IBS-ZINC00495392 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 1 0 0 0 0 0999 V2000 0.0300 1.5070 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -0.0220 -0.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6230 -0.3730 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -0.5100 1.2560 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7820 -0.1190 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -2.0250 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -2.7840 0.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.3530 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -1.2680 3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -1.3260 4.5040 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.1210 2.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -3.6690 2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -4.1380 4.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -5.4360 4.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -6.2670 3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -5.8030 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -4.5050 2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.5350 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 1.8980 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 1.8550 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 1.8580 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 0.7820 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -3.4890 4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -5.8010 5.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -7.2810 4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 -6.4550 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -4.1420 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -0.2620 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 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 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 M END