B6DUC2 -OEChem-04022110373D 29 28 0 1 0 0 0 0 0999 V2000 -1.8426 0.7700 1.7148 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6465 -2.6200 -0.1718 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9425 1.9538 0.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7349 -1.3040 1.6704 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5445 -0.4160 -1.1569 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -0.3572 -1.2418 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3341 -0.3627 -0.3321 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2096 -0.3309 -0.4772 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4094 0.7676 0.2022 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1142 0.6651 -0.5571 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6044 0.8148 -0.7495 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4275 0.9069 0.4959 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9153 0.9445 0.0103 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -1.4321 0.4688 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1009 -1.2490 -1.8821 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1402 0.5068 -1.9192 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3362 -1.2312 0.3364 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3786 1.6909 0.7943 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5718 -0.0444 0.9132 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 1.5012 -1.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6333 -0.0958 -1.3602 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5055 1.6620 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3633 -0.5048 -0.5559 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5261 -1.2553 -1.7353 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9328 1.8608 0.6089 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0669 0.0925 0.6807 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7566 0.9795 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8933 1.5973 2.2394 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8734 -3.3512 0.4415 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 28 1 0 0 0 0 2 14 1 0 0 0 0 2 29 1 0 0 0 0 3 12 2 0 0 0 0 4 14 2 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 12 1 0 0 0 0 7 17 1 0 0 0 0 8 10 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 M END $$$$