IFLAB-ZINC02701406 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 -0.7810 -1.2360 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -0.2160 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -0.4740 0.4400 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9490 -0.4190 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -1.8020 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -1.6940 2.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -2.5830 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 2.0290 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 2.7690 2.3160 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8130 2.9070 3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 4.1060 1.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 4.8330 3.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 5.5420 3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 6.6100 2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 7.3640 2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9810 7.0630 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8390 6.0090 4.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6650 5.2490 4.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 4.1140 4.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 3.0880 4.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1330 4.2390 6.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 1.8770 2.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0650 2.3910 3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.9330 -2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -2.2270 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -1.3170 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -0.1980 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 0.7720 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 -1.9890 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -2.6540 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 2.0540 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 2.3990 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 4.6930 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 3.9260 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 6.8660 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 8.1920 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8950 7.6520 3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6620 5.7920 4.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 5.2780 6.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 3.8490 6.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5320 3.6620 7.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 0.5970 1.4970 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7390 0.4760 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 0.4200 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 42 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 42 1 M END