IFLAB-ZINC04315366 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 0.0620 -0.0790 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 0.0910 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 0.4510 1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 0.6350 0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 0.4590 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 0.1020 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 0.7100 -0.9070 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 0.6720 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 1.0200 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 0.9810 1.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 1.3390 0.1760 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3360 0.6880 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0860 2.8000 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5680 3.1620 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1640 2.8690 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4740 1.0480 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 1.0130 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0890 0.6880 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4850 0.4930 1.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8770 0.6220 3.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2850 0.3020 3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8940 0.1730 4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8380 -1.0510 5.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3600 -1.1600 6.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9340 -0.0470 7.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9930 1.1750 6.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4710 1.2870 5.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4330 -0.1530 8.7920 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.3580 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -0.0560 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 0.5840 2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -0.0310 -2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 2.9780 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 3.4710 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1130 2.5990 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6950 4.2250 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2440 3.0470 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6950 3.4740 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0020 1.6200 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4080 -0.0210 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 0.1050 3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5110 1.8270 3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4990 0.7960 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4000 -0.6300 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7810 1.0900 3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3860 -1.9240 5.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3220 -2.1040 7.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4430 2.0310 7.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5150 2.2480 5.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9350 1.4170 1.5470 N 0 3 0 0 0 0 0 0 0 0 0 0 8.4190 0.8590 0.8190 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 50 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 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 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END