IFLAB-ZINC01110964 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.6120 -2.7230 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -2.0290 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -2.7210 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -2.0850 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -0.7540 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -0.0560 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.6940 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 0.0080 -2.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -0.4760 -3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 0.4330 -4.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 0.5130 -5.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 0.8590 -4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -0.0660 -3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 0.2230 -6.7750 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 0.8920 -7.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 0.4700 -7.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -1.5010 -6.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -1.9750 -7.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -3.3280 -7.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -4.2060 -7.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -3.7320 -7.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -2.3790 -7.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -5.6540 -7.4690 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1040 -6.0720 -7.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -6.4280 -7.5750 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8050 1.3950 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -2.7090 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -2.2070 -3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -3.7550 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -3.7610 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -2.6290 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -0.2600 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -0.4600 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -1.4950 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 1.4280 -4.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.0140 -5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 1.8960 -4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 0.7230 -4.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -1.0910 -3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 0.2480 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -1.2890 -6.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -3.6980 -7.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -4.4180 -7.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -2.0080 -7.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 1.4710 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 1.9270 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 1.8360 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END