| C1—C2 | 1.3900 | C11—C12 | 1.402 (3) |
| C1—C6 | 1.3900 | C12—C13 | 1.369 (4) |
| C1—C7' | 1.531 (14) | C12—H12 | 0.9300 |
| C1—S1 | 1.7058 (18) | C13—C14 | 1.356 (4) |
| C2—C3 | 1.3900 | C13—H13 | 0.9300 |
| C2—H2 | 0.9300 | C14—F1 | 1.358 (3) |
| C3—C4 | 1.3900 | C14—C15 | 1.360 (3) |
| C3—H3 | 0.9300 | C15—C16 | 1.394 (3) |
| C4—C5 | 1.3900 | C15—H15 | 0.9300 |
| C4—H4 | 0.9300 | C16—N1 | 1.421 (3) |
| C5—C6 | 1.3900 | C17—C22 | 1.379 (3) |
| C5—H5 | 0.9300 | C17—C18 | 1.381 (3) |
| C6—C7 | 1.426 (6) | C17—S2 | 1.754 (2) |
| C6—S1' | 1.727 (5) | C18—C19 | 1.373 (4) |
| S1'—C8' | 1.738 (17) | C18—H18 | 0.9300 |
| C7'—C8' | 1.356 (18) | C19—C20 | 1.375 (4) |
| C7'—H7' | 0.9300 | C19—H19 | 0.9300 |
| C8'—C9 | 1.446 (17) | C20—C21 | 1.365 (4) |
| S1—C8 | 1.732 (7) | C20—H20 | 0.9300 |
| C7—C8 | 1.345 (8) | C21—C22 | 1.375 (4) |
| C7—H7 | 0.9300 | C21—H21 | 0.9300 |
| C8—C9 | 1.463 (7) | C22—H22 | 0.9300 |
| C9—C10 | 1.298 (3) | N1—S2 | 1.6301 (19) |
| C9—H9 | 0.9300 | N1—H1N | 0.828 (16) |
| C10—C11 | 1.467 (3) | O1—S2 | 1.4222 (14) |
| C10—H10 | 0.9300 | O2—S2 | 1.4348 (14) |
| C11—C16 | 1.393 (3) | ||
| C2—C1—C6 | 120.0 | C16—C11—C10 | 122.8 (2) |
| C2—C1—C7' | 144.2 (7) | C12—C11—C10 | 120.3 (2) |
| C6—C1—C7' | 95.5 (7) | C13—C12—C11 | 122.9 (3) |
| C2—C1—S1 | 123.88 (12) | C13—C12—H12 | 118.5 |
| C6—C1—S1 | 116.11 (12) | C11—C12—H12 | 118.5 |
| C3—C2—C1 | 120.0 | C14—C13—C12 | 117.5 (3) |
| C3—C2—H2 | 120.0 | C14—C13—H13 | 121.3 |
| C1—C2—H2 | 120.0 | C12—C13—H13 | 121.3 |
| C2—C3—C4 | 120.0 | C13—C14—F1 | 118.9 (2) |
| C2—C3—H3 | 120.0 | C13—C14—C15 | 123.4 (2) |
| C4—C3—H3 | 120.0 | F1—C14—C15 | 117.7 (3) |
| C5—C4—C3 | 120.0 | C14—C15—C16 | 118.6 (2) |
| C5—C4—H4 | 120.0 | C14—C15—H15 | 120.7 |
| C3—C4—H4 | 120.0 | C16—C15—H15 | 120.7 |
| C4—C5—C6 | 120.0 | C11—C16—C15 | 120.7 (2) |
| C4—C5—H5 | 120.0 | C11—C16—N1 | 119.74 (18) |
| C6—C5—H5 | 120.0 | C15—C16—N1 | 119.6 (2) |
| C5—C6—C1 | 120.0 | C22—C17—C18 | 121.2 (2) |
| C5—C6—C7 | 134.3 (3) | C22—C17—S2 | 119.30 (17) |
| C1—C6—C7 | 105.7 (3) | C18—C17—S2 | 119.49 (17) |
| C5—C6—S1' | 114.1 (2) | C19—C18—C17 | 118.5 (2) |
| C1—C6—S1' | 125.9 (2) | C19—C18—H18 | 120.7 |
| C6—S1'—C8' | 86.1 (6) | C17—C18—H18 | 120.7 |
| C8'—C7'—C1 | 120.6 (13) | C18—C19—C20 | 120.5 (3) |
| C8'—C7'—H7' | 119.7 | C18—C19—H19 | 119.7 |
| C1—C7'—H7' | 119.7 | C20—C19—H19 | 119.7 |
| C7'—C8'—C9 | 126.0 (15) | C21—C20—C19 | 120.5 (3) |
| C7'—C8'—S1' | 110.9 (13) | C21—C20—H20 | 119.8 |
| C9—C8'—S1' | 119.1 (13) | C19—C20—H20 | 119.8 |
| C1—S1—C8 | 90.1 (2) | C20—C21—C22 | 120.1 (3) |
| C8—C7—C6 | 117.7 (6) | C20—C21—H21 | 119.9 |
| C8—C7—H7 | 121.1 | C22—C21—H21 | 119.9 |
