ENAMINE-ZINC04485643 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.5200 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0100 -0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5110 -0.3690 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5010 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -0.8810 2.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -0.5190 1.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -0.8830 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -1.8580 3.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -2.2180 4.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 -1.6080 4.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -0.6300 3.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 -0.2740 2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8030 -0.1900 4.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1870 -1.1940 5.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -1.7800 5.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -0.6340 0.0180 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -0.0540 -1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 0.6310 -2.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 0.9140 -3.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 1.6020 -4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 1.7250 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 1.1720 -5.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 0.4900 -4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 0.3550 -3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -0.2570 -2.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -0.9830 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -0.0250 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7120 0.0710 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 1.8950 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.8750 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.8790 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -0.2790 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -2.3340 2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -2.9770 5.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 0.4810 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8280 -1.9420 4.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 -0.7370 6.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 2.0360 -4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 2.2570 -6.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 1.2760 -6.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 0.0610 -4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 -1.4390 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -1.7600 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 0.5820 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1880 -0.5360 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3000 0.7580 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 M END