9ZP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N2 | C3 | sing | 1.46Å | 1.48Å | |
| N2 | C6 | sing | 1.35Å | 1.35Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C6 | O7 | doub | 1.22Å | 1.23Å | |
| C6 | C8 | sing | 1.48Å | 1.48Å | |
| C8 | C9 | sing | 1.40Å | 1.41Å | Aromatic |
| C8 | C15 | doub | 1.40Å | 1.41Å | Aromatic |
| C9 | C10 | doub | 1.38Å | 1.37Å | Aromatic |
| C10 | O11 | sing | 1.36Å | 1.38Å | |
| C10 | C13 | sing | 1.40Å | 1.40Å | Aromatic |
| O11 | C12 | sing | 1.43Å | 1.43Å | |
| C13 | C14 | doub | 1.39Å | 1.41Å | Aromatic |
| C13 | N16 | sing | 1.39Å | 1.39Å | |
| C14 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| N16 | C18 | sing | 1.39Å | 1.38Å | |
| C18 | N19 | sing | 1.32Å | 1.34Å | Aromatic |
| C18 | N23 | doub | 1.32Å | 1.33Å | Aromatic |
| N19 | C20 | doub | 1.33Å | 1.34Å | Aromatic |
| C20 | C21 | sing | 1.41Å | 1.44Å | Aromatic |
| C20 | N33 | sing | 1.38Å | 1.39Å | |
| C21 | C22 | doub | 1.38Å | 1.36Å | Aromatic |
| C21 | N24 | sing | 1.39Å | 1.41Å | |
| C22 | N23 | sing | 1.33Å | 1.34Å | Aromatic |
| N24 | C25 | sing | 1.37Å | 1.34Å | |
| N24 | C28 | sing | 1.49Å | 1.39Å | |
| C25 | N26 | doub | 1.29Å | 1.31Å | |
| N26 | N27 | sing | 1.40Å | 1.29Å | |
| N27 | C28 | sing | 1.47Å | 1.28Å | |
| C28 | C29 | sing | 1.53Å | 1.53Å | |
| C29 | C31 | sing | 1.53Å | 1.55Å | |
| C29 | N33 | sing | 1.47Å | 1.49Å | |
| C31 | C32 | sing | 1.53Å | 1.55Å | |
| N33 | C34 | sing | 1.47Å | 1.50Å | |
| C34 | C35 | sing | 1.54Å | 1.56Å | |
| C34 | C38 | sing | 1.54Å | 1.54Å | |
| C35 | C36 | sing | 1.54Å | 1.55Å | |
| C36 | C37 | sing | 1.55Å | 1.56Å | |
| C37 | C38 | sing | 1.55Å | 1.54Å | |
| N2 | H2 | sing | 0.97Å | 1.00Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H41C | sing | 1.09Å | 1.10Å | |
| C4 | H42C | sing | 1.09Å | 1.10Å | |
| C5 | H51C | sing | 1.09Å | 1.10Å | |
| C5 | H52C | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C12 | H123 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| N16 | H16 | sing | 0.97Å | 1.00Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| N27 | H27 | sing | 0.97Å | 1.00Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C32 | H323 | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C38 | H381 | sing | 1.09Å | 1.10Å | |
| C38 | H382 | sing | 1.09Å | 1.10Å | |
| C36 | H361 | sing | 1.09Å | 1.10Å | |
