IFLAB-ZINC04519551 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 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 1.1950 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 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -4.8650 -1.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -4.8790 1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -5.0080 -0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1600 -4.6800 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -6.5290 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -7.1590 -1.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -8.5020 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -9.1920 -0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -9.1320 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -10.4770 -2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -10.7930 -3.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -9.7450 -4.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -8.2770 -3.5920 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -4.3600 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -3.5160 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -3.0480 2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -3.5110 3.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -4.6080 2.8550 S 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 0.0160 -2.6060 -2.1450 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 -1.3240 -6.8580 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -6.8160 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -6.6090 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -11.2180 -1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -11.8130 -3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -9.8180 -5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -3.2200 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 -2.3590 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -3.2560 4.3950 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 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 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 M END