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. 2008 Oct 31;64(Pt 11):o2216. doi: 10.1107/S1600536808032327
C1A—N2A 1.330 (5) C1B—N2B 1.330 (5)
C1A—C6A 1.375 (6) C1B—C6B 1.372 (6)
C1A—N8A 1.411 (5) C1B—N8B 1.418 (5)
N2A—C3A 1.336 (5) N2B—C3B 1.344 (5)
C3A—C4A 1.382 (7) C3B—C4B 1.369 (6)
C3A—H3A 0.9500 C3B—H3B 0.9500
C4A—C5A 1.383 (7) C4B—C5B 1.388 (6)
C4A—H4A 0.9500 C4B—H4B 0.9500
C5A—C6A 1.389 (6) C5B—C6B 1.392 (6)
C5A—C7A 1.494 (7) C5B—C7B 1.494 (6)
C6A—H6A 0.9500 C6B—H6B 0.9500
C7A—H7A 0.9800 C7B—H7D 0.9800
C7A—H7B 0.9800 C7B—H7E 0.9800
C7A—H7C 0.9800 C7B—H7F 0.9800
N8A—C9A 1.373 (5) N8B—C9B 1.367 (5)
N8A—H8A 0.9418 N8B—H8B 0.9790
C9A—O10A 1.199 (5) C9B—O10B 1.184 (5)
C9A—O11A 1.343 (5) C9B—O11B 1.361 (5)
O11A—C12A 1.477 (5) O11B—C12B 1.479 (5)
C12A—C13A 1.500 (6) C12B—C13B 1.503 (7)
C12A—C14A 1.514 (7) C12B—C14B 1.512 (7)
C12A—C15A 1.533 (6) C12B—C15B 1.520 (7)
C13A—H13A 0.9800 C13B—H13D 0.9800
C13A—H13B 0.9800 C13B—H13E 0.9800
C13A—H13C 0.9800 C13B—H13F 0.9800
C14A—H14A 0.9800 C14B—H14D 0.9800
C14A—H14B 0.9800 C14B—H14E 0.9800
C14A—H14C 0.9800 C14B—H14F 0.9800
C15A—H15A 0.9800 C15B—H15D 0.9800
C15A—H15B 0.9800 C15B—H15E 0.9800
C15A—H15C 0.9800 C15B—H15F 0.9800
N2A—C1A—C6A 123.8 (4) N2B—C1B—C6B 123.6 (4)
N2A—C1A—N8A 112.4 (4) N2B—C1B—N8B 112.3 (4)
C6A—C1A—N8A 123.8 (4) C6B—C1B—N8B 124.1 (4)
C1A—N2A—C3A 116.8 (4) C1B—N2B—C3B 116.8 (4)
N2A—C3A—C4A 123.6 (5) N2B—C3B—C4B 123.5 (4)
N2A—C3A—H3A 118.2 N2B—C3B—H3B 118.2
C4A—C3A—H3A 118.2 C4B—C3B—H3B 118.2
C3A—C4A—C5A 118.8 (4) C3B—C4B—C5B 119.3 (4)
C3A—C4A—H4A 120.6 C3B—C4B—H4B 120.3
C5A—C4A—H4A 120.6 C5B—C4B—H4B 120.3
C4A—C5A—C6A 117.9 (4) C4B—C5B—C6B 117.2 (4)
C4A—C5A—C7A 121.0 (4) C4B—C5B—C7B 121.4 (4)
C6A—C5A—C7A 121.2 (5) C6B—C5B—C7B 121.4 (4)
C1A—C6A—C5A 119.0 (4) C1B—C6B—C5B 119.5 (4)
C1A—C6A—H6A 120.5 C1B—C6B—H6B 120.3
C5A—C6A—H6A 120.5 C5B—C6B—H6B 120.3
C5A—C7A—H7A 109.5 C5B—C7B—H7D 109.5
C5A—C7A—H7B 109.5 C5B—C7B—H7E 109.5
H7A—C7A—H7B 109.5 H7D—C7B—H7E 109.5
C5A—C7A—H7C 109.5 C5B—C7B—H7F 109.5
H7A—C7A—H7C 109.5 H7D—C7B—H7F 109.5
H7B—C7A—H7C 109.5 H7E—C7B—H7F 109.5
C9A—N8A—C1A 126.7 (4) C9B—N8B—C1B 125.8 (4)
C9A—N8A—H8A 113.0 C9B—N8B—H8B 121.6
C1A—N8A—H8A 120.3 C1B—N8B—H8B 112.5
O10A—C9A—O11A 126.5 (4) O10B—C9B—O11B 126.5 (4)