| C36 | H362 | sing | 1.09Å | 1.10Å | |
| C37 | H371 | sing | 1.09Å | 1.10Å | |
| C37 | H372 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | N2 | C6 | 119.9° | 120.0° |
| N2 | C3 | C4 | 117.1° | 117.5° |
| N2 | C3 | C5 | 119.0° | 117.5° |
| C3 | N2 | H2 | 120.1° | 120.0° |
| N2 | C3 | H3 | 116.8° | 115.6° |
| N2 | C6 | O7 | 118.9° | 120.0° |
| N2 | C6 | C8 | 120.3° | 120.0° |
| C6 | N2 | H2 | 120.0° | 120.0° |
| C4 | C3 | C5 | 60.1° | 60.0° |
| C3 | C4 | C5 | 60.0° | 60.0° |
| C4 | C3 | H3 | 115.9° | 117.5° |
| C3 | C4 | H41C | 120.0° | 117.5° |
| C3 | C4 | H42C | 120.0° | 117.5° |
| C3 | C5 | C4 | 59.9° | 60.0° |
| C5 | C3 | H3 | 115.9° | 117.5° |
| C3 | C5 | H51C | 120.0° | 117.5° |
| C3 | C5 | H52C | 120.0° | 117.5° |
| C5 | C4 | H41C | 120.0° | 117.5° |
| C5 | C4 | H42C | 120.0° | 117.5° |
| C4 | C5 | H51C | 120.0° | 117.5° |
| C4 | C5 | H52C | 120.0° | 117.5° |
| O7 | C6 | C8 | 117.7° | 120.0° |
| C6 | C8 | C9 | 118.4° | 120.0° |
| C6 | C8 | C15 | 121.6° | 120.0° |
| C9 | C8 | C15 | 119.9° | 119.9° |
| C8 | C9 | C10 | 120.7° | 119.8° |
| C8 | C9 | H9 | 119.7° | 120.1° |
| C8 | C15 | C14 | 119.3° | 120.0° |
| C8 | C15 | H15 | 120.4° | 120.0° |
| C9 | C10 | O11 | 121.0° | 120.0° |
| C9 | C10 | C13 | 119.7° | 120.0° |
| C10 | C9 | H9 | 119.7° | 120.1° |
| O11 | C10 | C13 | 119.3° | 120.0° |
| C10 | O11 | C12 | 118.8° | 117.0° |
| C10 | C13 | C14 | 120.3° | 120.1° |
| C10 | C13 | N16 | 116.5° | 119.9° |
| O11 | C12 | H121 | 109.5° | 109.4° |
| O11 | C12 | H122 | 109.5° | 109.5° |
| O11 | C12 | H123 | 109.4° | 109.5° |
| C14 | C13 | N16 | 122.8° | 119.9° |
| C13 | C14 | C15 | 119.9° | 120.1° |
| C13 | C14 | H14 | 120.0° | 119.9° |
| C13 | N16 | C18 | 126.9° | 120.0° |
| C13 | N16 | H16 | 116.6° | 120.0° |
| C14 | C15 | H15 | 120.4° | 119.9° |
| C15 | C14 | H14 | 120.1° | 120.0° |
| N16 | C18 | N19 | 121.3° | 118.8° |
| N16 | C18 | N23 | 116.2° | 118.8° |
| C18 | N16 | H16 | 116.6° | 120.0° |
| N19 | C18 | N23 | 122.5° | 122.4° |
| C18 | N19 | C20 | 120.5° | 120.8° |
| C18 | N23 | C22 | 120.5° | 120.6° |
| N19 | C20 | C21 | 117.5° | 117.9° |
| N19 | C20 | N33 | 120.7° | 120.0° |
| C21 | C20 | N33 | 121.6° | 122.1° |
| C20 | C21 | C22 | 119.4° | 119.6° |
| C20 | C21 | N24 | 118.7° | 117.5° |
| C20 | N33 | C29 | 120.9° | 115.5° |
| C20 | N33 | C34 | 118.3° | 111.0° |
| C22 | C21 | N24 | 121.9° | 122.9° |
