ENAMINE-ZINC05785754 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.1130 1.3080 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 0.0230 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -0.5150 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -1.2840 -1.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -2.5800 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -3.1820 -0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -3.2480 -2.4230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2880 -3.6710 -2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -1.8820 -3.3660 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -0.6590 -2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 0.6140 -2.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 1.1280 -3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 0.8780 -4.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 1.4000 -5.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 2.1700 -5.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 2.4220 -4.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 1.9020 -3.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 2.1670 -1.9620 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.2370 2.8420 -1.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 1.7110 -0.9410 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.1670 -4.3300 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -5.0600 -3.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 -4.7460 -4.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4280 -6.0620 -3.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6950 -6.8010 -4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -7.0330 -5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 -7.7620 -6.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 -8.2610 -6.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 -8.0320 -5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9680 -7.3080 -4.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 1.6930 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 1.9820 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.6510 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -1.1600 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 0.3150 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 0.2770 -4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 1.2070 -6.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 2.5760 -6.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0190 3.0240 -4.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -5.0350 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 -3.8670 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -6.2710 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -6.6430 -5.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -7.9420 -7.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 -8.8310 -7.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2210 -8.4230 -6.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7540 -7.1340 -4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END