| C2—N1 | 1.342 (3) | C23—C24 | 1.404 (5) |
| C2—N3 | 1.349 (3) | C23—H23 | 0.9300 |
| C2—C3 | 1.411 (3) | C24—C25 | 1.365 (6) |
| C3—C4 | 1.401 (3) | C24—H24 | 0.9300 |
| C3—C31 | 1.420 (3) | C25—C26 | 1.341 (6) |
| C4—C5 | 1.390 (3) | C25—H25 | 0.9300 |
| C4—C41 | 1.478 (3) | C26—C27 | 1.368 (4) |
| C5—C6 | 1.380 (3) | C26—H26 | 0.9300 |
| C5—C9 | 1.501 (3) | C27—H27 | 0.9300 |
| C6—N1 | 1.330 (3) | C31—N2 | 1.140 (3) |
| C6—C7 | 1.499 (3) | C41—C46 | 1.382 (3) |
| C7—C8 | 1.496 (4) | C41—C42 | 1.386 (3) |
| C7—H7A | 0.9700 | C42—C43 | 1.371 (4) |
| C7—H7B | 0.9700 | C42—H42 | 0.9300 |
| C8—C9 | 1.531 (4) | C43—C44 | 1.384 (4) |
| C8—H8A | 0.9700 | C43—H43 | 0.9300 |
| C8—H8B | 0.9700 | C44—C45 | 1.376 (3) |
| C9—H9A | 0.9700 | C44—C47 | 1.497 (4) |
| C9—H9B | 0.9700 | C45—C46 | 1.382 (3) |
| C21—N3 | 1.437 (3) | C45—H45 | 0.9300 |
| C21—C22 | 1.494 (3) | C46—H46 | 0.9300 |
| C21—H21A | 0.9700 | C47—H47A | 0.9600 |
| C21—H21B | 0.9700 | C47—H47B | 0.9600 |
| C22—C23 | 1.363 (4) | C47—H47C | 0.9600 |
| C22—C27 | 1.374 (4) | N3—H3 | 0.8600 |
| N1—C2—N3 | 118.24 (19) | C22—C23—H23 | 119.9 |
| N1—C2—C3 | 121.54 (18) | C24—C23—H23 | 119.9 |
| N3—C2—C3 | 120.22 (18) | C25—C24—C23 | 119.3 (3) |
| C4—C3—C2 | 121.10 (19) | C25—C24—H24 | 120.3 |
| C4—C3—C31 | 121.52 (19) | C23—C24—H24 | 120.3 |
| C2—C3—C31 | 117.30 (18) | C26—C25—C24 | 120.7 (4) |
| C5—C4—C3 | 116.08 (19) | C26—C25—H25 | 119.7 |
| C5—C4—C41 | 123.40 (19) | C24—C25—H25 | 119.7 |
| C3—C4—C41 | 120.50 (18) | C25—C26—C27 | 119.7 (4) |
| C6—C5—C4 | 118.73 (19) | C25—C26—H26 | 120.2 |
| C6—C5—C9 | 110.2 (2) | C27—C26—H26 | 120.2 |
| C4—C5—C9 | 131.1 (2) | C26—C27—C22 | 122.0 (3) |
| N1—C6—C5 | 126.2 (2) | C26—C27—H27 | 119.0 |
| N1—C6—C7 | 122.5 (2) | C22—C27—H27 | 119.0 |
| C5—C6—C7 | 111.3 (2) | N2—C31—C3 | 174.7 (2) |
| C8—C7—C6 | 103.1 (2) | C46—C41—C42 | 117.6 (2) |
| C8—C7—H7A | 111.1 | C46—C41—C4 | 121.51 (19) |
| C6—C7—H7A | 111.1 | C42—C41—C4 | 120.9 (2) |
| C8—C7—H7B | 111.1 | C43—C42—C41 | 121.3 (2) |
| C6—C7—H7B | 111.1 | C43—C42—H42 | 119.4 |
| H7A—C7—H7B | 109.1 | C41—C42—H42 | 119.4 |
| C7—C8—C9 | 107.4 (2) | C42—C43—C44 | 121.4 (2) |
| C7—C8—H8A | 110.2 | C42—C43—H43 | 119.3 |
| C9—C8—H8A | 110.2 | C44—C43—H43 | 119.3 |
| C7—C8—H8B | 110.2 | C45—C44—C43 | 117.4 (2) |
| C9—C8—H8B | 110.2 | C45—C44—C47 | 121.1 (3) |
