NCID-ZINC01689566 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.8060 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -0.3340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 0.5870 0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -1.6060 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 -1.8960 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -2.7980 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 -3.9210 -1.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -3.6310 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -2.7290 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 -5.1940 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 -5.4210 -1.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -6.5280 -1.2060 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -7.9300 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1830 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1670 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1570 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -2.4070 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -0.9650 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -3.1800 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -2.2290 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -4.5620 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -3.1210 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -2.3480 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -3.3000 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 -8.8620 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -7.8920 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -7.8820 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 M END