BX9A4E -OEChem-04022109523D 34 37 0 0 0 0 0 0 0999 V2000 -2.3780 2.9744 -0.1779 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4024 -2.1463 -0.1307 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1475 0.0802 0.1068 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5288 4.1483 0.0129 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6239 -3.2383 -0.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4558 -0.1722 0.2928 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3328 -1.4773 0.9423 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8241 0.2082 -0.0584 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0442 -2.5289 0.0991 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 -0.9170 -0.8575 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4067 0.6927 0.1861 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9565 0.8578 -0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5701 2.0331 0.1584 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8649 2.2252 -0.0369 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2927 0.3965 -0.0929 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3845 2.9305 0.0393 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6608 -1.0063 -0.0779 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1776 1.4518 -0.1942 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8754 -1.5338 0.4218 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -2.0830 -0.5299 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8042 -2.8954 0.2396 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2925 -1.7826 1.0974 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8048 -1.4144 1.9305 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3877 0.3872 0.8651 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8766 1.1144 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0509 -3.4889 0.6247 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5409 -2.6781 -0.8637 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9873 -1.0460 -1.8332 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5272 -0.6917 -1.0359 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5307 2.5273 0.2431 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2551 1.4187 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7055 -1.0007 0.8641 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9642 -2.1985 -0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4733 -3.7149 0.4577 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 18 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 4 16 2 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 13 30 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 2 0 0 0 0 17 19 1 0 0 0 0 17 20 2 0 0 0 0 18 31 1 0 0 0 0 19 21 2 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 M END $$$$