SIAL-ZINC04517585 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 1 0 0 0 0 0999 V2000 -0.0210 1.3700 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.0140 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -0.6550 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 0.0420 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 1.3980 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 2.0610 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 3.5130 0.5350 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0290 4.0990 0.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 4.1240 0.7700 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7100 -0.6660 0.0080 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7830 -1.7980 0.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 -0.1170 -0.4300 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2850 -2.0260 -0.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.7840 -0.6910 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7050 -2.1580 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -4.0230 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -3.5910 -2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -4.8120 -3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -5.9190 -3.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -4.6740 -5.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -3.2080 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -2.9080 1.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 1.8910 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -0.5250 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 1.9400 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 -2.4760 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -4.6040 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -4.6330 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -3.0100 -3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -2.9810 -2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -3.7890 -5.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -5.4600 -5.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -3.9190 0.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -4.1680 1.6530 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 13 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 25 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 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 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 2 0 0 0 0 18 20 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 22 2 0 0 0 0 21 33 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 10 1 M CHG 1 12 -1 M END