BU2M9Q -OEChem-04042107373D 35 38 0 0 0 0 0 0 0999 V2000 0.0585 -0.5851 1.9108 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0045 -1.5504 -0.3071 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3959 -0.2527 1.8285 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -0.4964 -0.6896 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0856 0.4815 -0.3716 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2728 -0.2122 -0.1271 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2729 -0.2116 -0.1655 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6924 -1.7262 -0.6559 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6889 0.0114 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2588 -0.2665 -1.0311 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3248 -0.0231 0.8074 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1009 -0.3817 1.3163 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0842 1.8857 -0.2548 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4635 0.4308 0.2298 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9582 -2.6277 -0.1527 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4135 0.2268 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6876 0.1526 0.9464 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2679 2.5423 0.1015 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4380 1.8241 0.3396 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7958 0.4075 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4266 0.3707 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2845 -2.7114 -0.8413 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -0.1347 -2.0927 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1806 2.4606 -0.4365 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3777 -0.1225 0.4166 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6453 -0.3147 2.8085 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7741 -2.4703 -0.8627 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4692 -3.5836 -0.3569 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3299 -2.6144 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9387 0.2575 -2.5683 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1719 0.1243 1.9157 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2727 3.6251 0.1932 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 2.3545 0.6151 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3932 0.5790 -2.3677 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 0.5142 -0.1547 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 6 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 8 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 13 2 0 0 0 0 6 14 2 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 7 12 1 0 0 0 0 8 22 1 0 0 0 0 9 11 1 0 0 0 0 9 16 2 0 0 0 0 10 23 1 0 0 0 0 11 17 2 0 0 0 0 13 18 1 0 0 0 0 13 24 1 0 0 0 0 14 19 1 0 0 0 0 14 25 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 20 1 0 0 0 0 16 30 1 0 0 0 0 17 21 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 M END $$$$