| S1A—C12A | 1.6621 (18) | S1B—C12B | 1.6618 (19) |
| F1A—C20A | 1.356 (2) | F1B—C20B | 1.359 (2) |
| N1A—C1A | 1.382 (2) | N1B—C1B | 1.386 (2) |
| N1A—C8A | 1.399 (2) | N1B—C8B | 1.394 (2) |
| N1A—C14A | 1.479 (2) | N1B—C14B | 1.473 (2) |
| N2A—C11A | 1.283 (2) | N2B—C11B | 1.281 (2) |
| N2A—N3A | 1.3940 (18) | N2B—N3B | 1.3955 (18) |
| N3A—C13A | 1.368 (2) | N3B—C13B | 1.362 (2) |
| N3A—C12A | 1.385 (2) | N3B—C12B | 1.386 (2) |
| N4A—C12A | 1.344 (2) | N4B—C12B | 1.341 (2) |
| N4A—N5A | 1.372 (2) | N4B—N5B | 1.371 (2) |
| N4A—H4AB | 0.91 (3) | N4B—H4BB | 0.90 (3) |
| N5A—C13A | 1.287 (2) | N5B—C13B | 1.287 (2) |
| C1A—C2A | 1.395 (2) | C1B—C2B | 1.394 (2) |
| C1A—C6A | 1.411 (2) | C1B—C6B | 1.409 (2) |
| C2A—C3A | 1.373 (3) | C2B—C3B | 1.377 (3) |
| C2A—H2AA | 0.9300 | C2B—H2BA | 0.9300 |
| C3A—C4A | 1.396 (3) | C3B—C4B | 1.394 (3) |
| C3A—H3AA | 0.9300 | C3B—H3BA | 0.9300 |
| C4A—C5A | 1.371 (3) | C4B—C5B | 1.367 (3) |
| C4A—H4AA | 0.9300 | C4B—H4BA | 0.9300 |
| C5A—C6A | 1.402 (2) | C5B—C6B | 1.402 (2) |
| C5A—H5AA | 0.9300 | C5B—H5BA | 0.9300 |
| C6A—C7A | 1.417 (2) | C6B—C7B | 1.423 (2) |
| C7A—C8A | 1.388 (2) | C7B—C8B | 1.385 (2) |
| C7A—C17A | 1.478 (2) | C7B—C17B | 1.473 (2) |
| C8A—C9A | 1.436 (2) | C8B—C9B | 1.437 (2) |
| C9A—C10A | 1.342 (2) | C9B—C10B | 1.335 (2) |
| C9A—H9AA | 0.9300 | C9B—H9BA | 0.9300 |
| C10A—C11A | 1.429 (2) | C10B—C11B | 1.432 (2) |
| C10A—H10A | 0.9300 | C10B—H10B | 0.9300 |
| C11A—H11A | 0.9300 | C11B—H11B | 0.9300 |
| C13A—H13A | 0.9300 | C13B—H13B | 0.9300 |
| C14A—C15A | 1.514 (3) | C14B—C15B | 1.518 (3) |
| C14A—C16A | 1.518 (3) | C14B—C16B | 1.520 (3) |
| C14A—H14A | 0.9800 | C14B—H14B | 0.9800 |
| C15A—H15A | 0.9600 | C15B—H15D | 0.9600 |
| C15A—H15B | 0.9600 | C15B—H15E | 0.9600 |
| C15A—H15C | 0.9600 | C15B—H15F | 0.9600 |
| C16A—H16A | 0.9600 | C16B—H16D | 0.9600 |
| C16A—H16B | 0.9600 | C16B—H16E | 0.9600 |
| C16A—H16C | 0.9600 | C16B—H16F | 0.9600 |
| C17A—C22A | 1.379 (2) | C17B—C18B | 1.386 (3) |
| C17A—C18A | 1.386 (2) | C17B—C22B | 1.389 (2) |
| C18A—C19A | 1.381 (2) | C18B—C19B | 1.384 (3) |
| C18A—H18A | 0.9300 | C18B—H18B | 0.9300 |
| C19A—C20A | 1.356 (3) | C19B—C20B | 1.364 (3) |
| C19A—H19A | 0.9300 | C19B—H19B | 0.9300 |
| C20A—C21A | 1.353 (3) | C20B—C21B | 1.354 (3) |
