D16MLK -OEChem-03302104333D 22 21 0 0 0 0 0 0 0999 V2000 4.5589 0.3497 -0.0046 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5793 -0.4402 0.0085 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3462 -0.2677 0.0018 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5858 0.4362 0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8965 -0.3536 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8123 0.3345 0.0175 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1346 0.5445 -0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0127 -0.6032 -0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5665 1.0839 0.8894 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.0843 -0.8807 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9284 -0.9958 0.8963 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9164 -1.0211 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5556 -1.0459 -0.8113 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8504 0.9528 0.9231 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8401 1.0027 -0.8526 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1295 1.1717 -0.9155 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1337 1.2075 0.8542 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0001 -1.2223 -0.9195 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0122 -1.2706 0.8523 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3697 -0.8686 -0.8211 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1613 0.3404 -0.0652 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3771 0.9272 1.1921 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 22 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 2 13 1 0 0 0 0 3 7 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 M END $$$$