ENAMINE-ZINC05072713 MOE2007 3D Structure written by MMmdl. 44 47 0 0 0 0 0 0 0 0999 V2000 10.1590 15.0670 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4690 14.8690 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4840 13.8820 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1770 13.0810 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1890 12.0820 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8800 11.2790 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5840 11.4940 -2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5710 12.4840 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8780 13.2840 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8660 14.2800 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8440 10.2430 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4430 9.2930 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 8.5280 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 9.0740 0.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 8.8210 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 10.0780 0.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 7.4330 -1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 7.2380 -2.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 6.6330 -0.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 5.6360 -1.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 4.9210 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 3.8240 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 3.3490 -2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 2.2800 -2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 1.6760 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 2.1490 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 3.2360 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 3.7180 1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 4.9500 1.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9250 15.8350 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6960 15.4810 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 13.7440 2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 11.9280 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3830 10.9050 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 12.6240 -3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4170 14.4520 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8270 9.1600 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 6.7490 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 5.1090 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 3.8020 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 1.9170 -3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 0.8390 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 1.6700 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 2.8530 2.5960 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 M CHG 1 44 -1 M END