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. 2008 Dec 20;65(Pt 1):o173. doi: 10.1107/S1600536808042864
S1A—C1A 1.8171 (12) S1B—C4B 1.8088 (11)
S1A—C4A 1.8330 (10) S1B—C1B 1.8183 (12)
S2A—C4A 1.8119 (11) S2B—C3B 1.8123 (13)
S2A—C3A 1.8227 (12) S2B—C4B 1.8329 (10)
S3A—C6A 1.8185 (13) S3B—C5B 1.8079 (11)
S3A—C5A 1.8207 (11) S3B—C6B 1.8165 (13)
S4A—C5A 1.8099 (11) S4B—C5B 1.8206 (11)
S4A—C8A 1.8162 (13) S4B—C8B 1.8218 (13)
O1A—C9A 1.2013 (15) O1B—C9B 1.2052 (14)
C1A—C2A 1.5222 (16) C1B—C2B 1.5200 (19)
C1A—H1AA 0.9700 C1B—H1BA 0.9700
C1A—H1AB 0.9700 C1B—H1BB 0.9700
C2A—C3A 1.5193 (16) C2B—C3B 1.524 (2)
C2A—H2AA 0.9700 C2B—H2BA 0.9700
C2A—H2AB 0.9700 C2B—H2BB 0.9700
C3A—H3AA 0.9700 C3B—H3BA 0.9700
C3A—H3AB 0.9700 C3B—H3BB 0.9700
C4A—C9A 1.5287 (15) C4B—C9B 1.5197 (16)
C4A—C5A 1.5350 (15) C4B—C5B 1.5333 (15)
C5A—H5AA 0.9800 C5B—H5BA 0.9800
C6A—C7A 1.5177 (19) C6B—C7B 1.5159 (19)
C6A—H6AA 0.9700 C6B—H6BA 0.9700
C6A—H6AB 0.9700 C6B—H6BB 0.9700
C7A—C8A 1.5210 (19) C7B—C8B 1.520 (2)
C7A—H7AA 0.9700 C7B—H7BA 0.9700
C7A—H7AB 0.9700 C7B—H7BB 0.9700
C8A—H8AA 0.9700 C8B—H8BA 0.9700
C8A—H8AB 0.9700 C8B—H8BB 0.9700
C9A—H9AA 0.9300 C9B—H9BA 0.9300
C1A—S1A—C4A 100.07 (5) C4B—S1B—C1B 102.44 (5)
C4A—S2A—C3A 102.32 (5) C3B—S2B—C4B 99.53 (5)
C6A—S3A—C5A 97.44 (6) C5B—S3B—C6B 97.30 (6)
C5A—S4A—C8A 96.48 (5) C5B—S4B—C8B 97.18 (6)
C2A—C1A—S1A 112.77 (8) C2B—C1B—S1B 114.71 (9)
C2A—C1A—H1AA 109.0 C2B—C1B—H1BA 108.6
S1A—C1A—H1AA 109.0 S1B—C1B—H1BA 108.6
C2A—C1A—H1AB 109.0 C2B—C1B—H1BB 108.6
S1A—C1A—H1AB 109.0 S1B—C1B—H1BB 108.6
H1AA—C1A—H1AB 107.8 H1BA—C1B—H1BB 107.6
C3A—C2A—C1A 113.07 (9) C1B—C2B—C3B 114.09 (11)
C3A—C2A—H2AA 109.0 C1B—C2B—H2BA 108.7
C1A—C2A—H2AA 109.0 C3B—C2B—H2BA 108.7
C3A—C2A—H2AB 109.0 C1B—C2B—H2BB 108.7
C1A—C2A—H2AB 109.0 C3B—C2B—H2BB 108.7
H2AA—C2A—H2AB 107.8 H2BA—C2B—H2BB 107.6
C2A—C3A—S2A 114.46 (9) C2B—C3B—S2B 113.05 (9)
C2A—C3A—H3AA 108.6 C2B—C3B—H3BA 109.0
S2A—C3A—H3AA 108.6 S2B—C3B—H3BA 109.0
C2A—C3A—H3AB 108.6 C2B—C3B—H3BB 109.0
S2A—C3A—H3AB 108.6 S2B—C3B—H3BB 109.0
H3AA—C3A—H3AB 107.6 H3BA—C3B—H3BB 107.8
C9A—C4A—C5A 106.84 (8) C9B—C4B—C5B 107.55 (9)
C9A—C4A—S2A 114.46 (8) C9B—C4B—S1B 114.83 (8)
C5A—C4A—S2A 110.63 (7) C5B—C4B—S1B 110.18 (7)
C9A—C4A—S1A 103.39 (7) C9B—C4B—S2B 102.57 (7)
C5A—C4A—S1A 107.36 (7) C5B—C4B—S2B 107.74 (7)
S2A—C4A—S1A 113.58 (5) S1B—C4B—S2B 113.45 (6)
C4A—C5A—S4A 113.09 (7) C4B—C5B—S3B 112.57 (7)
C4A—C5A—S3A 109.25 (7) C4B—C5B—S4B 108.94 (7)
S4A—C5A—S3A 113.55 (6) S3B—C5B—S4B 113.13 (6)
