IBS-ZINC00489479 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 24 0 0 0 0 0 0 0 0999 V2000 0.0620 1.4400 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.0110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.6040 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 0.0530 2.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -2.0330 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.7270 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -2.0880 -1.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -2.6450 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -0.7130 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -0.1670 -2.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -4.0700 0.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -4.2160 1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -3.0060 2.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -2.8390 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -3.6730 4.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -3.1600 4.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 1.7990 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 1.8320 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 1.8170 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -5.1620 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -3.1380 4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -1.7870 3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -4.7800 4.7350 O 0 5 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 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 M CHG 1 23 -1 M END