IBS-ZINC06759819 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 0.3620 1.3980 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -0.0900 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -0.4720 -0.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8320 -0.0930 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -2.0310 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -2.5520 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 0.0470 1.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 1.2810 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 2.1050 0.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 1.5210 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 2.9080 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 3.1940 3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 3.0400 4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1070 3.3940 5.5710 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 3.3710 6.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 3.7840 6.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 3.6680 5.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 4.0050 5.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 4.4450 6.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 4.5510 7.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 4.2230 7.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 1.5840 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 1.7700 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 1.9790 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.6230 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -0.4080 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -0.6300 1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 0.7470 2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 1.4000 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 3.6770 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 2.9960 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8480 2.7020 3.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 3.9210 4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 4.7020 6.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8880 4.8940 8.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2700 4.3040 8.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -2.5790 -1.1550 O 0 5 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 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 M CHG 1 37 -1 M END