CHEMBRIDGE-ZINC03103385 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0130 -0.4010 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -0.5420 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -1.3100 0.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -1.4600 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -0.6260 -1.4290 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -2.1660 -0.9920 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1970 -2.8170 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -3.5170 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4100 -2.8500 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3530 -3.5340 -2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 -4.8490 -2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 -5.4520 -2.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 -4.8340 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 0.2960 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -1.1780 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -2.2330 -1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 -2.0660 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -3.5450 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 -1.8220 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2660 -3.0460 -2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8400 -5.3890 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 -5.3620 -1.0050 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 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 21 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 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 15 27 1 0 0 0 0 M END