B80XLB -OEChem-04022103293D 40 44 0 0 0 0 0 0 0999 V2000 -2.8442 -2.1721 -0.6416 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5452 0.8028 -0.6954 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4995 -0.9689 0.6459 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4296 1.6412 -2.0291 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1414 -0.9253 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9239 -0.3422 0.2332 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3812 -0.2592 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8965 -1.2768 -0.0765 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3599 1.0399 0.6075 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9263 0.9504 0.7911 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4942 -2.3925 -0.6121 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1401 1.6247 0.9716 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4956 -1.1319 0.1128 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6022 -0.8568 -0.3262 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 1.7119 0.7866 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3414 -0.1831 -0.4326 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7836 -0.1754 -0.1192 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8386 0.6291 -0.2744 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7978 -0.1658 -0.1365 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 -0.4828 0.5616 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7863 1.1130 0.4176 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0157 1.3277 -0.5448 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9642 -0.9388 1.1727 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 0.8603 0.0719 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1579 -0.2527 0.9157 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8367 0.8232 -1.3136 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 -2.8318 -0.9891 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0005 1.4325 1.0931 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0853 -3.3250 -0.9772 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1171 2.6224 1.4067 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9537 -1.8958 0.7413 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6355 -1.8526 -0.7599 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6014 2.7113 1.2166 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7403 -0.6247 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2361 1.5343 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7208 1.6476 0.5634 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0311 2.1912 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9568 -1.8025 1.8299 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1221 1.3735 -0.1096 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0799 -0.5924 1.3806 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 11 1 0 0 0 0 1 27 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 2 35 1 0 0 0 0 3 17 2 0 0 0 0 3 20 1 0 0 0 0 4 26 3 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 7 9 1 0 0 0 0 7 14 2 0 0 0 0 8 11 2 0 0 0 0 8 13 1 0 0 0 0 9 12 1 0 0 0 0 9 15 2 0 0 0 0 10 12 2 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 13 16 2 0 0 0 0 13 31 1 0 0 0 0 14 19 1 0 0 0 0 14 32 1 0 0 0 0 15 21 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 18 20 1 0 0 0 0 18 22 2 0 0 0 0 19 21 2 0 0 0 0 19 34 1 0 0 0 0 20 23 2 0 0 0 0 21 36 1 0 0 0 0 22 24 1 0 0 0 0 22 37 1 0 0 0 0 23 25 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$