IBS-ZINC00027063 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0030 1.4690 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0360 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -0.6360 0.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.7430 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -2.1200 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 -2.5210 0.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -1.6030 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -0.0430 0.1440 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 -1.8560 0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3140 -3.1720 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 -3.5210 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 -4.8220 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 -5.7780 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 -5.4340 -0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -4.1340 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -2.9900 0.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 1.8400 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 1.7910 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 1.8660 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -1.1210 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1720 -2.7750 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9750 -5.0930 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5740 -6.7950 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 -6.1830 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -3.8650 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -2.6420 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -3.9480 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 M END