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. 2019 Jul 9;75(Pt 8):1117–1122. doi: 10.1107/S2056989019009435
O1A—C2A 1.366 (3) O1B—C2B 1.365 (3)
O1A—C3A 1.392 (3) O1B—C3B 1.389 (3)
O2A—C2A 1.216 (3) O2B—C2B 1.221 (3)
N1A—C8A 1.358 (3) N1B—C8B 1.356 (3)
N1A—H1A1 0.8600 N1B—H1B1 0.8600
N1A—H1A2 0.8600 N1B—H1B2 0.8600
C1A—C9A 1.411 (3) C1B—C9B 1.409 (3)
C1A—C8A 1.425 (3) C1B—C8B 1.417 (3)
C1A—C2A 1.435 (4) C1B—C2B 1.435 (4)
C3A—C4A 1.334 (3) C3B—C4B 1.328 (4)
C3A—C11A 1.494 (4) C3B—C11B 1.492 (4)
C4A—C9A 1.461 (3) C4B—C9B 1.467 (3)
C4A—C13A 1.511 (4) C4B—C13B 1.511 (4)
C5A—C6A 1.386 (3) C5B—C6B 1.388 (4)
C5A—C9A 1.387 (3) C5B—C9B 1.388 (3)
C5A—H5A 0.9300 C5B—H5B 0.9300
C6A—C7A 1.369 (4) C6B—C7B 1.363 (4)
C6A—C10A 1.501 (4) C6B—C10B 1.507 (4)
C7A—C8A 1.393 (4) C7B—C8B 1.396 (4)
C7A—H7A 0.9300 C7B—H7B 0.9300
C10A—H10A 0.9600 C10B—H10D 0.9600
C10A—H10B 0.9600 C10B—H10E 0.9600
C10A—H10C 0.9600 C10B—H10F 0.9600
C11A—C12A 1.509 (4) C11B—C12B 1.509 (4)
C11A—H11A 0.9700 C11B—H11C 0.9700
C11A—H11B 0.9700 C11B—H11D 0.9700
C12A—H12A 0.9600 C12B—H12D 0.9600
C12A—H12B 0.9600 C12B—H12E 0.9600
C12A—H12C 0.9600 C12B—H12F 0.9600
C13A—C14A 1.517 (4) C13B—C14B 1.519 (4)
C13A—H13A 0.9700 C13B—H13C 0.9700
C13A—H13B 0.9700 C13B—H13D 0.9700
C14A—H14A 0.9600 C14B—H14D 0.9600
C14A—H14B 0.9600 C14B—H14E 0.9600
C14A—H14C 0.9600 C14B—H14F 0.9600
C2A—O1A—C3A 123.1 (2) C2B—O1B—C3B 122.9 (2)
C8A—N1A—H1A1 120.0 C8B—N1B—H1B1 120.0
C8A—N1A—H1A2 120.0 C8B—N1B—H1B2 120.0
H1A1—N1A—H1A2 120.0 H1B1—N1B—H1B2 120.0
C9A—C1A—C8A 119.1 (2) C9B—C1B—C8B 119.3 (2)
C9A—C1A—C2A 120.0 (2) C9B—C1B—C2B 119.8 (2)
C8A—C1A—C2A 120.9 (3) C8B—C1B—C2B 120.8 (3)
O2A—C2A—O1A 115.0 (3) O2B—C2B—O1B 115.1 (3)
O2A—C2A—C1A 127.6 (3) O2B—C2B—C1B 127.3 (3)
O1A—C2A—C1A 117.5 (3) O1B—C2B—C1B 117.6 (3)
C4A—C3A—O1A 121.6 (2) C4B—C3B—O1B 121.9 (2)
C4A—C3A—C11A 129.7 (3) C4B—C3B—C11B 129.8 (3)
O1A—C3A—C11A 108.7 (3) O1B—C3B—C11B 108.3 (3)
C3A—C4A—C9A 118.8 (3) C3B—C4B—C9B 118.6 (3)
