| N1—C6 | 1.484 (5) | O24—C27 | 1.419 (5) |
| N1—C2 | 1.484 (4) | C27—H27A | 0.9600 |
| N1—H11 | 0.86 (3) | C27—H27B | 0.9600 |
| N1—H12 | 0.98 (3) | C27—H27C | 0.9600 |
| C2—C3 | 1.512 (4) | C31—O32 | 1.247 (5) |
| C2—H2A | 0.9700 | C31—O31 | 1.270 (7) |
| C2—H2B | 0.9700 | C31—C32 | 1.513 (6) |
| C3—N4 | 1.459 (4) | C32—C33 | 1.517 (7) |
| C3—H3A | 0.9700 | C32—H32A | 0.9700 |
| C3—H3B | 0.9700 | C32—H32B | 0.9700 |
| N4—C21 | 1.429 (3) | C33—C34 | 1.505 (6) |
| N4—C5 | 1.469 (3) | C33—H33A | 0.9700 |
| C5—C6 | 1.508 (4) | C33—H33B | 0.9700 |
| C5—H5A | 0.9700 | C34—O33 | 1.233 (9) |
| C5—H5B | 0.9700 | C34—O34 | 1.280 (6) |
| C6—H6A | 0.9700 | O34—H34 | 0.8200 |
| C6—H6B | 0.9700 | C41—O42 | 1.247 (9) |
| C21—C26 | 1.390 (4) | C41—O41 | 1.271 (10) |
| C21—C22 | 1.396 (4) | C41—C42 | 1.514 (9) |
| C22—C23 | 1.388 (4) | C42—C43 | 1.507 (11) |
| C22—H22 | 0.9300 | C42—H42A | 0.9700 |
| C23—C24 | 1.378 (5) | C42—H42B | 0.9700 |
| C23—H23 | 0.9300 | C43—C44 | 1.508 (10) |
| C24—C25 | 1.371 (4) | C43—H43A | 0.9700 |
| C24—O24 | 1.376 (3) | C43—H43B | 0.9700 |
| C25—C26 | 1.390 (4) | C44—O43 | 1.235 (13) |
| C25—H25 | 0.9300 | C44—O44 | 1.282 (9) |
| C26—H26 | 0.9300 | O44—H44 | 0.8200 |
| C6—N1—C2 | 109.6 (2) | C21—C26—C25 | 122.0 (3) |
| C6—N1—H11 | 114 (3) | C21—C26—H26 | 119.0 |
| C2—N1—H11 | 110 (2) | C25—C26—H26 | 119.0 |
| C6—N1—H12 | 106 (2) | C24—O24—C27 | 117.0 (3) |
| C2—N1—H12 | 114 (2) | O24—C27—H27A | 109.5 |
| H11—N1—H12 | 103 (3) | O24—C27—H27B | 109.5 |
| N1—C2—C3 | 110.2 (2) | H27A—C27—H27B | 109.5 |
| N1—C2—H2A | 109.6 | O24—C27—H27C | 109.5 |
| C3—C2—H2A | 109.6 | H27A—C27—H27C | 109.5 |
| N1—C2—H2B | 109.6 | H27B—C27—H27C | 109.5 |
| C3—C2—H2B | 109.6 | O32—C31—O31 | 123.7 (8) |
| H2A—C2—H2B | 108.1 | O32—C31—C32 | 120.0 (6) |
| N4—C3—C2 | 112.4 (3) | O31—C31—C32 | 116.3 (6) |
| N4—C3—H3A | 109.1 | C31—C32—C33 | 114.8 (6) |
| C2—C3—H3A | 109.1 | C31—C32—H32A | 108.6 |
| N4—C3—H3B | 109.1 | C33—C32—H32A | 108.6 |
| C2—C3—H3B | 109.1 | C31—C32—H32B | 108.6 |
| H3A—C3—H3B | 107.9 | C33—C32—H32B | 108.6 |
| C21—N4—C3 | 115.3 (2) | H32A—C32—H32B | 107.5 |
| C21—N4—C5 | 114.3 (2) | C34—C33—C32 | 113.3 (6) |
| C3—N4—C5 | 110.7 (2) | C34—C33—H33A | 108.9 |
| N4—C5—C6 | 112.1 (2) | C32—C33—H33A | 108.9 |
