IFLAB-ZINC04039949 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 0.2250 1.4710 -0.2090 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 0.0360 -0.5030 1.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -1.7800 1.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -2.2840 2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -3.6440 2.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -4.2040 4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -1.2140 3.9900 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -0.8820 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -1.9670 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -2.7860 -2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -2.5350 -3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -1.4590 -3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.6300 -2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -3.3460 -4.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 1.6600 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 1.8000 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 2.0200 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -4.2330 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -3.9210 4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -3.8180 4.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -5.2910 4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -2.1660 5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -2.1630 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -3.6250 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -1.2680 -4.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 0.2090 -2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -3.0660 -4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 M END