IBS-ZINC00554201 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 1.2270 -2.4900 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -2.0160 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -0.4870 -1.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0910 -0.1100 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 0.0400 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 1.5650 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 2.0740 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 1.2940 -1.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 3.3960 -0.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 3.8780 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 3.2600 -1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2360 3.7390 -1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5810 4.8320 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6310 5.4490 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 4.9780 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0040 6.6180 0.6370 N 0 3 0 0 0 0 0 0 0 0 0 0 8.1480 7.0360 0.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1680 7.1620 1.3350 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1310 -0.0210 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 0.6630 -3.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -2.1890 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -2.0420 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -3.5760 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -2.3910 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -2.3940 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -0.3880 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -0.2430 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 1.9970 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 1.8510 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 4.0130 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 2.4060 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9810 3.2580 -2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5950 5.2040 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 5.4640 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -0.3650 -2.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -0.0420 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 19 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 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 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END