B8OEH6 -OEChem-04022101513D 36 38 0 1 0 0 0 0 0999 V2000 -5.2546 0.2191 -1.0219 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3634 -1.7628 -0.0834 N 0 0 2 0 0 0 0 0 0 0 0 0 -0.0642 0.5396 1.0092 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4734 0.9407 -1.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8376 -0.6098 0.7374 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0564 -2.0099 0.1916 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 0.4811 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8823 -0.7506 0.0444 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1258 -0.0608 0.1121 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1458 -2.9799 0.1428 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3665 1.6411 1.8578 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1904 -0.8335 -0.4573 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1956 1.6097 0.4273 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3252 -0.1271 0.8123 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0988 0.5056 -1.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9892 0.3032 -0.5291 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4924 1.5236 -0.0869 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4606 0.3831 0.2036 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2891 0.9875 -1.6782 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0788 -1.0093 1.7335 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2057 -2.4000 1.2074 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4241 -2.7649 -0.5142 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1955 -2.8340 -0.1314 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7744 -3.7945 -0.4892 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1036 -3.3111 1.1866 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2993 1.4056 2.3806 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3777 1.8559 2.6329 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5347 2.5446 1.2625 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5821 -1.7939 -0.7848 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8466 2.5857 0.7563 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3846 -0.5619 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1826 0.5764 -1.7338 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1088 2.4174 -0.1365 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4210 0.3554 0.7078 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3214 1.4389 -2.6643 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4323 -0.7017 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 36 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 10 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 3 11 1 0 0 0 0 4 18 2 0 0 0 0 4 19 1 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 12 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 16 2 0 0 0 0 12 29 1 0 0 0 0 13 17 2 0 0 0 0 13 30 1 0 0 0 0 14 18 1 0 0 0 0 14 31 1 0 0 0 0 15 19 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 M END $$$$