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. 2014 Jun 14;70(Pt 7):o779–o780. doi: 10.1107/S1600536814012872
Br1A—C9A 1.899 (5) Br1B—C9B 1.893 (5)
O1A—C1A 1.223 (6) O1B—C1B 1.224 (6)
O2A—C4A 1.225 (6) O2B—C4B 1.226 (6)
O3A—H3A 0.8400 O3B—H3B 0.8400
O3A—C4A 1.312 (6) O3B—C4B 1.311 (6)
N1A—H1A 0.8800 N1B—H1B 0.8800
N1A—C1A 1.359 (6) N1B—C1B 1.346 (6)
N1A—C6A 1.408 (6) N1B—C6B 1.428 (6)
C1A—C2A 1.527 (6) C1B—C2B 1.525 (6)
C2A—H2AA 0.9900 C2B—H2BA 0.9900
C2A—H2AB 0.9900 C2B—H2BB 0.9900
C2A—C3A 1.506 (7) C2B—C3B 1.511 (7)
C3A—C4A 1.487 (7) C3B—C4B 1.488 (7)
C3A—C5A 1.316 (7) C3B—C5B 1.321 (7)
C5A—H5AA 0.9500 C5B—H5BA 0.9500
C5A—H5AB 0.9500 C5B—H5BB 0.9500
C6A—C7A 1.391 (7) C6B—C7B 1.392 (7)
C6A—C11A 1.406 (7) C6B—C11B 1.382 (8)
C7A—H7A 0.9500 C7B—H7B 0.9500
C7A—C8A 1.367 (8) C7B—C8B 1.385 (8)
C8A—H8A 0.9500 C8B—H8B 0.9500
C8A—C9A 1.377 (9) C8B—C9B 1.375 (8)
C9A—C10A 1.400 (9) C9B—C10B 1.383 (8)
C10A—H10A 0.9500 C10B—H10B 0.9500
C10A—C11A 1.374 (8) C10B—C11B 1.384 (8)
C11A—H11A 0.9500 C11B—H11B 0.9500
C4A—O3A—H3A 109.5 C4B—O3B—H3B 109.5
C1A—N1A—H1A 116.6 C1B—N1B—H1B 118.2
C1A—N1A—C6A 126.8 (4) C1B—N1B—C6B 123.7 (4)
C6A—N1A—H1A 116.6 C6B—N1B—H1B 118.2
O1A—C1A—N1A 123.8 (4) O1B—C1B—N1B 123.0 (4)
O1A—C1A—C2A 122.0 (4) O1B—C1B—C2B 123.2 (4)
N1A—C1A—C2A 114.1 (4) N1B—C1B—C2B 113.8 (4)
C1A—C2A—H2AA 109.4 C1B—C2B—H2BA 109.2
C1A—C2A—H2AB 109.4 C1B—C2B—H2BB 109.2
H2AA—C2A—H2AB 108.0 H2BA—C2B—H2BB 107.9
C3A—C2A—C1A 111.3 (4) C3B—C2B—C1B 112.3 (4)
C3A—C2A—H2AA 109.4 C3B—C2B—H2BA 109.2
C3A—C2A—H2AB 109.4 C3B—C2B—H2BB 109.2
C4A—C3A—C2A 115.1 (4) C4B—C3B—C2B 116.0 (4)
C5A—C3A—C2A 123.7 (5) C5B—C3B—C2B 123.6 (5)
C5A—C3A—C4A 121.1 (5) C5B—C3B—C4B 120.3 (5)
O2A—C4A—O3A 123.5 (5) O2B—C4B—O3B 123.7 (4)
O2A—C4A—C3A 121.9 (5) O2B—C4B—C3B 122.0 (5)
O3A—C4A—C3A 114.5 (4) O3B—C4B—C3B 114.2 (4)
C3A—C5A—H5AA 120.0 C3B—C5B—H5BA 120.0
C3A—C5A—H5AB 120.0 C3B—C5B—H5BB 120.0
H5AA—C5A—H5AB 120.0 H5BA—C5B—H5BB 120.0
