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. 2012 Jun 30;68(Pt 7):o2258–o2259. doi: 10.1107/S1600536812028474
S1—O1 1.4345 (17) C10—C11 1.546 (3)
S1—O2 1.4414 (17) C10—H10 1.0000
S1—N3 1.613 (2) C11—C12 1.518 (3)
S1—C21 1.759 (2) C11—H11 1.0000
O3—C24 1.493 (4) C12—C17 1.393 (3)
O3—H3o 0.839 (10) C12—C13 1.389 (3)
N1—C1 1.285 (3) C13—C14 1.368 (4)
N1—N2 1.393 (3) C13—H13 0.9500
N2—C18 1.370 (3) C14—C15 1.384 (4)
N2—C11 1.483 (3) C14—H14 0.9500
N3—H1n 0.873 (10) C15—C16 1.390 (4)
N3—H2n 0.877 (10) C15—H15 0.9500
C1—C2 1.459 (3) C16—C17 1.381 (4)
C1—C10 1.518 (3) C16—H16 0.9500
C2—C3 1.396 (3) C17—H17 0.9500
C2—C7 1.406 (3) C18—C23 1.398 (3)
C3—C4 1.373 (3) C18—C19 1.409 (3)
C3—H3 0.9500 C19—C20 1.375 (3)
C4—C5 1.397 (3) C19—H19 0.9500
C4—H4 0.9500 C20—C21 1.398 (3)
C5—C6 1.375 (4) C20—H20 0.9500
C5—H5 0.9500 C21—C22 1.384 (3)
C6—C7 1.398 (3) C22—C23 1.386 (3)
C6—H6 0.9500 C22—H22 0.9500
C7—C8 1.512 (3) C23—H23 0.9500
C8—C9 1.522 (4) C24—C25 1.457 (5)
C8—H8A 0.9900 C24—H24A 0.9900
C8—H8B 0.9900 C24—H24B 0.9900
C9—C10 1.515 (3) C25—H25A 0.9800
C9—H9A 0.9900 C25—H25B 0.9800
C9—H9B 0.9900 C25—H25C 0.9800
O1—S1—O2 119.27 (10) N2—C11—C10 100.52 (18)
O1—S1—N3 106.86 (11) C12—C11—C10 116.95 (19)
O2—S1—N3 106.42 (11) N2—C11—H11 109.0
O1—S1—C21 107.25 (10) C12—C11—H11 109.0
O2—S1—C21 107.81 (10) C10—C11—H11 109.0
N3—S1—C21 108.93 (10) C17—C12—C13 118.7 (2)
C24—O3—H3o 114 (2) C17—C12—C11 119.3 (2)
C1—N1—N2 107.35 (18) C13—C12—C11 121.9 (2)
C18—N2—N1 120.57 (17) C14—C13—C12 120.9 (2)
C18—N2—C11 126.45 (18) C14—C13—H13 119.5
N1—N2—C11 112.97 (16) C12—C13—H13 119.5
S1—N3—H1n 111 (2) C13—C14—C15 120.5 (3)
S1—N3—H2n 110.5 (17) C13—C14—H14 119.8
H1n—N3—H2n 121 (3) C15—C14—H14 119.8
N1—C1—C2 124.7 (2) C14—C15—C16 119.4 (3)
N1—C1—C10 114.3 (2) C14—C15—H15 120.3
C2—C1—C10 120.91 (19) C16—C15—H15 120.3
C3—C2—C7 120.3 (2) C17—C16—C15 120.1 (3)
C3—C2—C1 121.89 (19) C17—C16—H16 119.9
C7—C2—C1 117.8 (2) C15—C16—H16 119.9
C4—C3—C2 120.6 (2) C16—C17—C12 120.4 (3)
C4—C3—H3 119.7 C16—C17—H17 119.8
C2—C3—H3 119.7 C12—C17—H17 119.8
C3—C4—C5 119.6 (2) N2—C18—C23 120.35 (19)
C3—C4—H4 120.2 N2—C18—C19 120.88 (19)
C5—C4—H4 120.2 C23—C18—C19 118.76 (19)
C6—C5—C4 120.1 (2) C20—C19—C18 120.3 (2)
C6—C5—H5 120.0 C20—C19—H19 119.9
C4—C5—H5 120.0 C18—C19—H19 119.9
C5—C6—C7 121.5 (2) C19—C20—C21 120.4 (2)
C5—C6—H6 119.3 C19—C20—H20 119.8
C7—C6—H6 119.3 C21—C20—H20 119.8
C6—C7—C2 117.9 (2) C22—C21—C20 119.90 (19)
