IBS-ZINC05325163 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.0050 0.8280 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 1.0650 2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 3.0050 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 3.4410 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 4.9600 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 5.4210 -1.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 6.7790 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 7.6130 -0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 7.1480 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 8.4080 -2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 8.3540 -3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0440 9.2980 -4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7640 8.8860 -5.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7060 7.5690 -5.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9230 6.6190 -5.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 7.0430 -4.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 6.3420 -3.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 5.3680 -3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7400 10.0300 -6.3170 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.2500 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 1.2210 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.0340 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.4240 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.0260 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 1.4960 3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 3.3620 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 3.3800 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 3.1060 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 2.9860 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 5.3230 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 5.4300 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 4.7410 -1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 9.2800 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 10.3260 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2720 7.2670 -6.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8760 5.5940 -5.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 1.4940 1.2020 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6570 1.1470 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 37 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 37 1 M END