BO31AR -OEChem-04022110182D 38 39 0 1 0 0 0 0 0999 V2000 2.8660 1.7383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1674 4.3801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0084 3.0929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7383 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2617 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 2.7328 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6808 2.9407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 1.3316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2383 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9595 3.4020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1238 2.5106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2472 3.1929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4892 3.5304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5956 1.6140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6823 2.4391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2016 0.7946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0132 0.9671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.3209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.3694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.8817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.0483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 4.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.4517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.4517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.0717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.0717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -4.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 13 1 0 0 0 0 2 33 1 0 0 0 0 3 13 2 0 0 0 0 4 20 1 0 0 0 0 4 38 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 12 6 1 1 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 6 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 19 2 0 0 0 0 17 35 1 0 0 0 0 18 20 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 M END $$$$