| S1—C9 | 1.6982 (7) | C5—H5A | 0.9500 |
| O1—C8 | 1.2259 (9) | C6—C7 | 1.5261 (10) |
| N1—C8 | 1.3699 (10) | C7—C8 | 1.5190 (10) |
| N1—N2 | 1.3927 (9) | C7—C14 | 1.5270 (11) |
| N1—H1N1 | 0.884 (14) | C7—H7A | 1.0000 |
| N2—C9 | 1.3578 (9) | C10—C11 | 1.5381 (12) |
| N2—H1N2 | 0.855 (15) | C10—H10A | 0.9900 |
| N3—C9 | 1.3318 (9) | C10—H10B | 0.9900 |
| N3—H2N3 | 0.851 (14) | C11—C12 | 1.5178 (14) |
| N3—H1N3 | 0.843 (14) | C11—C13 | 1.5269 (12) |
| C1—C2 | 1.3925 (10) | C11—H11A | 1.0000 |
| C1—C6 | 1.4019 (10) | C12—H12A | 0.9800 |
| C1—H1A | 0.9500 | C12—H12B | 0.9800 |
| C2—C3 | 1.4002 (11) | C12—H12C | 0.9800 |
| C2—H2A | 0.9500 | C13—H13A | 0.9800 |
| C3—C4 | 1.3957 (12) | C13—H13B | 0.9800 |
| C3—C10 | 1.5100 (11) | C13—H13C | 0.9800 |
| C4—C5 | 1.3947 (11) | C14—H14A | 0.9800 |
| C4—H4A | 0.9500 | C14—H14B | 0.9800 |
| C5—C6 | 1.3946 (11) | C14—H14C | 0.9800 |
| C8—N1—N2 | 119.30 (6) | N1—C8—C7 | 114.12 (6) |
| C8—N1—H1N1 | 123.8 (9) | N3—C9—N2 | 117.81 (6) |
| N2—N1—H1N1 | 114.5 (8) | N3—C9—S1 | 123.05 (5) |
| C9—N2—N1 | 119.39 (6) | N2—C9—S1 | 119.12 (5) |
| C9—N2—H1N2 | 119.6 (9) | C3—C10—C11 | 113.56 (6) |
| N1—N2—H1N2 | 115.4 (9) | C3—C10—H10A | 108.9 |
| C9—N3—H2N3 | 121.5 (10) | C11—C10—H10A | 108.9 |
| C9—N3—H1N3 | 118.9 (10) | C3—C10—H10B | 108.9 |
| H2N3—N3—H1N3 | 119.6 (13) | C11—C10—H10B | 108.9 |
| C2—C1—C6 | 120.56 (7) | H10A—C10—H10B | 107.7 |
| C2—C1—H1A | 119.7 | C12—C11—C13 | 110.83 (8) |
| C6—C1—H1A | 119.7 | C12—C11—C10 | 111.70 (8) |
| C1—C2—C3 | 121.12 (7) | C13—C11—C10 | 110.21 (7) |
| C1—C2—H2A | 119.4 | C12—C11—H11A | 108.0 |
| C3—C2—H2A | 119.4 | C13—C11—H11A | 108.0 |
| C4—C3—C2 | 117.97 (7) | C10—C11—H11A | 108.0 |
| C4—C3—C10 | 121.57 (7) | C11—C12—H12A | 109.5 |
| C2—C3—C10 | 120.45 (7) | C11—C12—H12B | 109.5 |
| C5—C4—C3 | 121.16 (7) | H12A—C12—H12B | 109.5 |
| C5—C4—H4A | 119.4 | C11—C12—H12C | 109.5 |
| C3—C4—H4A | 119.4 | H12A—C12—H12C | 109.5 |
| C6—C5—C4 | 120.71 (7) | H12B—C12—H12C | 109.5 |
| C6—C5—H5A | 119.6 | C11—C13—H13A | 109.5 |
| C4—C5—H5A | 119.6 | C11—C13—H13B | 109.5 |
| C5—C6—C1 | 118.45 (7) | H13A—C13—H13B | 109.5 |
| C5—C6—C7 | 120.22 (6) | C11—C13—H13C | 109.5 |
| C1—C6—C7 | 121.14 (6) | H13A—C13—H13C | 109.5 |
| C8—C7—C6 | 104.02 (5) | H13B—C13—H13C | 109.5 |
| C8—C7—C14 | 112.04 (7) | C7—C14—H14A | 109.5 |
| C6—C7—C14 | 113.91 (6) | C7—C14—H14B | 109.5 |
| C8—C7—H7A | 108.9 | H14A—C14—H14B | 109.5 |
| C6—C7—H7A | 108.9 | C7—C14—H14C | 109.5 |
| C14—C7—H7A | 108.9 | H14A—C14—H14C | 109.5 |
| O1—C8—N1 | 121.87 (7) | H14B—C14—H14C | 109.5 |
| O1—C8—C7 | 123.83 (7) | ||
| C8—N1—N2—C9 | 81.80 (8) | C1—C6—C7—C14 | −59.88 (9) |
| C6—C1—C2—C3 | 0.06 (12) | N2—N1—C8—O1 | 16.17 (10) |
| C1—C2—C3—C4 | −1.36 (11) | N2—N1—C8—C7 | −159.10 (6) |
| C1—C2—C3—C10 | 179.31 (7) | C6—C7—C8—O1 | −91.51 (8) |
| C2—C3—C4—C5 | 1.40 (12) | C14—C7—C8—O1 | 31.97 (10) |
| C10—C3—C4—C5 | −179.28 (7) | C6—C7—C8—N1 | 83.65 (7) |
| C3—C4—C5—C6 | −0.13 (12) | C14—C7—C8—N1 | −152.87 (6) |
| C4—C5—C6—C1 | −1.19 (11) | N1—N2—C9—N3 | 14.79 (10) |
| C4—C5—C6—C7 | 173.91 (7) | N1—N2—C9—S1 | −166.70 (5) |
| C2—C1—C6—C5 | 1.22 (11) | C4—C3—C10—C11 | −106.27 (9) |
| C2—C1—C6—C7 | −173.83 (7) | C2—C3—C10—C11 | 73.03 (10) |
| C5—C6—C7—C8 | −112.59 (7) | C3—C10—C11—C12 | 62.58 (11) |
| C1—C6—C7—C8 | 62.37 (8) | C3—C10—C11—C13 | −173.75 (8) |
| C5—C6—C7—C14 | 125.16 (8) |