| C21A—C22A | 1.385 (3) | C21B—C22B | 1.385 (3) |
| C21A—H21A | 0.9300 | C21B—H21B | 0.9300 |
| C22A—H22A | 0.9300 | C22B—H22B | 0.9300 |
| C1A—N1A—C8A | 107.86 (13) | C1B—N1B—C8B | 107.49 (14) |
| C1A—N1A—C14A | 124.51 (13) | C1B—N1B—C14B | 125.46 (14) |
| C8A—N1A—C14A | 126.36 (13) | C8B—N1B—C14B | 124.92 (14) |
| C11A—N2A—N3A | 117.96 (13) | C11B—N2B—N3B | 116.57 (14) |
| C13A—N3A—C12A | 108.07 (14) | C13B—N3B—C12B | 108.25 (14) |
| C13A—N3A—N2A | 119.78 (13) | C13B—N3B—N2B | 120.17 (14) |
| C12A—N3A—N2A | 131.35 (14) | C12B—N3B—N2B | 131.03 (15) |
| C12A—N4A—N5A | 114.68 (15) | C12B—N4B—N5B | 114.71 (15) |
| C12A—N4A—H4AB | 124.6 (16) | C12B—N4B—H4BB | 125.5 (17) |
| N5A—N4A—H4AB | 120.5 (16) | N5B—N4B—H4BB | 119.8 (17) |
| C13A—N5A—N4A | 103.21 (14) | C13B—N5B—N4B | 103.27 (15) |
| N1A—C1A—C2A | 131.02 (15) | N1B—C1B—C2B | 130.38 (17) |
| N1A—C1A—C6A | 108.27 (14) | N1B—C1B—C6B | 108.73 (14) |
| C2A—C1A—C6A | 120.71 (15) | C2B—C1B—C6B | 120.88 (16) |
| C3A—C2A—C1A | 117.77 (17) | C3B—C2B—C1B | 117.91 (18) |
| C3A—C2A—H2AA | 121.1 | C3B—C2B—H2BA | 121.0 |
| C1A—C2A—H2AA | 121.1 | C1B—C2B—H2BA | 121.0 |
| C2A—C3A—C4A | 122.14 (18) | C2B—C3B—C4B | 121.70 (17) |
| C2A—C3A—H3AA | 118.9 | C2B—C3B—H3BA | 119.1 |
| C4A—C3A—H3AA | 118.9 | C4B—C3B—H3BA | 119.1 |
| C5A—C4A—C3A | 120.66 (17) | C5B—C4B—C3B | 120.80 (17) |
| C5A—C4A—H4AA | 119.7 | C5B—C4B—H4BA | 119.6 |
| C3A—C4A—H4AA | 119.7 | C3B—C4B—H4BA | 119.6 |
| C4A—C5A—C6A | 118.62 (17) | C4B—C5B—C6B | 119.06 (18) |
| C4A—C5A—H5AA | 120.7 | C4B—C5B—H5BA | 120.5 |
| C6A—C5A—H5AA | 120.7 | C6B—C5B—H5BA | 120.5 |
| C5A—C6A—C1A | 120.09 (15) | C5B—C6B—C1B | 119.59 (15) |
| C5A—C6A—C7A | 132.27 (15) | C5B—C6B—C7B | 133.36 (17) |
| C1A—C6A—C7A | 107.63 (14) | C1B—C6B—C7B | 107.05 (14) |
| C8A—C7A—C6A | 106.91 (14) | C8B—C7B—C6B | 107.00 (15) |
| C8A—C7A—C17A | 128.82 (14) | C8B—C7B—C17B | 125.95 (15) |
| C6A—C7A—C17A | 124.25 (14) | C6B—C7B—C17B | 127.04 (15) |
| C7A—C8A—N1A | 109.33 (13) | C7B—C8B—N1B | 109.70 (14) |
| C7A—C8A—C9A | 122.57 (14) | C7B—C8B—C9B | 122.96 (15) |
| N1A—C8A—C9A | 127.96 (14) | N1B—C8B—C9B | 127.25 (15) |
| C10A—C9A—C8A | 132.44 (15) | C10B—C9B—C8B | 132.70 (16) |
| C10A—C9A—H9AA | 113.8 | C10B—C9B—H9BA | 113.7 |