| N4—C5—H5A | 109.2 | C34—C33—H33B | 108.9 |
| C6—C5—H5A | 109.2 | C32—C33—H33B | 108.9 |
| N4—C5—H5B | 109.2 | H33A—C33—H33B | 107.7 |
| C6—C5—H5B | 109.2 | O33—C34—O34 | 122.3 (7) |
| H5A—C5—H5B | 107.9 | O33—C34—C33 | 122.8 (7) |
| N1—C6—C5 | 109.8 (3) | O34—C34—C33 | 114.7 (6) |
| N1—C6—H6A | 109.7 | C34—O34—H34 | 109.5 |
| C5—C6—H6A | 109.7 | O42—C41—O41 | 124.3 (15) |
| N1—C6—H6B | 109.7 | O42—C41—C42 | 119.7 (12) |
| C5—C6—H6B | 109.7 | O41—C41—C42 | 115.3 (12) |
| H6A—C6—H6B | 108.2 | C43—C42—C41 | 116.0 (12) |
| C26—C21—C22 | 116.7 (2) | C43—C42—H42A | 108.3 |
| C26—C21—N4 | 120.9 (3) | C41—C42—H42A | 108.3 |
| C22—C21—N4 | 122.3 (3) | C43—C42—H42B | 108.3 |
| C23—C22—C21 | 121.2 (3) | C41—C42—H42B | 108.3 |
| C23—C22—H22 | 119.4 | H42A—C42—H42B | 107.4 |
| C21—C22—H22 | 119.4 | C42—C43—C44 | 113.1 (15) |
| C24—C23—C22 | 120.8 (3) | C42—C43—H43A | 109.0 |
| C24—C23—H23 | 119.6 | C44—C43—H43A | 109.0 |
| C22—C23—H23 | 119.6 | C42—C43—H43B | 109.0 |
| C25—C24—O24 | 124.8 (3) | C44—C43—H43B | 109.0 |
| C25—C24—C23 | 119.1 (3) | H43A—C43—H43B | 107.8 |
| O24—C24—C23 | 116.0 (3) | O43—C44—O44 | 120.3 (16) |
| C24—C25—C26 | 120.2 (3) | O43—C44—C43 | 123.7 (14) |
| C24—C25—H25 | 119.9 | O44—C44—C43 | 114.8 (12) |
| C26—C25—H25 | 119.9 | C44—O44—H44 | 109.5 |
| C6—N1—C2—C3 | −57.9 (3) | O24—C24—C25—C26 | 179.3 (3) |
| N1—C2—C3—N4 | 56.2 (3) | C23—C24—C25—C26 | −1.5 (5) |
| C2—C3—N4—C21 | 174.2 (2) | C22—C21—C26—C25 | 1.0 (4) |
| C2—C3—N4—C5 | −54.0 (3) | N4—C21—C26—C25 | 179.3 (3) |
| C21—N4—C5—C6 | −172.9 (3) | C24—C25—C26—C21 | 0.4 (5) |
| C3—N4—C5—C6 | 54.8 (3) | C25—C24—O24—C27 | −3.1 (5) |
| C2—N1—C6—C5 | 58.5 (3) | C23—C24—O24—C27 | 177.7 (3) |
| N4—C5—C6—N1 | −57.4 (3) | O32—C31—C32—C33 | 32 (2) |
| C3—N4—C21—C26 | 161.9 (3) | O31—C31—C32—C33 | −146 (2) |
| C5—N4—C21—C26 | 31.8 (4) | C31—C32—C33—C34 | −178.3 (12) |
| C3—N4—C21—C22 | −19.9 (4) | C32—C33—C34—O33 | −162 (2) |
| C5—N4—C21—C22 | −150.0 (3) | C32—C33—C34—O34 | 23 (2) |
| C26—C21—C22—C23 | −1.3 (4) | O42—C41—C42—C43 | −13 (5) |
| N4—C21—C22—C23 | −179.6 (3) | O41—C41—C42—C43 | 157 (4) |
| C21—C22—C23—C24 | 0.2 (5) | C41—C42—C43—C44 | −178 (2) |
| C22—C23—C24—C25 | 1.2 (5) | C42—C43—C44—O43 | −86 (4) |
| C22—C23—C24—O24 | −179.5 (3) | C42—C43—C44—O44 | 82 (4) |