| C21 | C22 | N23 | 119.4° | 118.8° |
| C21 | C22 | H22 | 120.3° | 120.6° |
| C21 | N24 | C25 | 132.9° | 132.8° |
| C21 | N24 | C28 | 120.6° | 120.5° |
| N23 | C22 | H22 | 120.3° | 120.6° |
| C25 | N24 | C28 | 106.3° | 106.7° |
| N24 | C25 | N26 | 107.1° | 111.3° |
| N24 | C25 | H25 | 126.5° | 124.3° |
| N24 | C28 | N27 | 106.4° | 102.6° |
| N24 | C28 | C29 | 122.5° | 105.3° |
| N24 | C28 | H28 | 91.1° | 112.1° |
| C25 | N26 | N27 | 110.0° | 111.5° |
| N26 | C25 | H25 | 126.4° | 124.3° |
| N26 | N27 | C28 | 110.1° | 105.8° |
| N26 | N27 | H27 | 109.3° | 127.1° |
| N27 | C28 | C29 | 131.0° | 112.3° |
| N27 | C28 | H28 | 91.1° | 111.9° |
| C28 | N27 | H27 | 109.3° | 127.1° |
| C28 | C29 | C31 | 109.8° | 109.5° |
| C28 | C29 | N33 | 110.4° | 109.2° |
| C29 | C28 | H28 | 91.0° | 112.2° |
| C28 | C29 | H29 | 108.1° | 109.5° |
| C31 | C29 | N33 | 111.8° | 109.5° |
| C29 | C31 | C32 | 111.3° | 109.5° |
| C31 | C29 | H29 | 107.9° | 109.5° |
| C29 | C31 | H311 | 109.0° | 109.4° |
| C29 | C31 | H312 | 109.0° | 109.5° |
| C29 | N33 | C34 | 119.8° | 111.0° |
| N33 | C29 | H29 | 108.7° | 109.6° |
| C32 | C31 | H311 | 109.0° | 109.5° |
| C32 | C31 | H312 | 109.0° | 109.5° |
| C31 | C32 | H321 | 109.5° | 109.5° |
| C31 | C32 | H322 | 109.5° | 109.5° |
| C31 | C32 | H323 | 109.5° | 109.5° |
| N33 | C34 | C35 | 113.5° | 110.0° |
| N33 | C34 | C38 | 112.6° | 110.1° |
| N33 | C34 | H34 | 109.1° | 110.0° |
| C35 | C34 | C38 | 104.6° | 106.6° |
| C34 | C35 | C36 | 103.2° | 106.6° |
| C35 | C34 | H34 | 108.4° | 110.0° |
| C34 | C35 | H351 | 111.0° | 110.1° |
| C34 | C35 | H352 | 111.0° | 110.0° |
| C34 | C38 | C37 | 106.1° | 104.2° |
| C38 | C34 | H34 | 108.5° | 110.0° |
| C34 | C38 | H381 | 110.3° | 110.4° |
| C34 | C38 | H382 | 110.3° | 110.5° |
| C35 | C36 | C37 | 105.1° | 104.2° |
| C36 | C35 | H351 | 111.0° | 110.0° |
| C36 | C35 | H352 | 111.0° | 110.0° |
| C35 | C36 | H361 | 110.6° | 110.4° |
| C35 | C36 | H362 | 110.5° | 110.5° |
| C36 | C37 | C38 | 107.1° | 102.8° |
| C37 | C36 | H361 | 110.5° | 110.6° |
| C37 | C36 | H362 | 110.5° | 110.5° |
| C36 | C37 | H371 | 110.0° | 110.7° |
| C36 | C37 | H372 | 110.1° | 110.7° |
| C37 | C38 | H381 | 110.3° | 110.5° |
| C37 | C38 | H382 | 110.3° | 110.5° |
| C38 | C37 | H371 | 110.1° | 110.7° |
| C38 | C37 | H372 | 110.1° | 110.8° |