C6—C7—C8 120.8 (2) C22—C21—S1 120.66 (17)
C2—C7—C8 121.4 (2) C20—C21—S1 119.44 (16)
C7—C8—C9 113.95 (19) C21—C22—C23 120.0 (2)
C7—C8—H8A 108.8 C21—C22—H22 120.0
C9—C8—H8A 108.8 C23—C22—H22 120.0
C7—C8—H8B 108.8 C22—C23—C18 120.6 (2)
C9—C8—H8B 108.8 C22—C23—H23 119.7
H8A—C8—H8B 107.7 C18—C23—H23 119.7
C10—C9—C8 109.0 (2) C25—C24—O3 113.2 (3)
C10—C9—H9A 109.9 C25—C24—H24A 108.9
C8—C9—H9A 109.9 O3—C24—H24A 108.9
C10—C9—H9B 109.9 C25—C24—H24B 108.9
C8—C9—H9B 109.9 O3—C24—H24B 108.9
H9A—C9—H9B 108.3 H24A—C24—H24B 107.7
C9—C10—C1 108.90 (19) C24—C25—H25A 109.5
C9—C10—C11 121.0 (2) C24—C25—H25B 109.5
C1—C10—C11 101.19 (17) H25A—C25—H25B 109.5
C9—C10—H10 108.4 C24—C25—H25C 109.5
C1—C10—H10 108.4 H25A—C25—H25C 109.5
C11—C10—H10 108.4 H25B—C25—H25C 109.5
N2—C11—C12 111.94 (19)
C1—N1—N2—C18 172.3 (2) C9—C10—C11—C12 −16.4 (3)
C1—N1—N2—C11 −8.9 (2) C1—C10—C11—C12 103.9 (2)
N2—N1—C1—C2 177.9 (2) N2—C11—C12—C17 −153.5 (2)
N2—N1—C1—C10 −4.5 (3) C10—C11—C12—C17 91.3 (3)
N1—C1—C2—C3 5.3 (3) N2—C11—C12—C13 27.2 (3)
C10—C1—C2—C3 −172.2 (2) C10—C11—C12—C13 −88.0 (3)
N1—C1—C2—C7 −174.8 (2) C17—C12—C13—C14 0.5 (4)
C10—C1—C2—C7 7.8 (3) C11—C12—C13—C14 179.8 (2)
C7—C2—C3—C4 −1.3 (3) C12—C13—C14—C15 −1.0 (4)
C1—C2—C3—C4 178.6 (2) C13—C14—C15—C16 0.1 (5)
C2—C3—C4—C5 −0.3 (3) C14—C15—C16—C17 1.3 (5)
C3—C4—C5—C6 0.8 (4) C15—C16—C17—C12 −1.8 (5)
C4—C5—C6—C7 0.3 (4) C13—C12—C17—C16 0.9 (4)
C5—C6—C7—C2 −1.9 (4) C11—C12—C17—C16 −178.5 (2)
C5—C6—C7—C8 178.5 (2) N1—N2—C18—C23 −179.40 (19)
C3—C2—C7—C6 2.3 (3) C11—N2—C18—C23 2.0 (3)
C1—C2—C7—C6 −177.6 (2) N1—N2—C18—C19 −0.6 (3)
C3—C2—C7—C8 −178.0 (2) C11—N2—C18—C19 −179.3 (2)
C1—C2—C7—C8 2.1 (3) N2—C18—C19—C20 −177.0 (2)
C6—C7—C8—C9 −159.6 (2) C23—C18—C19—C20 1.8 (3)
C2—C7—C8—C9 20.8 (3) C18—C19—C20—C21 −0.3 (3)
C7—C8—C9—C10 −51.6 (3) C19—C20—C21—C22 −0.9 (3)
C8—C9—C10—C1 58.8 (3) C19—C20—C21—S1 179.81 (17)
C8—C9—C10—C11 175.3 (2) O1—S1—C21—C22 12.3 (2)
N1—C1—C10—C9 143.4 (2) O2—S1—C21—C22 141.86 (18)
C2—C1—C10—C9 −38.9 (3) N3—S1—C21—C22 −103.05 (19)
N1—C1—C10—C11 14.9 (3) O1—S1—C21—C20 −168.51 (17)
C2—C1—C10—C11 −167.4 (2) O2—S1—C21—C20 −38.9 (2)
C18—N2—C11—C12 71.2 (3) N3—S1—C21—C20 76.2 (2)
N1—N2—C11—C12 −107.5 (2) C20—C21—C22—C23 0.7 (3)
C18—N2—C11—C10 −163.9 (2) S1—C21—C22—C23 179.98 (17)
N1—N2—C11—C10 17.4 (2) C21—C22—C23—C18 0.7 (3)
C9—C10—C11—N2 −137.8 (2) N2—C18—C23—C22 176.8 (2)
C1—C10—C11—N2 −17.5 (2) C19—C18—C23—C22 −2.0 (3)