KEYORGANICS-ZINC04105948 MOE2007 3D Structure written by MMmdl. 41 43 0 0 0 0 0 0 0 0999 V2000 0.6780 6.9140 7.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 7.4370 7.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 7.0180 5.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 6.0690 5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 5.5520 5.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 5.9720 7.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 5.6320 3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 5.9920 2.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 5.5580 1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 3.7090 2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 4.1340 3.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 3.5780 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 2.0780 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 1.3350 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.0570 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -0.7140 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0100 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 1.4020 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -2.4290 -0.4790 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 7.2400 8.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 8.1720 7.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 7.4410 5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 4.8160 5.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 5.5630 7.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 6.1740 3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 5.5200 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 7.0750 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 5.7380 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 6.0760 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 4.2060 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 2.6240 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 3.5350 4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 3.8980 4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 4.0180 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 3.9820 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.8290 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -0.6210 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 -0.5010 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 1.9490 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 4.0750 1.3700 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8790 3.5920 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 40 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END