| H8A—C8—H8B | 108.5 | C43—C44—C47 | 121.5 (2) |
| C5—C9—C8 | 102.8 (2) | C44—C45—C46 | 121.6 (2) |
| C5—C9—H9A | 111.2 | C44—C45—H45 | 119.2 |
| C8—C9—H9A | 111.2 | C46—C45—H45 | 119.2 |
| C5—C9—H9B | 111.2 | C41—C46—C45 | 120.8 (2) |
| C8—C9—H9B | 111.2 | C41—C46—H46 | 119.6 |
| H9A—C9—H9B | 109.1 | C45—C46—H46 | 119.6 |
| N3—C21—C22 | 113.74 (19) | C44—C47—H47A | 109.5 |
| N3—C21—H21A | 108.8 | C44—C47—H47B | 109.5 |
| C22—C21—H21A | 108.8 | H47A—C47—H47B | 109.5 |
| N3—C21—H21B | 108.8 | C44—C47—H47C | 109.5 |
| C22—C21—H21B | 108.8 | H47A—C47—H47C | 109.5 |
| H21A—C21—H21B | 107.7 | H47B—C47—H47C | 109.5 |
| C23—C22—C27 | 117.9 (3) | C6—N1—C2 | 116.30 (19) |
| C23—C22—C21 | 121.4 (3) | C2—N3—C21 | 125.59 (19) |
| C27—C22—C21 | 120.7 (2) | C2—N3—H3 | 117.2 |
| C22—C23—C24 | 120.3 (3) | C21—N3—H3 | 117.2 |
| N1—C2—C3—C4 | 1.9 (3) | C23—C24—C25—C26 | 1.6 (6) |
| N3—C2—C3—C4 | −178.91 (19) | C24—C25—C26—C27 | −2.2 (6) |
| N1—C2—C3—C31 | −174.95 (19) | C25—C26—C27—C22 | 0.6 (6) |
| N3—C2—C3—C31 | 4.2 (3) | C23—C22—C27—C26 | 1.6 (4) |
| C2—C3—C4—C5 | −0.8 (3) | C21—C22—C27—C26 | −176.9 (3) |
| C31—C3—C4—C5 | 175.9 (2) | C5—C4—C41—C46 | 134.4 (2) |
| C2—C3—C4—C41 | −179.58 (18) | C3—C4—C41—C46 | −46.9 (3) |
| C31—C3—C4—C41 | −2.9 (3) | C5—C4—C41—C42 | −47.7 (3) |
| C3—C4—C5—C6 | 0.1 (3) | C3—C4—C41—C42 | 131.0 (2) |
| C41—C4—C5—C6 | 178.90 (19) | C46—C41—C42—C43 | 1.5 (3) |
| C3—C4—C5—C9 | −179.6 (2) | C4—C41—C42—C43 | −176.5 (2) |
| C41—C4—C5—C9 | −0.9 (4) | C41—C42—C43—C44 | −1.7 (4) |
| C4—C5—C6—N1 | −0.6 (3) | C42—C43—C44—C45 | 0.8 (4) |
| C9—C5—C6—N1 | 179.2 (2) | C42—C43—C44—C47 | 179.8 (3) |
| C4—C5—C6—C7 | −179.6 (2) | C43—C44—C45—C46 | 0.4 (4) |
| C9—C5—C6—C7 | 0.2 (3) | C47—C44—C45—C46 | −178.7 (2) |
| N1—C6—C7—C8 | 166.9 (2) | C42—C41—C46—C45 | −0.4 (3) |
| C5—C6—C7—C8 | −14.1 (3) | C4—C41—C46—C45 | 177.59 (19) |
| C6—C7—C8—C9 | 22.1 (3) | C44—C45—C46—C41 | −0.6 (4) |
| C6—C5—C9—C8 | 13.4 (3) | C5—C6—N1—C2 | 1.6 (3) |
| C4—C5—C9—C8 | −166.8 (2) | C7—C6—N1—C2 | −179.4 (2) |
| C7—C8—C9—C5 | −22.0 (3) | N3—C2—N1—C6 | 178.59 (19) |
| N3—C21—C22—C23 | 134.3 (2) | C3—C2—N1—C6 | −2.2 (3) |
| N3—C21—C22—C27 | −47.2 (3) | N1—C2—N3—C21 | 2.6 (3) |
| C27—C22—C23—C24 | −2.2 (4) | C3—C2—N3—C21 | −176.6 (2) |
| C21—C22—C23—C24 | 176.3 (3) | C22—C21—N3—C2 | 101.2 (3) |
| C22—C23—C24—C25 | 0.7 (5) |