IFLAB-ZINC04569397 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.0510 1.2380 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.1880 -0.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.7830 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -2.1650 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -2.7670 1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -1.9940 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -0.6170 2.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -0.0100 1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -2.7650 4.3680 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -1.8500 5.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -4.0930 4.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -2.8900 4.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 -1.8320 4.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3480 -2.1680 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3630 -3.7190 3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 -4.0750 3.4810 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4400 -4.3290 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -5.2540 4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 -4.8630 5.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -5.7750 6.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 -6.9190 6.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7560 -5.3760 8.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1040 -4.2320 8.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8150 -6.2880 9.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -5.8970 10.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2650 -7.0910 11.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3500 -7.4620 11.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 1.6600 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.5830 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 1.5590 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -2.7690 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -3.8420 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -0.0150 3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 1.0660 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 -0.8540 4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 -1.8560 5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1110 -1.8170 2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 -1.7550 3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 -4.1350 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9400 -4.0670 4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 -5.5390 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 -6.0980 4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 -3.9480 5.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5380 -7.2020 8.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3210 -5.5280 10.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 -5.1110 10.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 -7.6420 11.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3260 -8.3180 12.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 -6.9110 11.8480 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END