SIAL-ZINC04517817 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.0770 1.3460 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.0010 0.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -0.6120 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.1780 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 1.5440 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 2.1990 0.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 2.0690 -0.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 1.0220 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -0.1390 -0.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 3.4780 -0.4210 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9960 4.0040 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 4.0920 -1.8270 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9360 3.3860 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 4.4740 -1.7200 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1010 3.5590 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6770 4.7790 -0.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1680 5.7210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 3.6930 0.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 4.9140 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7190 5.9420 -0.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6830 5.7320 -2.3090 P 0 0 0 0 0 0 0 0 0 0 0 0 8.3370 4.4040 -2.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0570 5.5360 -2.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 5.2160 -1.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 4.8650 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 3.7560 -2.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 6.0170 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 5.5590 -2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 6.6240 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 7.6040 -1.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -1.9830 -0.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 1.7980 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 1.1610 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 5.1880 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6920 3.9750 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 6.4410 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 6.7790 -3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 5.2320 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 4.6930 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -2.4950 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -2.4400 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1210 7.0110 -2.9790 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.6990 6.3920 -2.3920 O 0 5 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 32 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 36 1 0 0 0 0 27 37 1 0 0 0 0 28 29 1 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 29 30 2 0 0 0 0 29 43 1 0 0 0 0 31 40 1 0 0 0 0 31 41 1 0 0 0 0 M CHG 1 42 -1 M CHG 1 43 -1 M END