| S1—O3 | 1.422 (2) | C9—C14 | 1.388 (3) |
| S1—O2 | 1.4275 (19) | C9—C10 | 1.397 (3) |
| S1—N2 | 1.606 (2) | C10—C11 | 1.374 (3) |
| S1—C11 | 1.784 (2) | C10—H10 | 0.9300 |
| S2—O8 | 1.4296 (19) | C11—C12 | 1.405 (3) |
| S2—O7 | 1.4318 (17) | C12—C13 | 1.391 (4) |
| S2—N4 | 1.592 (2) | C12—C15 | 1.488 (4) |
| S2—C27 | 1.797 (2) | C13—C14 | 1.373 (3) |
| O1—C8 | 1.226 (3) | C13—H13 | 0.9300 |
| O4—C15 | 1.206 (3) | C14—H14 | 0.9300 |
| O5—C15 | 1.327 (3) | C16—H16A | 0.9600 |
| O5—C16 | 1.441 (3) | C16—H16B | 0.9600 |
| O6—C24 | 1.216 (3) | C16—H16C | 0.9600 |
| O9—C31 | 1.197 (3) | C17—C18 | 1.374 (4) |
| O10—C31 | 1.322 (3) | C17—C22 | 1.393 (4) |
| O10—C32 | 1.439 (3) | C17—C24 | 1.487 (4) |
| N1—C8 | 1.366 (3) | C18—C19 | 1.373 (4) |
| N1—C9 | 1.407 (3) | C18—H18 | 0.9300 |
| N1—H1A | 0.890 (10) | C19—C20 | 1.379 (4) |
| N2—H2A | 0.888 (10) | C19—H19 | 0.9300 |
| N2—H2B | 0.892 (10) | C20—C21 | 1.379 (4) |
| N3—C24 | 1.374 (3) | C20—C23 | 1.503 (4) |
| N3—C25 | 1.398 (3) | C21—C22 | 1.376 (4) |
| N3—H3A | 0.889 (10) | C21—H21 | 0.9300 |
| N4—H4A | 0.886 (10) | C22—H22 | 0.9300 |
| N4—H4B | 0.888 (10) | C23—H23A | 0.9600 |
| C1—C6 | 1.376 (4) | C23—H23B | 0.9600 |
| C1—C2 | 1.387 (3) | C23—H23C | 0.9600 |
| C1—C8 | 1.485 (3) | C25—C30 | 1.382 (3) |
| C2—C3 | 1.373 (4) | C25—C26 | 1.402 (3) |
| C2—H2 | 0.9300 | C26—C27 | 1.376 (3) |
| C3—C4 | 1.376 (4) | C26—H26 | 0.9300 |
| C3—H3 | 0.9300 | C27—C28 | 1.417 (3) |
| C4—C5 | 1.379 (4) | C28—C29 | 1.384 (3) |
| C4—C7 | 1.502 (4) | C28—C31 | 1.484 (3) |
| C5—C6 | 1.372 (4) | C29—C30 | 1.374 (3) |
| C5—H5 | 0.9300 | C29—H29 | 0.9300 |
| C6—H6 | 0.9300 | C30—H30 | 0.9300 |
| C7—H7A | 0.9600 | C32—H32A | 0.9600 |
| C7—H7B | 0.9600 | C32—H32B | 0.9600 |
| C7—H7C | 0.9600 | C32—H32C | 0.9600 |
| O3—S1—O2 | 119.98 (13) | C12—C13—H13 | 118.8 |
| O3—S1—N2 | 106.99 (13) | C13—C14—C9 | 119.7 (2) |
| O2—S1—N2 | 106.49 (13) | C13—C14—H14 | 120.2 |
| O3—S1—C11 | 107.35 (12) | C9—C14—H14 | 120.2 |
| O2—S1—C11 | 107.47 (11) | O4—C15—O5 | 123.6 (2) |
| N2—S1—C11 | 108.08 (12) | O4—C15—C12 | 125.2 (3) |
| O8—S2—O7 | 117.81 (11) | O5—C15—C12 | 111.1 (2) |
| O8—S2—N4 | 108.82 (12) | O5—C16—H16A | 109.5 |
| O7—S2—N4 | 105.66 (12) | O5—C16—H16B | 109.5 |
| O8—S2—C27 | 106.89 (11) | H16A—C16—H16B | 109.5 |
| O7—S2—C27 | 106.71 (11) | O5—C16—H16C | 109.5 |
| N4—S2—C27 | 110.93 (12) | H16A—C16—H16C | 109.5 |
| C15—O5—C16 | 116.1 (2) | H16B—C16—H16C | 109.5 |
| C31—O10—C32 | 117.0 (2) | C18—C17—C22 | 116.9 (3) |
| C8—N1—C9 | 127.6 (2) | C18—C17—C24 | 125.2 (2) |
