IBS-ZINC04029213 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 1 0 0 0 0 0999 V2000 -0.1270 1.9050 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 0.5400 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.3500 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 0.1790 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 1.5430 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 2.4190 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 1.7070 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 0.4650 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -0.4570 0.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 -1.4570 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6890 0.1660 -0.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7630 -0.3040 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 2.5490 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 2.9310 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3610 -0.7140 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -0.8200 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5820 -1.6290 3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7270 -2.3250 2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2140 -2.2050 1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5380 -1.3960 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0370 -1.2160 -0.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 2.5770 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 0.1600 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -1.4120 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 3.4840 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5960 2.1560 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4320 3.4040 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 3.5930 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 3.4820 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 -0.2760 2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 -1.7110 4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2470 -2.9510 3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1220 -2.7350 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7920 -1.8200 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4510 1.4720 -0.2440 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6430 1.8050 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3650 1.2440 -0.6610 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 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 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 35 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 35 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 34 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 M CHG 1 35 1 M END