| H41C | C4 | H42C | 109.4° | 115.5° |
| H51C | C5 | H52C | 109.5° | 115.6° |
| H121 | C12 | H122 | 109.5° | 109.5° |
| H121 | C12 | H123 | 109.5° | 109.4° |
| H122 | C12 | H123 | 109.5° | 109.5° |
| H311 | C31 | H312 | 109.5° | 109.5° |
| H321 | C32 | H322 | 109.5° | 109.5° |
| H321 | C32 | H323 | 109.5° | 109.5° |
| H322 | C32 | H323 | 109.5° | 109.4° |
| H351 | C35 | H352 | 109.5° | 110.0° |
| H381 | C38 | H382 | 109.5° | 110.5° |
| H361 | C36 | H362 | 109.5° | 110.5° |
| H371 | C37 | H372 | 109.5° | 110.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | N2 | C6 | H2 | 180.0° | 179.7° |
| N2 | C3 | C4 | C5 | 109.5° | 107.4° |
| N2 | C3 | C4 | H3 | 144.2° | 145.1° |
| N2 | C3 | C5 | H3 | 147.4° | 145.0° |
| C3 | N2 | C6 | O7 | 16.0° | 0.0° |
| C3 | N2 | C6 | C8 | 175.9° | 180.0° |
| N2 | C3 | C4 | H41C | 141.0° | 145.0° |
| N2 | C3 | C4 | H42C | 0.0° | 0.0° |
| N2 | C3 | C5 | H51C | 3.1° | 0.0° |
| N2 | C3 | C5 | H52C | 144.2° | 145.0° |
| C6 | N2 | C3 | C4 | 168.9° | 155.0° |
| C6 | N2 | C3 | C5 | 122.0° | 136.4° |
| N2 | C6 | O7 | C8 | 160.4° | 180.0° |
| N2 | C6 | C8 | C9 | 149.3° | 180.0° |
| N2 | C6 | C8 | C15 | 33.7° | 0.2° |
| C6 | N2 | C3 | H3 | 25.1° | 9.3° |
| C4 | C3 | C5 | H3 | 106.3° | 107.5° |
| C3 | C4 | C5 | H41C | 109.5° | 107.5° |
| C3 | C4 | C5 | H42C | 109.5° | 107.5° |
| C4 | C3 | N2 | H2 | 11.1° | 25.3° |
| C3 | C4 | H41C | H42C | 144.7° | 145.7° |
| C4 | C3 | C5 | H51C | 109.4° | 107.5° |
| C4 | C3 | C5 | H52C | 109.4° | 107.5° |
| C5 | C3 | N2 | H2 | 58.0° | 43.3° |
| C3 | C5 | H51C | H52C | 144.8° | 145.7° |
| C5 | C4 | H41C | H42C | 144.7° | 145.7° |
| C4 | C5 | H51C | H52C | 144.7° | 145.7° |
| O7 | C6 | C8 | C9 | 10.8° | 0.0° |
| O7 | C6 | C8 | C15 | 166.2° | 179.7° |
| O7 | C6 | N2 | H2 | 164.0° | 179.7° |
| C6 | C8 | C9 | C15 | 177.1° | 179.8° |
| C6 | C8 | C9 | C10 | 177.6° | 180.0° |
| C6 | C8 | C15 | C14 | 177.1° | 179.7° |
| C8 | C6 | N2 | H2 | 4.1° | 0.3° |
| C6 | C8 | C9 | H9 | 2.4° | 0.0° |
| C6 | C8 | C15 | H15 | 2.9° | 0.1° |
| C8 | C9 | C10 | H9 | 180.0° | 180.0° |
| C8 | C9 | C10 | O11 | 178.9° | 180.0° |
| C8 | C9 | C10 | C13 | 2.3° | 0.0° |
| C9 | C8 | C15 | C14 | 0.1° | 0.5° |
| C9 | C8 | C15 | H15 | 179.9° | 179.7° |
| C15 | C8 | C9 | C10 | 0.5° | 0.2° |
| C8 | C15 | C14 | C13 | 3.2° | 0.6° |
| C8 | C15 | C14 | H15 | 180.0° | 179.8° |
| C15 | C8 | C9 | H9 | 179.5° | 179.8° |