| C8A—C9A—H9AA | 113.8 | C8B—C9B—H9BA | 113.7 |
| C9A—C10A—C11A | 119.92 (15) | C9B—C10B—C11B | 118.64 (16) |
| C9A—C10A—H10A | 120.0 | C9B—C10B—H10B | 120.7 |
| C11A—C10A—H10A | 120.0 | C11B—C10B—H10B | 120.7 |
| N2A—C11A—C10A | 119.84 (15) | N2B—C11B—C10B | 120.80 (16) |
| N2A—C11A—H11A | 120.1 | N2B—C11B—H11B | 119.6 |
| C10A—C11A—H11A | 120.1 | C10B—C11B—H11B | 119.6 |
| N4A—C12A—N3A | 101.82 (14) | N4B—C12B—N3B | 101.69 (15) |
| N4A—C12A—S1A | 126.62 (13) | N4B—C12B—S1B | 126.76 (14) |
| N3A—C12A—S1A | 131.56 (13) | N3B—C12B—S1B | 131.55 (13) |
| N5A—C13A—N3A | 112.20 (16) | N5B—C13B—N3B | 112.06 (17) |
| N5A—C13A—H13A | 123.9 | N5B—C13B—H13B | 124.0 |
| N3A—C13A—H13A | 123.9 | N3B—C13B—H13B | 124.0 |
| N1A—C14A—C15A | 111.43 (16) | N1B—C14B—C15B | 110.91 (17) |
| N1A—C14A—C16A | 111.89 (15) | N1B—C14B—C16B | 112.39 (15) |
| C15A—C14A—C16A | 112.67 (16) | C15B—C14B—C16B | 112.68 (17) |
| N1A—C14A—H14A | 106.8 | N1B—C14B—H14B | 106.8 |
| C15A—C14A—H14A | 106.8 | C15B—C14B—H14B | 106.8 |
| C16A—C14A—H14A | 106.8 | C16B—C14B—H14B | 106.8 |
| C14A—C15A—H15A | 109.5 | C14B—C15B—H15D | 109.5 |
| C14A—C15A—H15B | 109.5 | C14B—C15B—H15E | 109.5 |
| H15A—C15A—H15B | 109.5 | H15D—C15B—H15E | 109.5 |
| C14A—C15A—H15C | 109.5 | C14B—C15B—H15F | 109.5 |
| H15A—C15A—H15C | 109.5 | H15D—C15B—H15F | 109.5 |
| H15B—C15A—H15C | 109.5 | H15E—C15B—H15F | 109.5 |
| C14A—C16A—H16A | 109.5 | C14B—C16B—H16D | 109.5 |
| C14A—C16A—H16B | 109.5 | C14B—C16B—H16E | 109.5 |
| H16A—C16A—H16B | 109.5 | H16D—C16B—H16E | 109.5 |
| C14A—C16A—H16C | 109.5 | C14B—C16B—H16F | 109.5 |
| H16A—C16A—H16C | 109.5 | H16D—C16B—H16F | 109.5 |
| H16B—C16A—H16C | 109.5 | H16E—C16B—H16F | 109.5 |
| C22A—C17A—C18A | 117.71 (16) | C18B—C17B—C22B | 117.97 (17) |
| C22A—C17A—C7A | 122.67 (15) | C18B—C17B—C7B | 120.80 (15) |
| C18A—C17A—C7A | 119.54 (15) | C22B—C17B—C7B | 121.23 (17) |
| C19A—C18A—C17A | 121.63 (17) | C19B—C18B—C17B | 121.48 (18) |
| C19A—C18A—H18A | 119.2 | C19B—C18B—H18B | 119.3 |
| C17A—C18A—H18A | 119.2 | C17B—C18B—H18B | 119.3 |
| C20A—C19A—C18A | 118.09 (18) | C20B—C19B—C18B | 118.0 (2) |
| C20A—C19A—H19A | 121.0 | C20B—C19B—H19B | 121.0 |
| C18A—C19A—H19A | 121.0 | C18B—C19B—H19B | 121.0 |
| C21A—C20A—C19A | 122.76 (18) | C21B—C20B—F1B | 118.8 (2) |
