3EA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C13 | H133 | sing | 1.09Å | 1.10Å | |
| C12 | C11 | sing | 1.53Å | 1.53Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C11 | C10 | sing | 1.51Å | 1.53Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C10 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | O4 | sing | 1.35Å | 1.37Å | Aromatic |
| C5 | C6 | sing | 1.41Å | 1.39Å | Aromatic |
| O4 | N3 | sing | 1.41Å | 1.41Å | Aromatic |
| N3 | C2 | doub | 1.30Å | 1.33Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.53Å | |
| C2 | C6 | sing | 1.46Å | 1.39Å | Aromatic |
| C1 | F34 | sing | 1.40Å | 1.33Å | |
| C1 | F33 | sing | 1.40Å | 1.33Å | |
| C1 | F32 | sing | 1.40Å | 1.33Å | |
| C6 | C7 | doub | 1.40Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.37Å | 1.39Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C9 | O14 | sing | 1.36Å | 1.36Å | |
| O14 | C15 | sing | 1.43Å | 1.44Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | O18 | sing | 1.43Å | 1.43Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| O18 | C19 | sing | 1.36Å | 1.36Å | |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | C24 | sing | 1.39Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.40Å | 1.40Å | Aromatic |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C24 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C23 | C22 | sing | 1.39Å | 1.40Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C22 | C21 | doub | 1.41Å | 1.40Å | Aromatic |
| C22 | N27 | sing | 1.38Å | 1.33Å | Aromatic |
| C21 | C25 | sing | 1.46Å | 1.33Å | Aromatic |
| C25 | C26 | doub | 1.34Å | 1.33Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | N27 | sing | 1.37Å | 1.33Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| N27 | C28 | sing | 1.47Å | 1.47Å | |
| C28 | C29 | sing | 1.51Å | 1.53Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C29 | O31 | sing | 1.34Å | 1.25Å | |
| C29 | O30 | doub | 1.21Å | 1.25Å | |
| O31 | H31 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | C13 | H131 | 109.4° | 109.5° |
| C12 | C13 | H132 | 109.5° | 109.5° |
| C12 | C13 | H133 | 109.5° | 109.4° |
| C13 | C12 | C11 | 110.7° | 109.5° |
| C13 | C12 | H121 | 108.8° | 109.5° |
| C13 | C12 | H122 | 109.1° | 109.5° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| H131 | C13 | H133 | 109.5° | 109.5° |
| H132 | C13 | H133 | 109.4° | 109.4° |
| C11 | C12 | H121 | 108.8° | 109.4° |
| C11 | C12 | H122 | 109.1° | 109.4° |
| C12 | C11 | C10 | 111.0° | 109.5° |
| C12 | C11 | H111 | 108.6° | 109.4° |
| C12 | C11 | H112 | 109.0° | 109.5° |
| H121 | C12 | H122 | 110.4° | 109.5° |
| C10 | C11 | H111 | 108.6° | 109.5° |
| C10 | C11 | H112 | 109.0° | 109.5° |
| C11 | C10 | C5 | 119.3° | 120.1° |
| C11 | C10 | C9 | 122.2° | 120.1° |
| H111 | C11 | H112 | 110.7° | 109.4° |
| C5 | C10 | C9 | 118.5° | 119.8° |
| C10 | C5 | O4 | 130.6° | 133.4° |
| C10 | C5 | C6 | 121.7° | 119.5° |
| C10 | C9 | C8 | 120.3° | 120.5° |
| C10 | C9 | O14 | 117.3° | 119.8° |
