 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9090 5.8710 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0030 4.5010 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6300 3.6630 -0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7780 2.1800 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9840 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 0.9420 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7750 -2.7980 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6900 0.6990 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1040 -0.3690 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3810 1.9930 -3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8150 1.2920 -3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0390 3.8260 -4.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 3.2800 -3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6930 6.0050 -3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3650 7.4840 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2020 6.5180 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3700 4.0780 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3310 1.9000 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8370 1.9220 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 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 27 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END