ENAMINE-ZINC02649235 MOE2007 3D Structure written by MMmdl. 50 51 0 0 0 0 0 0 0 0999 V2000 0.2700 -2.0160 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -0.6170 -0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -0.1810 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 1.1350 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 2.0630 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 1.6210 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 0.2930 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 2.5330 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 3.3940 0.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 4.0000 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 3.4940 0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1530 4.4100 0.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 5.5940 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 5.6760 0.7770 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 6.9700 0.7620 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 6.3300 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3330 7.4470 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3390 8.2880 -0.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2260 7.4300 1.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3030 8.3940 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6340 7.7820 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7980 8.7490 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1350 8.1000 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3060 9.0500 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6920 8.4620 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7230 7.2710 0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -2.0500 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -2.7070 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -2.3710 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -0.8600 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 1.4120 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -0.0360 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 2.9060 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 3.3770 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 2.0150 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 3.9770 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6810 5.4890 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1460 5.9840 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1490 6.7210 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0800 9.2890 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3390 8.6820 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8090 6.8580 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5830 7.4960 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6470 9.6520 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8190 9.0630 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2730 7.1900 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1190 7.7910 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1850 9.9440 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3020 9.3790 1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6500 9.2580 0.7920 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 M CHG 1 50 -1 M END