| C8 | C15 | C14 | H14 | 176.8° | 179.7° |
| C9 | C10 | O11 | C13 | 176.6° | 180.0° |
| C9 | C10 | O11 | C12 | 2.2° | 0.0° |
| C9 | C10 | C13 | C14 | 5.7° | 0.0° |
| C9 | C10 | C13 | N16 | 178.0° | 180.0° |
| O11 | C10 | C13 | C14 | 177.7° | 180.0° |
| O11 | C10 | C13 | N16 | 5.3° | 0.0° |
| O11 | C10 | C9 | H9 | 1.1° | 0.0° |
| C10 | O11 | C12 | H121 | 180.0° | 60.1° |
| C10 | O11 | C12 | H122 | 60.0° | 60.0° |
| C10 | O11 | C12 | H123 | 60.0° | 180.0° |
| C13 | C10 | O11 | C12 | 178.7° | 180.0° |
| C10 | C13 | C14 | N16 | 171.9° | 180.0° |
| C10 | C13 | C14 | C15 | 6.1° | 0.3° |
| C10 | C13 | N16 | C18 | 156.6° | 148.9° |
| C13 | C10 | C9 | H9 | 177.7° | 180.0° |
| C10 | C13 | C14 | H14 | 173.9° | 180.0° |
| C10 | C13 | N16 | H16 | 23.4° | 31.1° |
| O11 | C12 | H121 | H122 | 120.0° | 120.0° |
| O11 | C12 | H121 | H123 | 120.0° | 119.9° |
| O11 | C12 | H122 | H123 | 120.0° | 120.0° |
| C13 | C14 | C15 | H14 | 180.0° | 179.7° |
| C14 | C13 | N16 | C18 | 31.2° | 31.1° |
| C13 | C14 | C15 | H15 | 176.8° | 179.6° |
| C14 | C13 | N16 | H16 | 148.8° | 148.9° |
| N16 | C13 | C14 | C15 | 178.0° | 179.7° |
| C13 | N16 | C18 | H16 | 180.0° | 180.0° |
| C13 | N16 | C18 | N19 | 6.5° | 173.9° |
| C13 | N16 | C18 | N23 | 173.4° | 6.4° |
| N16 | C13 | C14 | H14 | 2.0° | 0.0° |
| N16 | C18 | N19 | N23 | 179.9° | 179.7° |
| N16 | C18 | N19 | C20 | 179.4° | 180.0° |
| N16 | C18 | N23 | C22 | 176.8° | 179.3° |
| C18 | N19 | C20 | C21 | 3.3° | 0.6° |
| C18 | N19 | C20 | N33 | 178.8° | 178.5° |
| N19 | C18 | N23 | C22 | 3.3° | 1.0° |
| N19 | C18 | N16 | H16 | 173.5° | 6.2° |
| N23 | C18 | N19 | C20 | 0.5° | 0.2° |
| C18 | N23 | C22 | C21 | 3.8° | 0.7° |
| N23 | C18 | N16 | H16 | 6.6° | 173.6° |
| C18 | N23 | C22 | H22 | 176.2° | 179.6° |
| N19 | C20 | C21 | N33 | 175.4° | 179.1° |
| N19 | C20 | C21 | C22 | 2.7° | 0.9° |
| N19 | C20 | C21 | N24 | 175.6° | 178.3° |
| N19 | C20 | N33 | C29 | 166.5° | 159.5° |
| N19 | C20 | N33 | C34 | 1.9° | 32.0° |
| C20 | C21 | C22 | N24 | 178.2° | 179.1° |
| C20 | C21 | C22 | N23 | 0.9° | 0.2° |
| C20 | C21 | N24 | C25 | 167.3° | 159.0° |
| C20 | C21 | N24 | C28 | 5.8° | 16.7° |
| C21 | C20 | N33 | C29 | 18.2° | 21.4° |
| C21 | C20 | N33 | C34 | 173.4° | 148.9° |
| C20 | C21 | C22 | H22 | 179.1° | 179.5° |
| N33 | C20 | C21 | C22 | 178.1° | 178.2° |
