S1—C8 | 1.731 (2) | C10—C11 | 1.474 (4) |
S1—C9 | 1.714 (2) | C12—C13 | 1.499 (4) |
O1—C1 | 1.328 (3) | C4—H4A | 0.9700 |
O1—C10 | 1.459 (3) | C4—H4B | 0.9700 |
O2—C12 | 1.211 (3) | C5—H5A | 0.9700 |
O3—C1 | 1.218 (3) | C5—H5B | 0.9700 |
N1—C9 | 1.382 (3) | C6—H6A | 0.9700 |
N1—C12 | 1.364 (3) | C6—H6B | 0.9700 |
N1—H1 | 0.8600 | C7—H7A | 0.9700 |
C1—C2 | 1.463 (3) | C7—H7B | 0.9700 |
C2—C9 | 1.378 (3) | C10—H10A | 0.9700 |
C2—C3 | 1.449 (3) | C10—H10B | 0.9700 |
C3—C4 | 1.506 (3) | C11—H11A | 0.9600 |
C3—C8 | 1.346 (3) | C11—H11B | 0.9600 |
C4—C5 | 1.531 (3) | C11—H11C | 0.9600 |
C5—C6 | 1.485 (3) | C13—H13A | 0.9600 |
C6—C7 | 1.509 (4) | C13—H13B | 0.9600 |
C7—C8 | 1.499 (3) | C13—H13C | 0.9600 |
C8—S1—C9 | 91.19 (10) | C4—C5—H5A | 109.00 |
C1—O1—C10 | 115.95 (19) | C4—C5—H5B | 109.00 |
C9—N1—C12 | 126.0 (2) | C6—C5—H5A | 109.00 |
C9—N1—H1 | 117.00 | C6—C5—H5B | 109.00 |
C12—N1—H1 | 117.00 | H5A—C5—H5B | 108.00 |
O1—C1—O3 | 122.1 (2) | C5—C6—H6A | 109.00 |
O3—C1—C2 | 124.3 (2) | C5—C6—H6B | 109.00 |
O1—C1—C2 | 113.63 (18) | C7—C6—H6A | 109.00 |
C1—C2—C9 | 119.95 (18) | C7—C6—H6B | 109.00 |
C1—C2—C3 | 128.32 (17) | H6A—C6—H6B | 108.00 |
C3—C2—C9 | 111.72 (18) | C6—C7—H7A | 110.00 |
C2—C3—C8 | 111.88 (17) | C6—C7—H7B | 110.00 |
C2—C3—C4 | 127.17 (18) | C8—C7—H7A | 110.00 |
C4—C3—C8 | 120.95 (18) | C8—C7—H7B | 110.00 |
C3—C4—C5 | 111.59 (19) | H7A—C7—H7B | 108.00 |
C4—C5—C6 | 113.14 (19) | O1—C10—H10A | 110.00 |
C5—C6—C7 | 111.6 (2) | O1—C10—H10B | 110.00 |
C6—C7—C8 | 109.67 (18) | C11—C10—H10A | 110.00 |
C3—C8—C7 | 126.2 (2) | C11—C10—H10B | 110.00 |
S1—C8—C3 | 112.99 (16) | H10A—C10—H10B | 108.00 |
S1—C8—C7 | 120.80 (16) | C10—C11—H11A | 109.00 |
N1—C9—C2 | 125.09 (19) | C10—C11—H11B | 109.00 |
S1—C9—N1 | 122.70 (16) | C10—C11—H11C | 109.00 |
S1—C9—C2 | 112.22 (16) | H11A—C11—H11B | 109.00 |
O1—C10—C11 | 107.6 (2) | H11A—C11—H11C | 109.00 |
N1—C12—C13 | 115.0 (2) | H11B—C11—H11C | 109.00 |
O2—C12—N1 | 121.4 (2) | C12—C13—H13A | 109.00 |
O2—C12—C13 | 123.5 (2) | C12—C13—H13B | 109.00 |
C3—C4—H4A | 109.00 | C12—C13—H13C | 109.00 |
C3—C4—H4B | 109.00 | H13A—C13—H13B | 109.00 |
C5—C4—H4A | 109.00 | H13A—C13—H13C | 110.00 |
C5—C4—H4B | 109.00 | H13B—C13—H13C | 109.00 |
H4A—C4—H4B | 108.00 | ||
C9—S1—C8—C3 | −0.74 (18) | C9—C2—C3—C4 | 178.71 (19) |
C9—S1—C8—C7 | −179.82 (19) | C9—C2—C3—C8 | −0.6 (2) |
C8—S1—C9—N1 | −179.31 (19) | C1—C2—C9—S1 | 179.01 (15) |
C8—S1—C9—C2 | 0.37 (17) | C1—C2—C9—N1 | −1.3 (3) |
C10—O1—C1—O3 | −4.5 (3) | C3—C2—C9—S1 | 0.0 (2) |
C10—O1—C1—C2 | 175.9 (2) | C3—C2—C9—N1 | 179.72 (19) |
C1—O1—C10—C11 | −169.7 (2) | C2—C3—C4—C5 | −167.96 (19) |
C12—N1—C9—S1 | −5.9 (3) | C8—C3—C4—C5 | 11.3 (3) |
C12—N1—C9—C2 | 174.4 (2) | C2—C3—C8—S1 | 0.9 (2) |
C9—N1—C12—O2 | 1.2 (4) | C2—C3—C8—C7 | 179.9 (2) |
C9—N1—C12—C13 | −177.8 (2) | C4—C3—C8—S1 | −178.48 (15) |
O1—C1—C2—C3 | −2.4 (3) | C4—C3—C8—C7 | 0.6 (3) |
O1—C1—C2—C9 | 178.80 (19) | C3—C4—C5—C6 | −41.8 (3) |
O3—C1—C2—C3 | 178.0 (2) | C4—C5—C6—C7 | 61.4 (3) |
O3—C1—C2—C9 | −0.8 (3) | C5—C6—C7—C8 | −46.2 (3) |
C1—C2—C3—C4 | −0.2 (3) | C6—C7—C8—S1 | −164.26 (17) |
C1—C2—C3—C8 | −179.5 (2) | C6—C7—C8—C3 | 16.8 (3) |