C4A—C5A—H5AA 106.8 C4B—C5B—H5BA 107.3
S4A—C5A—H5AA 106.8 S3B—C5B—H5BA 107.3
S3A—C5A—H5AA 106.8 S4B—C5B—H5BA 107.3
C7A—C6A—S3A 114.14 (8) C7B—C6B—S3B 114.68 (9)
C7A—C6A—H6AA 108.7 C7B—C6B—H6BA 108.6
S3A—C6A—H6AA 108.7 S3B—C6B—H6BA 108.6
C7A—C6A—H6AB 108.7 C7B—C6B—H6BB 108.6
S3A—C6A—H6AB 108.7 S3B—C6B—H6BB 108.6
H6AA—C6A—H6AB 107.6 H6BA—C6B—H6BB 107.6
C6A—C7A—C8A 113.48 (10) C6B—C7B—C8B 114.05 (11)
C6A—C7A—H7AA 108.9 C6B—C7B—H7BA 108.7
C8A—C7A—H7AA 108.9 C8B—C7B—H7BA 108.7
C6A—C7A—H7AB 108.9 C6B—C7B—H7BB 108.7
C8A—C7A—H7AB 108.9 C8B—C7B—H7BB 108.7
H7AA—C7A—H7AB 107.7 H7BA—C7B—H7BB 107.6
C7A—C8A—S4A 114.41 (10) C7B—C8B—S4B 113.28 (9)
C7A—C8A—H8AA 108.7 C7B—C8B—H8BA 108.9
S4A—C8A—H8AA 108.7 S4B—C8B—H8BA 108.9
C7A—C8A—H8AB 108.7 C7B—C8B—H8BB 108.9
S4A—C8A—H8AB 108.7 S4B—C8B—H8BB 108.9
H8AA—C8A—H8AB 107.6 H8BA—C8B—H8BB 107.7
O1A—C9A—C4A 125.78 (11) O1B—C9B—C4B 125.14 (11)
O1A—C9A—H9AA 117.1 O1B—C9B—H9BA 117.4
C4A—C9A—H9AA 117.1 C4B—C9B—H9BA 117.4
C4A—S1A—C1A—C2A −61.63 (9) C4B—S1B—C1B—C2B −53.25 (11)
S1A—C1A—C2A—C3A 69.59 (12) S1B—C1B—C2B—C3B 62.79 (14)
C1A—C2A—C3A—S2A −65.11 (12) C1B—C2B—C3B—S2B −68.27 (13)
C4A—S2A—C3A—C2A 54.44 (10) C4B—S2B—C3B—C2B 61.78 (10)
C3A—S2A—C4A—C9A 64.43 (9) C1B—S1B—C4B—C9B −62.56 (9)
C3A—S2A—C4A—C5A −174.81 (7) C1B—S1B—C4B—C5B 175.84 (8)
C3A—S2A—C4A—S1A −54.00 (7) C1B—S1B—C4B—S2B 54.96 (7)
C1A—S1A—C4A—C9A −67.55 (8) C3B—S2B—C4B—C9B 65.98 (8)
C1A—S1A—C4A—C5A 179.71 (7) C3B—S2B—C4B—C5B 179.29 (8)
C1A—S1A—C4A—S2A 57.08 (7) C3B—S2B—C4B—S1B −58.47 (7)
C9A—C4A—C5A—S4A −171.08 (7) C9B—C4B—C5B—S3B 169.01 (7)
S2A—C4A—C5A—S4A 63.73 (9) S1B—C4B—C5B—S3B −65.16 (8)
S1A—C4A—C5A—S4A −60.71 (8) S2B—C4B—C5B—S3B 59.08 (8)
C9A—C4A—C5A—S3A 61.41 (9) C9B—C4B—C5B—S4B −64.66 (9)
S2A—C4A—C5A—S3A −63.79 (8) S1B—C4B—C5B—S4B 61.17 (8)
S1A—C4A—C5A—S3A 171.78 (5) S2B—C4B—C5B—S4B −174.59 (5)
C8A—S4A—C5A—C4A 170.50 (8) C6B—S3B—C5B—C4B −172.25 (8)
C8A—S4A—C5A—S3A −64.27 (7) C6B—S3B—C5B—S4B 63.71 (7)
C6A—S3A—C5A—C4A −168.90 (7) C8B—S4B—C5B—C4B 169.19 (8)
C6A—S3A—C5A—S4A 63.85 (7) C8B—S4B—C5B—S3B −64.81 (7)
C5A—S3A—C6A—C7A −59.07 (10) C5B—S3B—C6B—C7B −59.23 (10)
S3A—C6A—C7A—C8A 64.76 (13) S3B—C6B—C7B—C8B 64.90 (14)
C6A—C7A—C8A—S4A −66.24 (13) C6B—C7B—C8B—S4B −65.45 (14)
C5A—S4A—C8A—C7A 61.09 (10) C5B—S4B—C8B—C7B 60.64 (11)
C5A—C4A—C9A—O1A −140.54 (12) C5B—C4B—C9B—O1B 141.54 (11)
S2A—C4A—C9A—O1A −17.70 (15) S1B—C4B—C9B—O1B 18.52 (15)
S1A—C4A—C9A—O1A 106.35 (12) S2B—C4B—C9B—O1B −105.02 (12)