RDKit 3D 28 28 0 0 0 0 0 0 0 0999 V2000 5.1891 -1.8785 0.2382 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3316 -0.7455 0.6952 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -0.8479 0.2456 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0381 0.1697 0.6118 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3891 1.1540 1.3182 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 0.1409 0.2183 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 1.1681 0.5939 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5564 0.9009 0.0475 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -0.2247 -0.7036 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9964 -0.5352 -1.2472 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 0.3054 -1.0245 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3498 0.0149 -1.5696 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.4970 -1.0186 -2.2508 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4127 0.8401 -1.3580 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.8632 1.4430 -0.2668 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6071 1.7433 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1268 -1.8499 0.8649 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6711 -2.8507 0.4002 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4246 -1.7863 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7316 0.2159 0.2587 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -0.5922 1.7897 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6535 -1.6519 -0.3381 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1618 2.0912 0.0776 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1993 1.3773 1.6665 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9207 -0.8983 -0.8872 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1616 -1.4221 -1.8429 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7056 2.0993 -0.0979 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4595 2.6381 0.8685 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 15 1 0 15 16 2 0 11 12 1 0 12 14 1 0 12 13 2 0 16 8 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 0 2 21 1 0 3 22 1 0 7 23 1 0 7 24 1 0 9 25 1 0 10 26 1 0 15 27 1 0 16 28 1 0 M CHG 2 12 1 14 -1 M END