| N33 | C20 | C21 | N24 | 0.2° | 2.6° |
| C20 | N33 | C29 | C28 | 26.9° | 51.1° |
| C20 | N33 | C29 | C31 | 95.6° | 68.8° |
| C20 | N33 | C29 | C34 | 168.2° | 127.5° |
| C20 | N33 | C34 | C35 | 163.6° | 68.6° |
| C20 | N33 | C34 | C38 | 77.8° | 174.2° |
| C20 | N33 | C29 | H29 | 145.4° | 171.1° |
| C20 | N33 | C34 | H34 | 42.7° | 52.8° |
| C21 | C22 | N23 | H22 | 180.0° | 179.7° |
| C22 | C21 | N24 | C25 | 10.9° | 20.2° |
| C22 | C21 | N24 | C28 | 176.0° | 164.2° |
| N24 | C21 | C22 | N23 | 179.1° | 178.9° |
| C21 | N24 | C25 | C28 | 173.8° | 176.1° |
| C21 | N24 | C25 | N26 | 175.7° | 165.5° |
| C21 | N24 | C28 | N27 | 177.5° | 162.4° |
| C21 | N24 | C28 | C29 | 5.8° | 44.7° |
| N24 | C21 | C22 | H22 | 0.9° | 1.4° |
| C21 | N24 | C25 | H25 | 4.3° | 14.5° |
| C21 | N24 | C28 | H28 | 86.0° | 77.5° |
| N24 | C25 | N26 | H25 | 180.0° | 180.0° |
| N24 | C25 | N26 | N27 | 0.3° | 1.9° |
| C25 | N24 | C28 | N27 | 2.7° | 14.3° |
| C25 | N24 | C28 | C29 | 179.4° | 131.9° |
| C25 | N24 | C28 | H28 | 88.8° | 105.9° |
| C28 | N24 | C25 | N26 | 1.8° | 10.6° |
| N24 | C28 | N27 | N26 | 2.6° | 13.0° |
| N24 | C28 | N27 | C29 | 176.3° | 112.5° |
| N24 | C28 | N27 | H28 | 91.5° | 120.3° |
| N24 | C28 | C29 | H28 | 91.9° | 122.2° |
| N24 | C28 | C29 | C31 | 102.5° | 60.2° |
| N24 | C28 | C29 | N33 | 21.2° | 59.7° |
| C28 | N24 | C25 | H25 | 178.1° | 169.4° |
| N24 | C28 | N27 | H27 | 122.7° | 167.0° |
| N24 | C28 | C29 | H29 | 140.0° | 179.7° |
| C25 | N26 | N27 | C28 | 1.5° | 7.6° |
| C25 | N26 | N27 | H27 | 121.6° | 172.4° |
| N26 | N27 | C28 | H27 | 120.1° | 180.0° |
| N26 | N27 | C28 | C29 | 178.9° | 125.5° |
| N27 | N26 | C25 | H25 | 179.7° | 178.1° |
| N26 | N27 | C28 | H28 | 88.8° | 107.3° |
| N27 | C28 | C29 | H28 | 92.3° | 127.0° |
| N27 | C28 | C29 | C31 | 73.3° | 50.6° |
| N27 | C28 | C29 | N33 | 163.0° | 170.5° |
| N27 | C28 | C29 | H29 | 44.2° | 69.5° |
| C28 | C29 | C31 | N33 | 122.9° | 119.7° |
| C28 | C29 | C31 | H29 | 117.6° | 120.1° |
| C28 | C29 | N33 | H29 | 118.5° | 119.9° |
| C28 | C29 | C31 | C32 | 61.2° | 66.0° |
| C28 | C29 | N33 | C34 | 164.9° | 178.6° |
| C29 | C28 | N27 | H27 | 61.0° | 54.5° |
| C28 | C29 | C31 | H311 | 178.5° | 54.0° |
| C28 | C29 | C31 | H312 | 59.1° | 174.0° |
| C31 | C29 | N33 | H29 | 119.0° | 120.2° |
| C29 | C31 | C32 | H311 | 120.3° | 120.0° |
| C29 | C31 | C32 | H312 | 120.3° | 120.0° |
