BMBE82 -OEChem-04012112342D 45 48 0 0 0 0 0 0 0999 V2000 7.2593 1.7127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2593 -1.7978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3008 0.1102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6276 1.2235 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4044 -1.0426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5323 -0.0426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2704 0.4574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0024 0.4574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2704 -0.5426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0024 -0.5426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1364 0.9574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1364 -1.0426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9486 0.7622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9486 -0.8473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9696 2.1632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6428 1.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4044 -2.0426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9544 2.3368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3268 2.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5383 -2.5426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2704 -2.5426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2964 3.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6688 3.8689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6537 4.0426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5383 -3.5426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2704 -3.5426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4044 -4.0426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1364 1.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1364 -1.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7938 -0.9349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1523 -0.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 1.8619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7162 2.8216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4749 2.2144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6014 2.2908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5251 1.4173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0014 -2.2326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8073 -2.2326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9070 3.3842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2703 4.3439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8657 4.6252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0014 -3.8526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8073 -3.8526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4044 -4.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 14 2 0 0 0 0 3 16 2 0 0 0 0 4 7 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 9 1 0 0 0 0 5 17 1 0 0 0 0 5 31 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 6 32 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 8 13 1 0 0 0 0 9 12 1 0 0 0 0 10 12 2 0 0 0 0 10 14 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 17 21 2 0 0 0 0 17 22 1 0 0 0 0 18 23 1 0 0 0 0 18 33 1 0 0 0 0 19 24 2 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 26 1 0 0 0 0 21 38 1 0 0 0 0 22 27 2 0 0 0 0 22 39 1 0 0 0 0 23 25 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 28 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 M END $$$$