ASINEX-ZINC04008993 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.1860 1.3920 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -0.0220 0.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4860 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -2.0000 1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -2.5810 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 -4.7950 3.2190 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1180 -4.2120 4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -5.1110 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -6.4800 3.9040 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -7.5500 3.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -5.9530 5.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -6.8990 4.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -6.1520 3.3650 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5290 -6.6920 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -5.8960 3.8230 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8050 1.7130 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 1.6850 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 1.8800 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -0.2120 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -0.0250 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -2.2560 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.4410 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -2.4000 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -2.1810 3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -5.4580 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 -4.2820 2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -7.9840 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -6.5540 5.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -4.0470 2.2020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3960 -4.2900 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -4.5050 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 6 29 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 15 -1 M CHG 1 29 1 M END