IBS-ZINC04122135 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0590 1.5090 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.0150 -0.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5680 -0.2380 -0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -0.6130 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -1.5070 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.6570 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1280 0.1390 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -1.4580 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 -1.1530 -1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 -1.8800 -3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -2.9230 -3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -3.2390 -2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -2.5120 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -1.8790 3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -1.1880 4.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -2.0970 5.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -3.2120 5.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -1.6280 6.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 -0.3650 6.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 0.0330 7.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 -0.8250 8.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -2.0950 8.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -2.4910 7.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -3.0020 9.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 -2.6400 10.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 -1.1640 10.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 -0.3600 9.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 1.9550 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 1.9250 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.8210 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -1.5490 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 0.0750 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -1.3950 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -2.5680 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -0.3420 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1470 -1.6310 -3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -3.4870 -4.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -4.0520 -3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.7840 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -2.7840 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -2.1440 3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -0.9560 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -0.2640 4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 0.3370 5.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 1.0170 7.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -3.4800 7.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1130 -3.2490 11.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9700 -2.8930 9.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 -0.9050 11.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 -0.9020 11.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -0.9510 2.1400 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6350 -0.0750 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 51 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 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 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END