| C6—C7—H7 | 121.1 | C21—C22—C17 | 119.2 (2) |
| C7—C8—C9 | 126.3 (6) | C21—C22—H22 | 120.4 |
| C7—C8—S1 | 110.1 (5) | C17—C22—H22 | 120.4 |
| C9—C8—S1 | 122.9 (5) | C16—N1—S2 | 124.85 (14) |
| C10—C9—C8' | 132.4 (8) | C16—N1—H1N | 116.0 (16) |
| C10—C9—C8 | 126.6 (4) | S2—N1—H1N | 109.5 (16) |
| C10—C9—H9 | 113.8 | O1—S2—O2 | 118.64 (9) |
| C8'—C9—H9 | 113.8 | O1—S2—N1 | 109.32 (10) |
| C9—C10—C11 | 127.2 (2) | O2—S2—N1 | 104.32 (9) |
| C9—C10—H10 | 116.4 | O1—S2—C17 | 108.01 (9) |
| C11—C10—H10 | 116.4 | O2—S2—C17 | 109.55 (10) |
| C16—C11—C12 | 116.8 (2) | N1—S2—C17 | 106.35 (9) |
| C6—C1—C2—C3 | 0.0 | C8'—C9—C10—C11 | 171 (2) |
| C7'—C1—C2—C3 | −171.5 (14) | C8—C9—C10—C11 | −174.3 (7) |
| S1—C1—C2—C3 | 178.91 (16) | C9—C10—C11—C16 | −178.7 (3) |
| C1—C2—C3—C4 | 0.0 | C9—C10—C11—C12 | 2.1 (4) |
| C2—C3—C4—C5 | 0.0 | C16—C11—C12—C13 | −0.1 (5) |
| C3—C4—C5—C6 | 0.0 | C10—C11—C12—C13 | 179.2 (3) |
| C4—C5—C6—C1 | 0.0 | C11—C12—C13—C14 | −0.7 (5) |
| C4—C5—C6—C7 | 178.8 (4) | C12—C13—C14—F1 | −179.2 (3) |
| C4—C5—C6—S1' | −179.6 (2) | C12—C13—C14—C15 | −0.1 (5) |
| C2—C1—C6—C5 | 0.0 | C13—C14—C15—C16 | 1.5 (4) |
| C7'—C1—C6—C5 | 175.0 (8) | F1—C14—C15—C16 | −179.3 (2) |
| S1—C1—C6—C5 | −178.99 (15) | C12—C11—C16—C15 | 1.6 (4) |
| C2—C1—C6—C7 | −179.1 (3) | C10—C11—C16—C15 | −177.7 (2) |
| S1—C1—C6—C7 | 1.9 (3) | C12—C11—C16—N1 | 179.5 (2) |
| C2—C1—C6—S1' | 179.5 (3) | C10—C11—C16—N1 | 0.2 (3) |
| C7'—C1—C6—S1' | −5.5 (8) | C14—C15—C16—C11 | −2.3 (4) |
| C5—C6—S1'—C8' | −171.8 (13) | C14—C15—C16—N1 | 179.8 (2) |
| C1—C6—S1'—C8' | 8.7 (14) | C22—C17—C18—C19 | −0.1 (4) |
| C2—C1—C7'—C8' | 171 (2) | S2—C17—C18—C19 | 178.41 (19) |
| C6—C1—C7'—C8' | −2 (3) | C17—C18—C19—C20 | 0.2 (4) |
| C1—C7'—C8'—C9 | 165 (2) | C18—C19—C20—C21 | −0.2 (4) |
| C1—C7'—C8'—S1' | 8 (4) | C19—C20—C21—C22 | 0.2 (4) |
| C6—S1'—C8'—C7' | −8 (2) | C20—C21—C22—C17 | −0.1 (4) |
| C6—S1'—C8'—C9 | −167 (3) | C18—C17—C22—C21 | 0.0 (4) |
| C2—C1—S1—C8 | −178.8 (5) | S2—C17—C22—C21 | −178.48 (19) |
| C6—C1—S1—C8 | 0.1 (5) | C11—C16—N1—S2 | 153.99 (18) |
| C5—C6—C7—C8 | 177.3 (7) | C15—C16—N1—S2 | −28.1 (3) |
| C1—C6—C7—C8 | −3.8 (9) | C16—N1—S2—O1 | 58.1 (2) |
| C6—C7—C8—C9 | 175.1 (8) | C16—N1—S2—O2 | −174.05 (17) |
| C6—C7—C8—S1 | 4.0 (11) | C16—N1—S2—C17 | −58.28 (19) |
| C1—S1—C8—C7 | −2.2 (8) | C22—C17—S2—O1 | −8.2 (2) |
| C1—S1—C8—C9 | −173.7 (9) | C18—C17—S2—O1 | 173.24 (18) |
| C7'—C8'—C9—C10 | 15 (5) | C22—C17—S2—O2 | −138.77 (17) |
| S1'—C8'—C9—C10 | 170.8 (10) | C18—C17—S2—O2 | 42.7 (2) |
| C7—C8—C9—C10 | −178.3 (8) | C22—C17—S2—N1 | 109.03 (18) |
| S1—C8—C9—C10 | −8.4 (13) | C18—C17—S2—N1 | −69.51 (19) |