IBS-ZINC00235299 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4130 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 1.8540 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 3.1040 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 3.1930 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 2.0430 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9570 0.7990 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 0.6880 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -0.4060 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 -1.7430 -0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -2.3580 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 -3.7640 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 -4.4290 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 -5.7450 -2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5900 -6.4110 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -5.7640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9900 -4.4410 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 -6.4490 -3.6860 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3910 -5.8650 -4.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9460 -7.6110 -3.6910 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 4.0020 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 4.1620 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6270 2.1230 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 -0.0910 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -1.8380 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 -3.9130 -3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 -7.4420 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 -6.2910 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 -3.8030 1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 -3.8820 1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 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 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END