| O4 | C5 | C6 | 107.7° | 107.1° |
| C5 | O4 | N3 | 108.0° | 109.3° |
| C5 | C6 | C2 | 106.9° | 106.4° |
| C5 | C6 | C7 | 119.5° | 119.9° |
| O4 | N3 | C2 | 107.6° | 109.7° |
| N3 | C2 | C1 | 123.4° | 126.3° |
| N3 | C2 | C6 | 109.7° | 107.4° |
| C1 | C2 | C6 | 126.8° | 126.3° |
| C2 | C1 | F34 | 108.6° | 109.5° |
| C2 | C1 | F33 | 111.7° | 109.4° |
| C2 | C1 | F32 | 110.8° | 109.5° |
| C2 | C6 | C7 | 133.6° | 133.7° |
| F34 | C1 | F33 | 110.8° | 109.5° |
| F34 | C1 | F32 | 107.7° | 109.5° |
| F33 | C1 | F32 | 107.2° | 109.5° |
| C6 | C7 | C8 | 119.3° | 119.9° |
| C6 | C7 | H7 | 120.3° | 120.0° |
| C8 | C7 | H7 | 120.3° | 120.1° |
| C7 | C8 | C9 | 120.7° | 120.4° |
| C7 | C8 | H8 | 119.7° | 119.8° |
| C9 | C8 | H8 | 119.6° | 119.8° |
| C8 | C9 | O14 | 122.1° | 119.7° |
| C9 | O14 | C15 | 116.1° | 106.8° |
| O14 | C15 | C16 | 107.1° | 109.5° |
| O14 | C15 | H151 | 110.8° | 109.5° |
| O14 | C15 | H152 | 110.3° | 109.5° |
| C16 | C15 | H151 | 110.8° | 109.5° |
| C16 | C15 | H152 | 110.3° | 109.5° |
| C15 | C16 | C17 | 105.7° | 109.5° |
| C15 | C16 | H161 | 111.6° | 109.5° |
| C15 | C16 | H162 | 110.8° | 109.5° |
| H151 | C15 | H152 | 107.6° | 109.5° |
| C17 | C16 | H161 | 111.6° | 109.4° |
| C17 | C16 | H162 | 110.7° | 109.5° |
| C16 | C17 | O18 | 109.0° | 109.5° |
| C16 | C17 | H171 | 109.7° | 109.5° |
| C16 | C17 | H172 | 109.7° | 109.5° |
| H161 | C16 | H162 | 106.6° | 109.5° |
| O18 | C17 | H171 | 109.8° | 109.5° |
| O18 | C17 | H172 | 109.6° | 109.5° |
| C17 | O18 | C19 | 108.7° | 106.8° |
| H171 | C17 | H172 | 109.1° | 109.4° |
| O18 | C19 | C20 | 118.9° | 119.9° |
| O18 | C19 | C24 | 120.3° | 119.8° |
| C20 | C19 | C24 | 120.8° | 120.3° |
| C19 | C20 | C21 | 119.7° | 119.6° |
| C19 | C20 | H20 | 120.1° | 120.2° |
| C19 | C24 | C23 | 119.7° | 120.6° |
| C19 | C24 | H24 | 120.2° | 119.7° |
| C21 | C20 | H20 | 120.1° | 120.2° |
| C20 | C21 | C22 | 119.6° | 119.9° |
| C20 | C21 | C25 | 132.4° | 134.0° |
| C23 | C24 | H24 | 120.1° | 119.7° |
| C24 | C23 | C22 | 119.6° | 120.0° |
| C24 | C23 | H23 | 120.2° | 120.0° |
| C22 | C23 | H23 | 120.2° | 120.0° |
| C23 | C22 | C21 | 120.6° | 119.5° |
| C23 | C22 | N27 | 134.0° | 133.4° |
| C21 | C22 | N27 | 105.4° | 107.1° |
| C22 | C21 | C25 | 107.9° | 106.1° |
| C22 | N27 | C26 | 110.1° | 109.9° |
| C22 | N27 | C28 | 125.4° | 125.0° |
| C21 | C25 | C26 | 108.6° | 107.0° |
| C21 | C25 | H25 | 125.7° | 126.5° |
| C26 | C25 | H25 | 125.7° | 126.5° |
| C25 | C26 | N27 | 108.0° | 110.0° |
| C25 | C26 | H26 | 126.0° | 125.0° |
| N27 | C26 | H26 | 126.0° | 125.0° |
| C26 | N27 | C28 | 124.5° | 125.1° |
| N27 | C28 | C29 | 107.9° | 109.5° |
| N27 | C28 | H281 | 110.3° | 109.4° |
| N27 | C28 | H282 | 110.0° | 109.5° |
| C29 | C28 | H281 | 110.4° | 109.4° |
| C29 | C28 | H282 | 110.0° | 109.5° |
| C28 | C29 | O31 | 115.7° | 120.0° |
| C28 | C29 | O30 | 117.2° | 120.0° |
| H281 | C28 | H282 | 108.3° | 109.5° |
| O31 | C29 | O30 | 127.1° | 120.0° |
