IBS-ZINC05215431 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 -0.3510 1.7420 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 0.2260 -0.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2160 -0.2210 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -0.0960 0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -1.6120 1.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3030 -1.8440 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -2.1310 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -1.8000 -1.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -0.3470 -1.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -2.3680 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -3.2980 -3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -3.8400 -4.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -3.4520 -4.6890 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -2.5680 -3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -2.0290 -2.8770 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 -2.0960 -4.3980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -4.7700 -5.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -3.7010 -2.8680 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7920 -3.0850 -3.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -4.6480 -2.1220 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6530 -2.2800 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 2.1880 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 1.9700 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 2.1500 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 0.3830 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 0.2720 1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -1.6660 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -3.2130 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.1320 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 0.1100 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -5.0480 -4.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -5.1430 -5.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -2.0480 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -3.3590 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -1.9070 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 29 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 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END