O10A—C9A—N8A 125.5 (4) O10B—C9B—N8B 126.9 (4)
O11A—C9A—N8A 108.0 (3) O11B—C9B—N8B 106.7 (3)
C9A—O11A—C12A 120.3 (3) C9B—O11B—C12B 119.0 (3)
O11A—C12A—C13A 109.2 (4) O11B—C12B—C13B 109.6 (4)
O11A—C12A—C14A 110.6 (4) O11B—C12B—C14B 112.0 (4)
C13A—C12A—C14A 114.2 (4) C13B—C12B—C14B 113.2 (4)
O11A—C12A—C15A 101.8 (3) O11B—C12B—C15B 101.1 (3)
C13A—C12A—C15A 110.9 (4) C13B—C12B—C15B 111.3 (5)
C14A—C12A—C15A 109.4 (4) C14B—C12B—C15B 109.0 (4)
C12A—C13A—H13A 109.5 C12B—C13B—H13D 109.5
C12A—C13A—H13B 109.5 C12B—C13B—H13E 109.5
H13A—C13A—H13B 109.5 H13D—C13B—H13E 109.5
C12A—C13A—H13C 109.5 C12B—C13B—H13F 109.5
H13A—C13A—H13C 109.5 H13D—C13B—H13F 109.5
H13B—C13A—H13C 109.5 H13E—C13B—H13F 109.5
C12A—C14A—H14A 109.5 C12B—C14B—H14D 109.5
C12A—C14A—H14B 109.5 C12B—C14B—H14E 109.5
H14A—C14A—H14B 109.5 H14D—C14B—H14E 109.5
C12A—C14A—H14C 109.5 C12B—C14B—H14F 109.5
H14A—C14A—H14C 109.5 H14D—C14B—H14F 109.5
H14B—C14A—H14C 109.5 H14E—C14B—H14F 109.5
C12A—C15A—H15A 109.5 C12B—C15B—H15D 109.5
C12A—C15A—H15B 109.5 C12B—C15B—H15E 109.5
H15A—C15A—H15B 109.5 H15D—C15B—H15E 109.5
C12A—C15A—H15C 109.5 C12B—C15B—H15F 109.5
H15A—C15A—H15C 109.5 H15D—C15B—H15F 109.5
H15B—C15A—H15C 109.5 H15E—C15B—H15F 109.5
C6A—C1A—N2A—C3A 2.1 (6) C6B—C1B—N2B—C3B −1.2 (7)
N8A—C1A—N2A—C3A −177.2 (4) N8B—C1B—N2B—C3B 178.6 (4)
C1A—N2A—C3A—C4A 0.3 (7) C1B—N2B—C3B—C4B −1.0 (8)
N2A—C3A—C4A—C5A −0.7 (7) N2B—C3B—C4B—C5B 2.2 (8)
C3A—C4A—C5A—C6A −1.2 (7) C3B—C4B—C5B—C6B −1.2 (7)
C3A—C4A—C5A—C7A 178.2 (5) C3B—C4B—C5B—C7B 177.6 (5)
N2A—C1A—C6A—C5A −4.0 (7) N2B—C1B—C6B—C5B 2.0 (7)
N8A—C1A—C6A—C5A 175.3 (4) N8B—C1B—C6B—C5B −177.7 (4)
C4A—C5A—C6A—C1A 3.4 (7) C4B—C5B—C6B—C1B −0.8 (6)
C7A—C5A—C6A—C1A −176.0 (5) C7B—C5B—C6B—C1B −179.5 (4)
N2A—C1A—N8A—C9A 178.9 (4) N2B—C1B—N8B—C9B 177.5 (4)
C6A—C1A—N8A—C9A −0.4 (7) C6B—C1B—N8B—C9B −2.7 (7)
C1A—N8A—C9A—O10A 9.6 (8) C1B—N8B—C9B—O10B −0.7 (7)
C1A—N8A—C9A—O11A −169.8 (4) C1B—N8B—C9B—O11B 179.9 (4)
O10A—C9A—O11A—C12A 2.3 (7) O10B—C9B—O11B—C12B −4.7 (6)
N8A—C9A—O11A—C12A −178.3 (4) N8B—C9B—O11B—C12B 174.8 (3)
C9A—O11A—C12A—C13A 65.5 (5) C9B—O11B—C12B—C13B −65.3 (5)
C9A—O11A—C12A—C14A −61.0 (5) C9B—O11B—C12B—C14B 61.2 (5)
C9A—O11A—C12A—C15A −177.2 (4) C9B—O11B—C12B—C15B 177.1 (4)