| C8—N1—H1A | 114.6 (19) | C22—C17—C24 | 117.8 (2) |
| C9—N1—H1A | 117.9 (19) | C19—C18—C17 | 121.9 (3) |
| S1—N2—H2A | 114.3 (18) | C19—C18—H18 | 119.1 |
| S1—N2—H2B | 111.7 (18) | C17—C18—H18 | 119.1 |
| H2A—N2—H2B | 114.7 (16) | C18—C19—C20 | 121.7 (3) |
| C24—N3—C25 | 127.0 (2) | C18—C19—H19 | 119.2 |
| C24—N3—H3A | 118.2 (19) | C20—C19—H19 | 119.2 |
| C25—N3—H3A | 114.8 (19) | C21—C20—C19 | 116.5 (3) |
| S2—N4—H4A | 114.9 (17) | C21—C20—C23 | 121.9 (3) |
| S2—N4—H4B | 114.4 (18) | C19—C20—C23 | 121.5 (3) |
| H4A—N4—H4B | 116.4 (16) | C22—C21—C20 | 122.3 (3) |
| C6—C1—C2 | 117.4 (2) | C22—C21—H21 | 118.9 |
| C6—C1—C8 | 124.5 (2) | C20—C21—H21 | 118.9 |
| C2—C1—C8 | 118.1 (2) | C21—C22—C17 | 120.6 (3) |
| C3—C2—C1 | 120.5 (3) | C21—C22—H22 | 119.7 |
| C3—C2—H2 | 119.7 | C17—C22—H22 | 119.7 |
| C1—C2—H2 | 119.7 | C20—C23—H23A | 109.5 |
| C2—C3—C4 | 122.3 (3) | C20—C23—H23B | 109.5 |
| C2—C3—H3 | 118.9 | H23A—C23—H23B | 109.5 |
| C4—C3—H3 | 118.9 | C20—C23—H23C | 109.5 |
| C3—C4—C5 | 116.7 (3) | H23A—C23—H23C | 109.5 |
| C3—C4—C7 | 121.8 (3) | H23B—C23—H23C | 109.5 |
| C5—C4—C7 | 121.5 (3) | O6—C24—N3 | 122.3 (2) |
| C6—C5—C4 | 121.6 (3) | O6—C24—C17 | 121.7 (2) |
| C6—C5—H5 | 119.2 | N3—C24—C17 | 116.0 (2) |
| C4—C5—H5 | 119.2 | C30—C25—N3 | 123.7 (2) |
| C5—C6—C1 | 121.5 (3) | C30—C25—C26 | 118.9 (2) |
| C5—C6—H6 | 119.3 | N3—C25—C26 | 117.3 (2) |
| C1—C6—H6 | 119.3 | C27—C26—C25 | 120.8 (2) |
| C4—C7—H7A | 109.5 | C27—C26—H26 | 119.6 |
| C4—C7—H7B | 109.5 | C25—C26—H26 | 119.6 |
| H7A—C7—H7B | 109.5 | C26—C27—C28 | 120.5 (2) |
| C4—C7—H7C | 109.5 | C26—C27—S2 | 115.51 (18) |
| H7A—C7—H7C | 109.5 | C28—C27—S2 | 123.87 (18) |
| H7B—C7—H7C | 109.5 | C29—C28—C27 | 117.0 (2) |
| O1—C8—N1 | 122.2 (2) | C29—C28—C31 | 119.0 (2) |
| O1—C8—C1 | 121.4 (2) | C27—C28—C31 | 123.9 (2) |
| N1—C8—C1 | 116.4 (2) | C30—C29—C28 | 122.8 (2) |
| C14—C9—C10 | 119.1 (2) | C30—C29—H29 | 118.6 |
| C14—C9—N1 | 123.9 (2) | C28—C29—H29 | 118.6 |
| C10—C9—N1 | 117.0 (2) | C29—C30—C25 | 119.8 (2) |
| C11—C10—C9 | 120.5 (2) | C29—C30—H30 | 120.1 |
| C11—C10—H10 | 119.7 | C25—C30—H30 | 120.1 |
| C9—C10—H10 | 119.7 | O9—C31—O10 | 121.9 (2) |
| C10—C11—C12 | 121.0 (2) | O9—C31—C28 | 126.0 (2) |
| C10—C11—S1 | 117.22 (19) | O10—C31—C28 | 112.1 (2) |
| C12—C11—S1 | 121.70 (19) | O10—C32—H32A | 109.5 |
| C13—C12—C11 | 117.1 (2) | O10—C32—H32B | 109.5 |
| C13—C12—C15 | 118.1 (2) | H32A—C32—H32B | 109.5 |
| C11—C12—C15 | 124.7 (2) | O10—C32—H32C | 109.5 |
| C14—C13—C12 | 122.5 (2) | H32A—C32—H32C | 109.5 |