C3A—C4A—C13A 120.9 (2) C3B—C4B—C13B 121.3 (2)
C9A—C4A—C13A 120.3 (2) C9B—C4B—C13B 120.0 (2)
C6A—C5A—C9A 121.5 (3) C6B—C5B—C9B 121.0 (3)
C6A—C5A—H5A 119.3 C6B—C5B—H5B 119.5
C9A—C5A—H5A 119.3 C9B—C5B—H5B 119.5
C7A—C6A—C5A 119.4 (3) C7B—C6B—C5B 119.6 (3)
C7A—C6A—C10A 121.0 (3) C7B—C6B—C10B 120.7 (3)
C5A—C6A—C10A 119.7 (3) C5B—C6B—C10B 119.7 (3)
C6A—C7A—C8A 121.9 (3) C6B—C7B—C8B 121.9 (3)
C6A—C7A—H7A 119.0 C6B—C7B—H7B 119.0
C8A—C7A—H7A 119.0 C8B—C7B—H7B 119.0
N1A—C8A—C7A 120.1 (3) N1B—C8B—C7B 119.8 (3)
N1A—C8A—C1A 121.2 (3) N1B—C8B—C1B 121.6 (3)
C7A—C8A—C1A 118.7 (3) C7B—C8B—C1B 118.6 (3)
C5A—C9A—C1A 119.3 (2) C5B—C9B—C1B 119.5 (2)
C5A—C9A—C4A 121.6 (3) C5B—C9B—C4B 121.5 (3)
C1A—C9A—C4A 119.1 (2) C1B—C9B—C4B 119.0 (2)
C6A—C10A—H10A 109.5 C6B—C10B—H10D 109.5
C6A—C10A—H10B 109.5 C6B—C10B—H10E 109.5
H10A—C10A—H10B 109.5 H10D—C10B—H10E 109.5
C6A—C10A—H10C 109.5 C6B—C10B—H10F 109.5
H10A—C10A—H10C 109.5 H10D—C10B—H10F 109.5
H10B—C10A—H10C 109.5 H10E—C10B—H10F 109.5
C3A—C11A—C12A 112.3 (3) C3B—C11B—C12B 112.7 (3)
C3A—C11A—H11A 109.1 C3B—C11B—H11C 109.1
C12A—C11A—H11A 109.1 C12B—C11B—H11C 109.1
C3A—C11A—H11B 109.1 C3B—C11B—H11D 109.1
C12A—C11A—H11B 109.1 C12B—C11B—H11D 109.1
H11A—C11A—H11B 107.9 H11C—C11B—H11D 107.8
C11A—C12A—H12A 109.5 C11B—C12B—H12D 109.5
C11A—C12A—H12B 109.5 C11B—C12B—H12E 109.5
H12A—C12A—H12B 109.5 H12D—C12B—H12E 109.5
C11A—C12A—H12C 109.5 C11B—C12B—H12F 109.5
H12A—C12A—H12C 109.5 H12D—C12B—H12F 109.5
H12B—C12A—H12C 109.5 H12E—C12B—H12F 109.5
C4A—C13A—C14A 112.6 (2) C4B—C13B—C14B 112.5 (2)
C4A—C13A—H13A 109.1 C4B—C13B—H13C 109.1
C14A—C13A—H13A 109.1 C14B—C13B—H13C 109.1
C4A—C13A—H13B 109.1 C4B—C13B—H13D 109.1
C14A—C13A—H13B 109.1 C14B—C13B—H13D 109.1
H13A—C13A—H13B 107.8 H13C—C13B—H13D 107.8
C13A—C14A—H14A 109.5 C13B—C14B—H14D 109.5
C13A—C14A—H14B 109.5 C13B—C14B—H14E 109.5
H14A—C14A—H14B 109.5 H14D—C14B—H14E 109.5
C13A—C14A—H14C 109.5 C13B—C14B—H14F 109.5
H14A—C14A—H14C 109.5 H14D—C14B—H14F 109.5
