IFLAB-ZINC04059553 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 -3.3090 -0.0300 -2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 -1.3280 -2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -1.4240 -2.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -2.5180 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -3.3680 -1.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -2.6780 -3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -3.6860 -2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -3.6320 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -4.5080 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 -4.2490 -4.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -3.1410 -4.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -2.3370 -5.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -2.5370 -4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -1.6040 -4.2560 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2380 -2.8570 -5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 -5.7040 -2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -4.6840 -1.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -5.9810 -2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -6.2780 -3.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -7.0620 -1.1770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0380 -6.9240 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -7.0040 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -8.0500 0.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -9.2800 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 -10.3960 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -11.6500 0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -11.7960 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -10.6890 -1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -9.4270 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -8.3460 -1.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 0.8210 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -0.0290 -3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 0.0430 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -1.3280 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -2.1780 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 -4.9020 -4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 -3.3590 -6.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3270 -1.7820 -5.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 -3.2240 -5.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -6.5750 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -5.8960 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2070 -5.5040 -1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -4.4470 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -7.1480 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -6.0380 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -10.2850 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -12.5180 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -12.7780 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -10.8060 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 17 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 16 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 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 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 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 M END