| C31 | C29 | N33 | C34 | 72.6° | 58.7° |
| C31 | C29 | C28 | H28 | 165.6° | 177.6° |
| C29 | C31 | H311 | H312 | 119.2° | 120.0° |
| C29 | C31 | C32 | H321 | 180.0° | 48.5° |
| C29 | C31 | C32 | H322 | 60.0° | 71.5° |
| C29 | C31 | C32 | H323 | 60.0° | 168.5° |
| N33 | C29 | C31 | C32 | 61.7° | 174.3° |
| C29 | N33 | C34 | C35 | 27.9° | 161.5° |
| C29 | N33 | C34 | C38 | 90.7° | 44.4° |
| N33 | C29 | C28 | H28 | 70.7° | 62.5° |
| N33 | C29 | C31 | H311 | 58.6° | 65.7° |
| N33 | C29 | C31 | H312 | 178.0° | 54.3° |
| C29 | N33 | C34 | H34 | 148.8° | 77.1° |
| C32 | C31 | C29 | H29 | 178.8° | 54.1° |
| C32 | C31 | H311 | H312 | 119.2° | 120.0° |
| C31 | C32 | H321 | H322 | 120.0° | 120.0° |
| C31 | C32 | H321 | H323 | 120.0° | 120.0° |
| C31 | C32 | H322 | H323 | 120.0° | 120.0° |
| N33 | C34 | C35 | C38 | 123.1° | 119.3° |
| N33 | C34 | C35 | H34 | 121.3° | 121.4° |
| N33 | C34 | C38 | H34 | 120.8° | 121.4° |
| N33 | C34 | C35 | C36 | 160.4° | 119.3° |
| N33 | C34 | C38 | C37 | 150.7° | 142.9° |
| C34 | N33 | C29 | H29 | 46.4° | 61.5° |
| N33 | C34 | C35 | H351 | 80.6° | 121.4° |
| N33 | C34 | C35 | H352 | 41.4° | 0.0° |
| N33 | C34 | C38 | H381 | 31.2° | 24.2° |
| N33 | C34 | C38 | H382 | 89.8° | 98.4° |
| C35 | C34 | C38 | H34 | 115.5° | 119.3° |
| C34 | C35 | C36 | H351 | 119.0° | 119.3° |
| C34 | C35 | C36 | H352 | 119.0° | 119.3° |
| C34 | C35 | C36 | C37 | 33.3° | 23.6° |
| C35 | C34 | C38 | C37 | 27.0° | 23.6° |
| C34 | C35 | H351 | H352 | 122.9° | 121.4° |
| C35 | C34 | C38 | H381 | 92.5° | 95.0° |
| C35 | C34 | C38 | H382 | 146.5° | 142.3° |
| C34 | C35 | C36 | H361 | 86.1° | 142.3° |
| C34 | C35 | C36 | H362 | 152.6° | 95.1° |
| C38 | C34 | C35 | C36 | 37.3° | 0.0° |
| C34 | C38 | C37 | C36 | 6.3° | 37.9° |
| C34 | C38 | C37 | H381 | 119.5° | 118.6° |
| C34 | C38 | C37 | H382 | 119.5° | 118.7° |
| C38 | C34 | C35 | H351 | 156.3° | 119.3° |
| C38 | C34 | C35 | H352 | 81.7° | 119.3° |
| C34 | C38 | H381 | H382 | 121.5° | 122.6° |
| C34 | C38 | C37 | H371 | 113.3° | 80.4° |
| C34 | C38 | C37 | H372 | 125.9° | 156.2° |
| C35 | C36 | C37 | H361 | 119.3° | 118.7° |
| C35 | C36 | C37 | H362 | 119.3° | 118.6° |
| C35 | C36 | C37 | C38 | 17.0° | 37.9° |
| C36 | C35 | C34 | H34 | 78.3° | 119.3° |
| C36 | C35 | H351 | H352 | 123.0° | 121.4° |
| C35 | C36 | H361 | H362 | 122.0° | 122.6° |
