IFLAB-ZINC04279607 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.0320 1.7030 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 0.6410 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -0.1290 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 0.1500 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 1.2270 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 1.9960 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -0.6610 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -0.0610 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 -0.8330 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9740 -2.2220 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 -2.8350 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -2.0590 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1850 -2.8560 -0.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1770 -4.2810 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6370 -4.7380 -0.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2270 -4.2120 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7420 -6.2570 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4140 -8.0640 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7140 -8.5110 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5430 -8.0880 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8200 -6.7500 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1780 -4.3670 -1.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9210 -3.4340 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 2.3020 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 0.4120 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -0.9460 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 1.4680 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 2.8230 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9620 1.0180 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 -0.3430 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 -3.9090 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -2.5610 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7380 -4.5680 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 -4.7220 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3430 -6.5350 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2140 -6.8170 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5780 -8.7140 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4690 -7.9430 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5630 -7.9860 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8800 -9.5870 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4960 -8.0150 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9210 -8.8170 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5090 -5.9020 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0460 -6.6760 -2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1850 -6.7100 0.0570 N 0 3 0 0 0 0 0 0 0 0 0 0 10.7360 -6.0340 0.6030 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 24 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END