IBS-ZINC06366387 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 -2.3610 1.8520 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 0.4030 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -0.2760 0.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6690 -0.1060 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 0.3440 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -1.7270 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -2.3820 -1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -1.9530 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -2.9330 -3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -4.2900 -3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -4.7060 -1.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -3.7350 -0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -3.9140 0.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -2.6970 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -2.3600 2.6070 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -1.6550 2.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -1.5430 3.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 2.2580 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 1.9320 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 2.4790 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 -0.1510 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 0.3720 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 1.3660 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -0.2320 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 0.3900 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -0.9030 -2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -2.6280 -4.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -5.0320 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -5.7590 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -3.6900 3.1990 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 30 1 0 0 0 0 M CHG 1 30 -1 M END