H14B—C14A—H14C 109.5 H14E—C14B—H14F 109.5
C3A—O1A—C2A—O2A −178.6 (2) C3B—O1B—C2B—O2B −178.2 (2)
C3A—O1A—C2A—C1A 0.4 (3) C3B—O1B—C2B—C1B 2.8 (4)
C9A—C1A—C2A—O2A 177.9 (3) C9B—C1B—C2B—O2B −179.6 (3)
C8A—C1A—C2A—O2A −3.1 (4) C8B—C1B—C2B—O2B −0.2 (4)
C9A—C1A—C2A—O1A −0.9 (3) C9B—C1B—C2B—O1B −0.7 (4)
C8A—C1A—C2A—O1A 178.1 (2) C8B—C1B—C2B—O1B 178.7 (2)
C2A—O1A—C3A—C4A 0.8 (4) C2B—O1B—C3B—C4B −2.0 (4)
C2A—O1A—C3A—C11A 179.3 (2) C2B—O1B—C3B—C11B 179.9 (2)
O1A—C3A—C4A—C9A −1.5 (4) O1B—C3B—C4B—C9B −1.0 (4)
C11A—C3A—C4A—C9A −179.6 (2) C11B—C3B—C4B—C9B 176.7 (3)
O1A—C3A—C4A—C13A 177.5 (2) O1B—C3B—C4B—C13B −179.1 (2)
C11A—C3A—C4A—C13A −0.6 (4) C11B—C3B—C4B—C13B −1.4 (4)
C9A—C5A—C6A—C7A −0.4 (4) C9B—C5B—C6B—C7B 2.1 (4)
C9A—C5A—C6A—C10A −179.1 (2) C9B—C5B—C6B—C10B −178.3 (3)
C5A—C6A—C7A—C8A 0.1 (4) C5B—C6B—C7B—C8B −1.7 (4)
C10A—C6A—C7A—C8A 178.7 (3) C10B—C6B—C7B—C8B 178.8 (3)
C6A—C7A—C8A—N1A −179.0 (2) C6B—C7B—C8B—N1B −180.0 (3)
C6A—C7A—C8A—C1A 0.8 (4) C6B—C7B—C8B—C1B −0.5 (4)
C9A—C1A—C8A—N1A 178.5 (2) C9B—C1B—C8B—N1B −178.3 (2)
C2A—C1A—C8A—N1A −0.5 (4) C2B—C1B—C8B—N1B 2.3 (4)
C9A—C1A—C8A—C7A −1.3 (3) C9B—C1B—C8B—C7B 2.2 (4)
C2A—C1A—C8A—C7A 179.7 (2) C2B—C1B—C8B—C7B −177.2 (2)
C6A—C5A—C9A—C1A −0.2 (4) C6B—C5B—C9B—C1B −0.3 (4)
C6A—C5A—C9A—C4A 179.6 (2) C6B—C5B—C9B—C4B 179.4 (2)
C8A—C1A—C9A—C5A 1.0 (3) C8B—C1B—C9B—C5B −1.8 (3)
C2A—C1A—C9A—C5A −180.0 (2) C2B—C1B—C9B—C5B 177.6 (2)
C8A—C1A—C9A—C4A −178.7 (2) C8B—C1B—C9B—C4B 178.5 (2)
C2A—C1A—C9A—C4A 0.2 (3) C2B—C1B—C9B—C4B −2.2 (3)
C3A—C4A—C9A—C5A −178.8 (2) C3B—C4B—C9B—C5B −176.7 (2)
C13A—C4A—C9A—C5A 2.2 (4) C13B—C4B—C9B—C5B 1.4 (4)
C3A—C4A—C9A—C1A 1.0 (3) C3B—C4B—C9B—C1B 3.0 (3)
C13A—C4A—C9A—C1A −178.1 (2) C13B—C4B—C9B—C1B −178.9 (2)
C4A—C3A—C11A—C12A 103.6 (4) C4B—C3B—C11B—C12B −109.5 (4)
O1A—C3A—C11A—C12A −74.7 (3) O1B—C3B—C11B—C12B 68.5 (3)
C3A—C4A—C13A—C14A −98.1 (3) C3B—C4B—C13B—C14B 93.8 (3)
C9A—C4A—C13A—C14A 80.9 (3) C9B—C4B—C13B—C14B −84.3 (3)