| C21A—C20A—F1A | 118.94 (19) | C21B—C20B—C19B | 122.98 (19) |
| C19A—C20A—F1A | 118.30 (19) | F1B—C20B—C19B | 118.3 (2) |
| C20A—C21A—C22A | 118.65 (19) | C20B—C21B—C22B | 118.66 (19) |
| C20A—C21A—H21A | 120.7 | C20B—C21B—H21B | 120.7 |
| C22A—C21A—H21A | 120.7 | C22B—C21B—H21B | 120.7 |
| C17A—C22A—C21A | 121.14 (18) | C21B—C22B—C17B | 120.9 (2) |
| C17A—C22A—H22A | 119.4 | C21B—C22B—H22B | 119.6 |
| C21A—C22A—H22A | 119.4 | C17B—C22B—H22B | 119.6 |
| C11A—N2A—N3A—C13A | −162.30 (17) | C11B—N2B—N3B—C13B | −157.5 (2) |
| C11A—N2A—N3A—C12A | 29.3 (3) | C11B—N2B—N3B—C12B | 32.0 (3) |
| C12A—N4A—N5A—C13A | 0.0 (2) | C12B—N4B—N5B—C13B | 0.0 (3) |
| C8A—N1A—C1A—C2A | −178.94 (19) | C8B—N1B—C1B—C2B | −177.88 (19) |
| C14A—N1A—C1A—C2A | 13.3 (3) | C14B—N1B—C1B—C2B | 18.1 (3) |
| C8A—N1A—C1A—C6A | 0.66 (19) | C8B—N1B—C1B—C6B | 1.4 (2) |
| C14A—N1A—C1A—C6A | −167.09 (15) | C14B—N1B—C1B—C6B | −162.60 (16) |
| N1A—C1A—C2A—C3A | 178.64 (19) | N1B—C1B—C2B—C3B | −179.10 (19) |
| C6A—C1A—C2A—C3A | −0.9 (3) | C6B—C1B—C2B—C3B | 1.7 (3) |
| C1A—C2A—C3A—C4A | 0.6 (3) | C1B—C2B—C3B—C4B | 0.5 (3) |
| C2A—C3A—C4A—C5A | 0.3 (3) | C2B—C3B—C4B—C5B | −2.1 (3) |
| C3A—C4A—C5A—C6A | −0.8 (3) | C3B—C4B—C5B—C6B | 1.5 (3) |
| C4A—C5A—C6A—C1A | 0.4 (3) | C4B—C5B—C6B—C1B | 0.6 (3) |
| C4A—C5A—C6A—C7A | −178.17 (19) | C4B—C5B—C6B—C7B | −179.50 (19) |
| N1A—C1A—C6A—C5A | −179.20 (16) | N1B—C1B—C6B—C5B | 178.37 (16) |
| C2A—C1A—C6A—C5A | 0.4 (3) | C2B—C1B—C6B—C5B | −2.3 (3) |
| N1A—C1A—C6A—C7A | −0.31 (19) | N1B—C1B—C6B—C7B | −1.53 (19) |
| C2A—C1A—C6A—C7A | 179.35 (17) | C2B—C1B—C6B—C7B | 177.81 (17) |
| C5A—C6A—C7A—C8A | 178.54 (19) | C5B—C6B—C7B—C8B | −178.80 (19) |
| C1A—C6A—C7A—C8A | −0.17 (19) | C1B—C6B—C7B—C8B | 1.08 (19) |
| C5A—C6A—C7A—C17A | 0.2 (3) | C5B—C6B—C7B—C17B | 2.4 (3) |
| C1A—C6A—C7A—C17A | −178.53 (15) | C1B—C6B—C7B—C17B | −177.68 (17) |
| C6A—C7A—C8A—N1A | 0.59 (19) | C6B—C7B—C8B—N1B | −0.3 (2) |
| C17A—C7A—C8A—N1A | 178.84 (16) | C17B—C7B—C8B—N1B | 178.53 (16) |
| C6A—C7A—C8A—C9A | −175.47 (16) | C6B—C7B—C8B—C9B | −177.13 (16) |
| C17A—C7A—C8A—C9A | 2.8 (3) | C17B—C7B—C8B—C9B | 1.7 (3) |
| C1A—N1A—C8A—C7A | −0.78 (19) | C1B—N1B—C8B—C7B | −0.7 (2) |
| C14A—N1A—C8A—C7A | 166.68 (16) | C14B—N1B—C8B—C7B | 163.39 (16) |
