KEYORGANICS-ZINC04024736 MOE2007 3D Structure written by MMmdl. 37 39 0 0 0 0 0 0 0 0999 V2000 0.8570 6.9640 8.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 5.6060 7.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 5.5770 5.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 5.7030 4.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 6.8270 4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 6.8720 6.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 4.8280 3.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 3.7940 3.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 3.1080 2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 3.5980 1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 4.9620 2.2640 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 3.1220 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 1.7040 0.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 0.6580 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -0.4840 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 1.2140 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 6.9900 9.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 7.8970 8.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 6.1020 8.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 4.7350 7.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 5.6490 8.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 4.6560 5.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 6.4100 5.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 7.7590 4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 6.7930 4.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 6.0050 6.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 7.7940 6.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 2.2480 2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 3.2550 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 3.6700 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 0.8680 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -1.5230 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 1.7820 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 6.8460 7.3400 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0790 7.6680 7.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.1070 0.6460 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6780 -0.7400 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 15 36 1 0 0 0 0 16 33 1 0 0 0 0 16 36 2 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 34 1 M CHG 1 36 1 M END