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. 2010 Sep 11;66(Pt 10):o2542. doi: 10.1107/S1600536810035166
C1—C2 1.391 (3) C12A—H12A 0.9300
C1—C6 1.393 (3) C13A—H13A 0.9600
C1—S1 1.770 (2) C13A—H13B 0.9600
C2—C3 1.377 (3) C13A—H13C 0.9600
C2—Cl1 1.7337 (19) N1—C7B 1.524 (9)
C3—C4 1.382 (3) N1—S1 1.6125 (18)
C3—H3 0.9300 N1—H1N 0.844 (17)
C4—C5 1.373 (3) O1—S1 1.4183 (17)
C4—Cl2 1.732 (2) O2—S1 1.4326 (15)
C5—C6 1.373 (3) C7B—C8B 1.374 (11)
C5—H5 0.9300 C7B—C12B 1.402 (17)
C6—H6 0.9300 C8B—C9B 1.415 (16)
C7A—C12A 1.381 (7) C8B—C13B 1.492 (13)
C7A—C8A 1.381 (5) C9B—C10B 1.36 (3)
C7A—N1 1.403 (4) C9B—H9B 0.9300
C8A—C9A 1.413 (11) C10B—C11B 1.352 (15)
C8A—C13A 1.492 (11) C10B—H10B 0.9300
C9A—C10A 1.350 (15) C11B—C12B 1.393 (16)
C9A—H9A 0.9300 C11B—H11B 0.9300
C10A—C11A 1.375 (8) C12B—H12B 0.9300
C10A—H10A 0.9300 C13B—H13D 0.9600
C11A—C12A 1.366 (7) C13B—H13E 0.9600
C11A—H11A 0.9300 C13B—H13F 0.9600
C2—C1—C6 119.02 (18) C8A—C13A—H13C 109.5
C2—C1—S1 123.26 (14) H13A—C13A—H13C 109.5
C6—C1—S1 117.69 (15) H13B—C13A—H13C 109.5
C3—C2—C1 120.80 (19) C7A—N1—C7B 31.8 (3)
C3—C2—Cl1 117.70 (16) C7A—N1—S1 121.00 (19)
C1—C2—Cl1 121.49 (15) C7B—N1—S1 129.1 (3)
C2—C3—C4 118.6 (2) C7A—N1—H1N 123.6 (17)
C2—C3—H3 120.7 C7B—N1—H1N 103.4 (17)
C4—C3—H3 120.7 S1—N1—H1N 115.0 (17)
C5—C4—C3 121.7 (2) O1—S1—O2 118.99 (10)
C5—C4—Cl2 119.84 (18) O1—S1—N1 109.42 (11)
C3—C4—Cl2 118.43 (18) O2—S1—N1 105.99 (9)
C4—C5—C6 119.4 (2) O1—S1—C1 105.83 (10)
C4—C5—H5 120.3 O2—S1—C1 108.16 (10)
C6—C5—H5 120.3 N1—S1—C1 108.06 (9)
C5—C6—C1 120.5 (2) C8B—C7B—C12B 119.8 (13)
C5—C6—H6 119.8 C8B—C7B—N1 123.0 (9)
C1—C6—H6 119.8 C12B—C7B—N1 117.1 (11)
C12A—C7A—C8A 121.6 (4) C7B—C8B—C9B 117.4 (14)
C12A—C7A—N1 119.3 (4) C7B—C8B—C13B 122.4 (9)
C8A—C7A—N1 118.9 (4) C9B—C8B—C13B 120.1 (14)
C7A—C8A—C9A 116.3 (7) C10B—C9B—C8B 121.5 (16)
C7A—C8A—C13A 123.6 (5) C10B—C9B—H9B 119.2
C9A—C8A—C13A 120.0 (7) C8B—C9B—H9B 119.2
C10A—C9A—C8A 122.0 (8) C11B—C10B—C9B 120.1 (10)