| C1A—N1A—C8A—C9A | 175.00 (17) | C1B—N1B—C8B—C9B | 176.01 (17) |
| C14A—N1A—C8A—C9A | −17.5 (3) | C14B—N1B—C8B—C9B | −19.9 (3) |
| C7A—C8A—C9A—C10A | 158.93 (19) | C7B—C8B—C9B—C10B | 155.7 (2) |
| N1A—C8A—C9A—C10A | −16.4 (3) | N1B—C8B—C9B—C10B | −20.6 (3) |
| C8A—C9A—C10A—C11A | −173.41 (18) | C8B—C9B—C10B—C11B | −174.33 (19) |
| N3A—N2A—C11A—C10A | −174.54 (15) | N3B—N2B—C11B—C10B | −174.83 (17) |
| C9A—C10A—C11A—N2A | 178.49 (17) | C9B—C10B—C11B—N2B | 179.52 (19) |
| N5A—N4A—C12A—N3A | −0.8 (2) | N5B—N4B—C12B—N3B | −0.6 (2) |
| N5A—N4A—C12A—S1A | 178.96 (15) | N5B—N4B—C12B—S1B | 178.81 (17) |
| C13A—N3A—C12A—N4A | 1.21 (19) | C13B—N3B—C12B—N4B | 1.0 (2) |
| N2A—N3A—C12A—N4A | 170.61 (17) | N2B—N3B—C12B—N4B | 172.32 (19) |
| C13A—N3A—C12A—S1A | −178.51 (16) | C13B—N3B—C12B—S1B | −178.40 (19) |
| N2A—N3A—C12A—S1A | −9.1 (3) | N2B—N3B—C12B—S1B | −7.1 (3) |
| N4A—N5A—C13A—N3A | 0.8 (2) | N4B—N5B—C13B—N3B | 0.7 (3) |
| C12A—N3A—C13A—N5A | −1.4 (2) | C12B—N3B—C13B—N5B | −1.1 (3) |
| N2A—N3A—C13A—N5A | −172.20 (16) | N2B—N3B—C13B—N5B | −173.56 (19) |
| C1A—N1A—C14A—C15A | −75.0 (2) | C1B—N1B—C14B—C15B | −78.5 (2) |
| C8A—N1A—C14A—C15A | 119.51 (19) | C8B—N1B—C14B—C15B | 120.25 (19) |
| C1A—N1A—C14A—C16A | 52.1 (2) | C1B—N1B—C14B—C16B | 48.7 (2) |
| C8A—N1A—C14A—C16A | −113.34 (19) | C8B—N1B—C14B—C16B | −112.61 (19) |
| C8A—C7A—C17A—C22A | −64.4 (3) | C8B—C7B—C17B—C18B | 125.1 (2) |
| C6A—C7A—C17A—C22A | 113.6 (2) | C6B—C7B—C17B—C18B | −56.4 (3) |
| C8A—C7A—C17A—C18A | 119.0 (2) | C8B—C7B—C17B—C22B | −54.0 (3) |
| C6A—C7A—C17A—C18A | −63.0 (2) | C6B—C7B—C17B—C22B | 124.5 (2) |
| C22A—C17A—C18A—C19A | 0.2 (3) | C22B—C17B—C18B—C19B | 2.2 (3) |
| C7A—C17A—C18A—C19A | 176.91 (17) | C7B—C17B—C18B—C19B | −176.87 (18) |
| C17A—C18A—C19A—C20A | −1.1 (3) | C17B—C18B—C19B—C20B | −1.1 (3) |
| C18A—C19A—C20A—C21A | 1.4 (4) | C18B—C19B—C20B—C21B | −0.7 (3) |
| C18A—C19A—C20A—F1A | −177.68 (19) | C18B—C19B—C20B—F1B | 179.67 (19) |
| C19A—C20A—C21A—C22A | −0.5 (4) | F1B—C20B—C21B—C22B | −179.12 (19) |
| F1A—C20A—C21A—C22A | 178.5 (2) | C19B—C20B—C21B—C22B | 1.2 (3) |
| C18A—C17A—C22A—C21A | 0.7 (3) | C20B—C21B—C22B—C17B | 0.0 (3) |
| C7A—C17A—C22A—C21A | −176.0 (2) | C18B—C17B—C22B—C21B | −1.6 (3) |
| C20A—C21A—C22A—C17A | −0.5 (4) | C7B—C17B—C22B—C21B | 177.44 (18) |