| C14—C13—H13 | 118.8 | H32B—C32—H32C | 109.5 |
| C6—C1—C2—C3 | −1.4 (5) | C22—C17—C18—C19 | −2.7 (5) |
| C8—C1—C2—C3 | 179.8 (3) | C24—C17—C18—C19 | 175.1 (3) |
| C1—C2—C3—C4 | 0.9 (5) | C17—C18—C19—C20 | 0.9 (5) |
| C2—C3—C4—C5 | 0.5 (5) | C18—C19—C20—C21 | 1.6 (5) |
| C2—C3—C4—C7 | 179.0 (3) | C18—C19—C20—C23 | −177.0 (3) |
| C3—C4—C5—C6 | −1.4 (5) | C19—C20—C21—C22 | −2.2 (5) |
| C7—C4—C5—C6 | −179.8 (3) | C23—C20—C21—C22 | 176.4 (3) |
| C4—C5—C6—C1 | 0.9 (5) | C20—C21—C22—C17 | 0.4 (5) |
| C2—C1—C6—C5 | 0.5 (5) | C18—C17—C22—C21 | 2.1 (5) |
| C8—C1—C6—C5 | 179.2 (3) | C24—C17—C22—C21 | −175.9 (3) |
| C9—N1—C8—O1 | −1.5 (4) | C25—N3—C24—O6 | 4.5 (5) |
| C9—N1—C8—C1 | 177.6 (2) | C25—N3—C24—C17 | −172.5 (2) |
| C6—C1—C8—O1 | −163.4 (3) | C18—C17—C24—O6 | −175.9 (3) |
| C2—C1—C8—O1 | 15.2 (4) | C22—C17—C24—O6 | 1.8 (4) |
| C6—C1—C8—N1 | 17.4 (4) | C18—C17—C24—N3 | 1.1 (4) |
| C2—C1—C8—N1 | −164.0 (3) | C22—C17—C24—N3 | 178.8 (3) |
| C8—N1—C9—C14 | −11.7 (4) | C24—N3—C25—C30 | −16.3 (4) |
| C8—N1—C9—C10 | 169.0 (3) | C24—N3—C25—C26 | 164.2 (3) |
| C14—C9—C10—C11 | 0.2 (4) | C30—C25—C26—C27 | 1.8 (4) |
| N1—C9—C10—C11 | 179.6 (2) | N3—C25—C26—C27 | −178.7 (2) |
| C9—C10—C11—C12 | 1.3 (4) | C25—C26—C27—C28 | 1.7 (4) |
| C9—C10—C11—S1 | 179.0 (2) | C25—C26—C27—S2 | −173.9 (2) |
| O3—S1—C11—C10 | −134.1 (2) | O8—S2—C27—C26 | 123.5 (2) |
| O2—S1—C11—C10 | −3.8 (3) | O7—S2—C27—C26 | −3.4 (2) |
| N2—S1—C11—C10 | 110.8 (2) | N4—S2—C27—C26 | −118.0 (2) |
| O3—S1—C11—C12 | 43.6 (3) | O8—S2—C27—C28 | −52.0 (2) |
| O2—S1—C11—C12 | 174.0 (2) | O7—S2—C27—C28 | −178.9 (2) |
| N2—S1—C11—C12 | −71.5 (2) | N4—S2—C27—C28 | 66.5 (2) |
| C10—C11—C12—C13 | −0.9 (4) | C26—C27—C28—C29 | −3.2 (4) |
| S1—C11—C12—C13 | −178.6 (2) | S2—C27—C28—C29 | 172.1 (2) |
| C10—C11—C12—C15 | −177.1 (3) | C26—C27—C28—C31 | 174.4 (2) |
| S1—C11—C12—C15 | 5.2 (4) | S2—C27—C28—C31 | −10.2 (4) |
| C11—C12—C13—C14 | −1.0 (4) | C27—C28—C29—C30 | 1.2 (4) |
| C15—C12—C13—C14 | 175.5 (3) | C31—C28—C29—C30 | −176.5 (2) |
| C12—C13—C14—C9 | 2.5 (4) | C28—C29—C30—C25 | 2.3 (4) |
| C10—C9—C14—C13 | −2.1 (4) | N3—C25—C30—C29 | 176.7 (3) |
| N1—C9—C14—C13 | 178.6 (3) | C26—C25—C30—C29 | −3.7 (4) |
| C16—O5—C15—O4 | −1.3 (4) | C32—O10—C31—O9 | −2.3 (4) |
| C16—O5—C15—C12 | −178.0 (2) | C32—O10—C31—C28 | 176.5 (2) |
| C13—C12—C15—O4 | −132.5 (3) | C29—C28—C31—O9 | 169.9 (3) |
| C11—C12—C15—O4 | 43.7 (4) | C27—C28—C31—O9 | −7.7 (4) |
| C13—C12—C15—O5 | 44.2 (4) | C29—C28—C31—O10 | −8.9 (4) |
| C11—C12—C15—O5 | −139.6 (3) | C27—C28—C31—O10 | 173.6 (2) |