C7A—C6A—N1A 124.1 (5) C7B—C6B—N1B 119.2 (5)
C7A—C6A—C11A 118.7 (5) C11B—C6B—N1B 121.0 (5)
C11A—C6A—N1A 117.0 (5) C11B—C6B—C7B 119.8 (5)
C6A—C7A—H7A 119.7 C6B—C7B—H7B 120.1
C8A—C7A—C6A 120.5 (6) C8B—C7B—C6B 119.8 (5)
C8A—C7A—H7A 119.7 C8B—C7B—H7B 120.1
C7A—C8A—H8A 119.7 C7B—C8B—H8B 120.1
C7A—C8A—C9A 120.5 (6) C9B—C8B—C7B 119.8 (5)
C9A—C8A—H8A 119.7 C9B—C8B—H8B 120.1
C8A—C9A—Br1A 120.8 (5) C8B—C9B—Br1B 118.8 (4)
C8A—C9A—C10A 120.5 (5) C8B—C9B—C10B 120.8 (5)
C10A—C9A—Br1A 118.6 (4) C10B—C9B—Br1B 120.4 (4)
C9A—C10A—H10A 120.6 C9B—C10B—H10B 120.3
C11A—C10A—C9A 118.7 (5) C9B—C10B—C11B 119.4 (5)
C11A—C10A—H10A 120.6 C11B—C10B—H10B 120.3
C6A—C11A—H11A 119.5 C6B—C11B—C10B 120.3 (5)
C10A—C11A—C6A 121.1 (5) C6B—C11B—H11B 119.8
C10A—C11A—H11A 119.5 C10B—C11B—H11B 119.8
Br1A—C9A—C10A—C11A −177.6 (5) Br1B—C9B—C10B—C11B 179.0 (5)
O1A—C1A—C2A—C3A −15.6 (6) O1B—C1B—C2B—C3B 10.3 (6)
N1A—C1A—C2A—C3A 166.0 (4) N1B—C1B—C2B—C3B −170.7 (4)
N1A—C6A—C7A—C8A −175.5 (5) N1B—C6B—C7B—C8B −178.3 (5)
N1A—C6A—C11A—C10A 176.3 (5) N1B—C6B—C11B—C10B 178.8 (5)
C1A—N1A—C6A—C7A −22.1 (8) C1B—N1B—C6B—C7B −103.4 (6)
C1A—N1A—C6A—C11A 163.5 (5) C1B—N1B—C6B—C11B 78.4 (7)
C1A—C2A—C3A—C4A −70.4 (5) C1B—C2B—C3B—C4B 69.5 (5)
C1A—C2A—C3A—C5A 112.3 (5) C1B—C2B—C3B—C5B −113.4 (5)
C2A—C3A—C4A—O2A −10.9 (7) C2B—C3B—C4B—O2B 11.7 (7)
C2A—C3A—C4A—O3A 167.5 (4) C2B—C3B—C4B—O3B −168.0 (4)
C5A—C3A—C4A—O2A 166.4 (5) C5B—C3B—C4B—O2B −165.5 (5)
C5A—C3A—C4A—O3A −15.1 (7) C5B—C3B—C4B—O3B 14.8 (7)
C6A—N1A—C1A—O1A −6.1 (8) C6B—N1B—C1B—O1B −0.6 (8)
C6A—N1A—C1A—C2A 172.3 (4) C6B—N1B—C1B—C2B −179.6 (4)
C6A—C7A—C8A—C9A 0.7 (9) C6B—C7B—C8B—C9B −0.6 (8)
C7A—C6A—C11A—C10A 1.6 (9) C7B—C6B—C11B—C10B 0.6 (9)
C7A—C8A—C9A—Br1A 178.0 (5) C7B—C8B—C9B—Br1B −178.5 (4)
C7A—C8A—C9A—C10A −0.6 (10) C7B—C8B—C9B—C10B 0.9 (9)
C8A—C9A—C10A—C11A 1.0 (9) C8B—C9B—C10B—C11B −0.4 (10)
C9A—C10A—C11A—C6A −1.5 (9) C9B—C10B—C11B—C6B −0.3 (9)
C11A—C6A—C7A—C8A −1.1 (8) C11B—C6B—C7B—C8B −0.1 (8)