IBS-ZINC05347438 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3740 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 1.2150 -0.6950 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0180 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4030 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 2.0810 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.5610 0.0070 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0920 4.1570 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 4.1820 0.0010 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7440 -0.6680 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -2.1310 -0.4310 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4900 -2.6830 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -2.7240 0.3790 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5820 -2.5400 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -2.0860 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.5940 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -4.0970 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -4.8130 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -4.2320 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -2.2090 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -2.7120 -2.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9020 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9570 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -0.1660 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -0.6230 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -2.4160 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -2.0790 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -4.4780 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -4.2740 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -4.6690 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -5.8780 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -4.4150 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -4.7040 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -1.7200 -2.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 -1.7930 -3.7340 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END