| C35 | C36 | C37 | H371 | 136.6° | 80.4° |
| C35 | C36 | C37 | H372 | 102.7° | 156.3° |
| C36 | C37 | C38 | H371 | 119.6° | 118.3° |
| C36 | C37 | C38 | H372 | 119.6° | 118.3° |
| C37 | C36 | C35 | H351 | 152.2° | 95.7° |
| C37 | C36 | C35 | H352 | 85.7° | 142.9° |
| C36 | C37 | C38 | H381 | 113.2° | 80.7° |
| C36 | C37 | C38 | H382 | 125.7° | 156.6° |
| C37 | C36 | H361 | H362 | 122.0° | 122.7° |
| C36 | C37 | H371 | H372 | 121.1° | 123.3° |
| C37 | C38 | C34 | H34 | 88.5° | 95.7° |
| C37 | C38 | H381 | H382 | 121.6° | 122.7° |
| C38 | C37 | C36 | H361 | 102.4° | 156.6° |
| C38 | C37 | C36 | H362 | 136.3° | 80.7° |
| C38 | C37 | H371 | H372 | 121.1° | 123.3° |
| H2 | N2 | C3 | H3 | 154.9° | 171.0° |
| H3 | C3 | C4 | H41C | 3.2° | 0.0° |
| H3 | C3 | C4 | H42C | 144.2° | 145.0° |
| H3 | C3 | C5 | H51C | 144.3° | 145.0° |
| H3 | C3 | C5 | H52C | 3.2° | 0.0° |
| H41C | C4 | C5 | H51C | 141.0° | 145.0° |
| H41C | C4 | C5 | H52C | 0.0° | 0.0° |
| H42C | C4 | C5 | H51C | 0.0° | 0.0° |
| H42C | C4 | C5 | H52C | 141.0° | 145.0° |
| H15 | C15 | C14 | H14 | 3.2° | 0.0° |
| H121 | C12 | H122 | H123 | 120.0° | 120.0° |
| H28 | C28 | N27 | H27 | 31.3° | 72.7° |
| H28 | C28 | C29 | H29 | 48.2° | 57.5° |
| H29 | C29 | C31 | H311 | 60.9° | 174.1° |
| H29 | C29 | C31 | H312 | 58.5° | 65.9° |
| H311 | C31 | C32 | H321 | 59.7° | 168.4° |
| H311 | C31 | C32 | H322 | 179.7° | 48.4° |
| H311 | C31 | C32 | H323 | 60.3° | 71.5° |
| H312 | C31 | C32 | H321 | 59.7° | 71.5° |
| H312 | C31 | C32 | H322 | 60.3° | 168.5° |
| H312 | C31 | C32 | H323 | 179.7° | 48.5° |
| H321 | C32 | H322 | H323 | 120.0° | 120.0° |
| H34 | C34 | C35 | H351 | 40.7° | 0.0° |
| H34 | C34 | C35 | H352 | 162.7° | 121.4° |
| H34 | C34 | C38 | H381 | 152.0° | 145.7° |
| H34 | C34 | C38 | H382 | 31.0° | 23.0° |
| H351 | C35 | C36 | H361 | 32.9° | 23.0° |
| H351 | C35 | C36 | H362 | 88.5° | 145.6° |
| H352 | C35 | C36 | H361 | 155.0° | 98.4° |
| H352 | C35 | C36 | H362 | 33.6° | 24.2° |
| H381 | C38 | C37 | H371 | 127.2° | 161.0° |
| H381 | C38 | C37 | H372 | 6.4° | 37.6° |
| H382 | C38 | C37 | H371 | 6.1° | 38.3° |
| H382 | C38 | C37 | H372 | 114.6° | 85.1° |
| H361 | C36 | C37 | H371 | 17.3° | 38.3° |
| H361 | C36 | C37 | H372 | 138.0° | 85.1° |
| H362 | C36 | C37 | H371 | 104.1° | 161.0° |
| H362 | C36 | C37 | H372 | 16.6° | 37.6° |