C10A—C9A—H9A 119.0 C11B—C10B—H10B 120.0
C8A—C9A—H9A 119.0 C9B—C10B—H10B 120.0
C9A—C10A—C11A 119.6 (5) C10B—C11B—C12B 119.9 (13)
C9A—C10A—H10A 120.2 C10B—C11B—H11B 120.1
C11A—C10A—H10A 120.2 C12B—C11B—H11B 120.1
C12A—C11A—C10A 120.4 (6) C11B—C12B—C7B 120.1 (18)
C12A—C11A—H11A 119.8 C11B—C12B—H12B 120.0
C10A—C11A—H11A 119.8 C7B—C12B—H12B 120.0
C11A—C12A—C7A 119.7 (6) C8B—C13B—H13D 109.5
C11A—C12A—H12A 120.1 C8B—C13B—H13E 109.5
C7A—C12A—H12A 120.1 H13D—C13B—H13E 109.5
C8A—C13A—H13A 109.5 C8B—C13B—H13F 109.5
C8A—C13A—H13B 109.5 H13D—C13B—H13F 109.5
H13A—C13A—H13B 109.5 H13E—C13B—H13F 109.5
C6—C1—C2—C3 0.4 (3) C7A—N1—S1—O1 29.7 (3)
S1—C1—C2—C3 −178.13 (16) C7B—N1—S1—O1 67.6 (5)
C6—C1—C2—Cl1 −178.41 (15) C7A—N1—S1—O2 159.2 (2)
S1—C1—C2—Cl1 3.1 (2) C7B—N1—S1—O2 −162.9 (5)
C1—C2—C3—C4 −1.0 (3) C7A—N1—S1—C1 −85.1 (2)
Cl1—C2—C3—C4 177.79 (16) C7B—N1—S1—C1 −47.2 (5)
C2—C3—C4—C5 0.5 (3) C2—C1—S1—O1 179.13 (16)
C2—C3—C4—Cl2 −178.15 (17) C6—C1—S1—O1 0.62 (18)
C3—C4—C5—C6 0.6 (3) C2—C1—S1—O2 50.59 (18)
Cl2—C4—C5—C6 179.28 (17) C6—C1—S1—O2 −127.93 (15)
C4—C5—C6—C1 −1.3 (3) C2—C1—S1—N1 −63.73 (18)
C2—C1—C6—C5 0.8 (3) C6—C1—S1—N1 117.75 (16)
S1—C1—C6—C5 179.39 (16) C7A—N1—C7B—C8B 1.1 (5)
C12A—C7A—C8A—C9A −1.7 (7) S1—N1—C7B—C8B −86.0 (8)
N1—C7A—C8A—C9A 173.1 (5) C7A—N1—C7B—C12B −176.0 (15)
C12A—C7A—C8A—C13A −178.6 (8) S1—N1—C7B—C12B 96.9 (13)
N1—C7A—C8A—C13A −3.8 (8) C12B—C7B—C8B—C9B −7.9 (19)
C7A—C8A—C9A—C10A 6.4 (11) N1—C7B—C8B—C9B 175.0 (12)
C13A—C8A—C9A—C10A −176.6 (9) C12B—C7B—C8B—C13B 175.7 (15)
C8A—C9A—C10A—C11A −7.2 (13) N1—C7B—C8B—C13B −1.4 (12)
C9A—C10A—C11A—C12A 3.2 (11) C7B—C8B—C9B—C10B 14 (3)
C10A—C11A—C12A—C7A 1.3 (9) C13B—C8B—C9B—C10B −170.0 (16)
C8A—C7A—C12A—C11A −2.0 (7) C8B—C9B—C10B—C11B −12 (3)
N1—C7A—C12A—C11A −176.8 (5) C9B—C10B—C11B—C12B 5(2)
C12A—C7A—N1—C7B 177.2 (8) C10B—C11B—C12B—C7B 0(3)
C8A—C7A—N1—C7B 2.3 (5) C8B—C7B—C12B—C11B 1(2)
C12A—C7A—N1—S1 −67.5 (4) N1—C7B—C12B—C11B 178.6 (13)
C8A—C7A—N1—S1 117.6 (3)