ENAMINE-ZINC05748971 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -0.4710 1.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.3810 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -0.5180 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -0.8130 -2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -0.9720 -3.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -0.8360 -3.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.5450 -2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -1.0060 -5.1040 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1620 -0.8860 -5.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -1.2650 -6.1400 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0340 -1.3480 -5.3410 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 -0.9660 -5.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -3.1560 -5.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -3.6410 -6.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1330 -2.8470 -7.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -0.3930 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -0.9190 -2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -0.4420 -2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -3.5920 -4.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -3.4570 -5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -4.9540 -6.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 -5.2160 -7.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END