ENAMINE-ZINC02667968 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.4540 0.5960 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -0.5120 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -0.3410 0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -1.6990 -0.6930 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -2.9530 0.0810 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0700 -2.9650 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -3.1780 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -2.1020 2.3290 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 -2.2380 2.6260 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3830 -3.2370 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 -1.1710 1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 -1.3820 1.9130 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.9400 -0.5100 2.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7520 -2.4060 1.3960 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.3850 -2.1460 4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 -0.9700 4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4270 -0.8860 6.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 -1.9870 6.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 -3.1360 6.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 -3.2490 4.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 -4.1010 6.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9030 -3.4250 8.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3730 -2.0840 8.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -4.1790 -0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -3.9970 -1.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 0.5410 -2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 0.5140 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 1.5610 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -1.7910 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -2.9880 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -4.2110 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 -0.1470 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5850 -1.2490 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 -0.1070 4.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 0.0140 6.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -4.1710 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 -3.3800 8.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 -4.0070 8.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -5.1870 -0.4610 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 39 -1 M END