BT3D5A -OEChem-04042107233D 28 28 0 0 0 0 0 0 0999 V2000 -4.4194 0.6887 0.1053 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -0.7932 2.1091 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6543 0.7462 0.1822 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1590 2.2175 -0.4649 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4823 1.0466 -0.1505 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2239 -0.6637 -0.5544 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1577 -0.3382 -0.9404 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1501 0.0475 -0.1171 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1815 0.3391 -0.5382 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5453 -1.9688 -0.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4913 0.0297 -0.1723 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8553 -2.2785 0.1524 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8281 -1.2792 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5172 0.3472 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8937 0.1576 1.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7829 0.2160 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4109 1.4856 1.8756 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3175 -0.4341 -2.0109 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8953 1.3524 -0.8116 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2036 -2.7563 -0.2257 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1171 -3.2976 0.4213 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8381 -1.5571 0.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6255 -0.8160 -2.4639 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8265 0.4777 -2.3416 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1489 0.9063 -2.7023 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4372 1.3526 2.3541 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1358 1.8739 2.5958 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3052 2.2110 1.0639 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 15 2 0 0 0 0 3 5 1 0 0 0 0 4 5 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 18 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 10 12 2 0 0 0 0 10 20 1 0 0 0 0 11 13 2 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 M CHG 2 3 -1 5 1 M END $$$$