B82NXW -OEChem-04012116462D 42 44 0 0 0 0 0 0 0999 V2000 5.2177 -1.8685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3457 0.8051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2947 -3.4563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 4.9547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.9366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8357 -1.8685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5267 -0.9175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5267 -0.9175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0267 -2.4563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0267 -3.4563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9389 -0.1084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1607 -3.9563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1145 -0.1084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8927 -3.9563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7579 1.6141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1607 -4.9563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8927 -4.9563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0267 -5.4563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1646 2.5277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 1.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 3.2322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5768 3.3367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1756 2.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4286 -3.9563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 4.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4249 0.2383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5082 -0.5544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6161 -0.4729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4789 0.3931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6129 0.2560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4297 -3.6463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6238 -5.2663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4297 -5.2663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0267 -6.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7812 2.5925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5112 0.9432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 3.9031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 2.2538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1186 -3.4194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8917 -4.2663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7386 -4.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0368 5.4563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 9 1 0 0 0 0 2 11 1 0 0 0 0 2 15 1 0 0 0 0 3 12 1 0 0 0 0 3 24 1 0 0 0 0 4 25 1 0 0 0 0 4 42 1 0 0 0 0 5 25 2 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 12 1 0 0 0 0 10 14 2 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 16 2 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 17 1 0 0 0 0 14 31 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 18 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 22 1 0 0 0 0 19 35 1 0 0 0 0 20 23 2 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 25 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END $$$$