IFLAB-ZINC02468188 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.7720 -2.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -3.7860 -2.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -4.1690 -4.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -2.5800 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -1.4010 -3.5240 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -1.7410 -5.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 -0.8230 -5.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 -0.0180 -4.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -0.8970 -6.6310 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6940 -0.0470 -6.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2240 0.9430 -6.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2440 1.4840 -6.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2790 0.8410 -7.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 0.0010 -7.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1620 2.5910 -6.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8400 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1650 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8530 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1430 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -4.1950 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -4.9470 -4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -1.5740 -5.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -2.7770 -5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 -1.5410 -7.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8910 1.2040 -5.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7400 3.5530 -6.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1380 2.4670 -6.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2720 2.5550 -5.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -3.0360 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -3.7850 2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -2.2450 3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -3.4200 -4.4230 N 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 42 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END