| C29 | O31 | H31 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | C13 | H131 | H132 | 120.0° | 120.0° |
| C12 | C13 | H131 | H133 | 120.0° | 120.0° |
| C12 | C13 | H132 | H133 | 120.0° | 120.0° |
| C13 | C12 | C11 | H121 | 119.5° | 120.0° |
| C13 | C12 | C11 | H122 | 120.0° | 120.0° |
| C13 | C12 | H121 | H122 | 119.7° | 120.1° |
| C13 | C12 | C11 | C10 | 168.7° | 180.0° |
| C13 | C12 | C11 | H111 | 49.4° | 60.0° |
| C13 | C12 | C11 | H112 | 71.3° | 59.9° |
| H131 | C13 | H132 | H133 | 120.0° | 120.0° |
| H131 | C13 | C12 | C11 | 129.0° | 60.0° |
| H131 | C13 | C12 | H121 | 111.5° | 60.0° |
| H131 | C13 | C12 | H122 | 9.0° | 180.0° |
| H132 | C13 | C12 | C11 | 111.0° | 60.0° |
| H132 | C13 | C12 | H121 | 8.5° | 180.0° |
| H132 | C13 | C12 | H122 | 129.0° | 59.9° |
| H133 | C13 | C12 | C11 | 9.0° | 180.0° |
| H133 | C13 | C12 | H121 | 128.5° | 60.1° |
| H133 | C13 | C12 | H122 | 111.0° | 60.0° |
| C11 | C12 | H121 | H122 | 119.7° | 119.9° |
| C12 | C11 | C10 | H111 | 119.3° | 120.0° |
| C12 | C11 | C10 | H112 | 120.0° | 120.0° |
| C12 | C11 | H111 | H112 | 119.6° | 120.0° |
| C12 | C11 | C10 | C5 | 80.2° | 90.3° |
| C12 | C11 | C10 | C9 | 100.7° | 90.0° |
| H121 | C12 | C11 | C10 | 71.8° | 60.0° |
| H121 | C12 | C11 | H111 | 168.9° | 180.0° |
| H121 | C12 | C11 | H112 | 48.2° | 60.1° |
| H122 | C12 | C11 | C10 | 48.7° | 60.0° |
| H122 | C12 | C11 | H111 | 70.6° | 60.0° |
| H122 | C12 | C11 | H112 | 168.7° | 180.0° |
| C10 | C11 | H111 | H112 | 119.6° | 120.0° |
| C11 | C10 | C5 | C9 | 179.1° | 179.7° |
| C11 | C10 | C5 | O4 | 1.8° | 0.5° |
| C11 | C10 | C5 | C6 | 178.8° | 179.7° |
| C11 | C10 | C9 | C8 | 179.4° | 180.0° |
| C11 | C10 | C9 | O14 | 5.0° | 0.0° |
| H111 | C11 | C10 | C5 | 39.1° | 149.7° |
| H111 | C11 | C10 | C9 | 140.0° | 30.0° |
| H112 | C11 | C10 | C5 | 159.8° | 29.7° |
| H112 | C11 | C10 | C9 | 19.3° | 150.0° |
| C10 | C5 | O4 | C6 | 179.5° | 179.3° |
| C10 | C5 | O4 | N3 | 180.0° | 179.3° |
| C10 | C5 | C6 | C2 | 179.9° | 179.6° |
| C10 | C5 | C6 | C7 | 0.6° | 0.7° |
| C5 | C10 | C9 | C8 | 0.3° | 0.3° |
| C5 | C10 | C9 | O14 | 174.1° | 179.7° |
| C9 | C10 | C5 | O4 | 179.1° | 179.8° |
| C9 | C10 | C5 | C6 | 0.3° | 0.6° |
| C10 | C9 | C8 | C7 | 0.5° | 0.0° |
| C10 | C9 | C8 | O14 | 174.1° | 180.0° |
| C10 | C9 | C8 | H8 | 179.5° | 179.9° |
| C10 | C9 | O14 | C15 | 149.9° | 180.0° |
| C5 | O4 | N3 | C2 | 0.5° | 0.3° |
| O4 | C5 | C6 | C2 | 0.4° | 0.3° |
| O4 | C5 | C6 | C7 | 178.9° | 179.9° |
| C6 | C5 | O4 | N3 | 0.5° | 0.0° |
| C5 | C6 | C2 | N3 | 0.1° | 0.4° |
| C5 | C6 | C2 | C1 | 177.6° | 180.0° |
| C5 | C6 | C2 | C7 | 179.1° | 179.6° |
| C5 | C6 | C7 | C8 | 0.4° | 0.4° |
| C5 | C6 | C7 | H7 | 179.6° | 179.7° |
| O4 | N3 | C2 | C1 | 177.3° | 180.0° |
| O4 | N3 | C2 | C6 | 0.2° | 0.4° |
| N3 | C2 | C1 | C6 | 177.1° | 179.5° |
| N3 | C2 | C1 | F34 | 111.8° | 5.0° |
| N3 | C2 | C1 | F33 | 125.8° | 125.0° |
| N3 | C2 | C1 | F32 | 6.3° | 115.0° |
| N3 | C2 | C6 | C7 | 179.0° | 180.0° |
| C2 | C1 | F34 | F33 | 123.0° | 120.0° |
| C2 | C1 | F34 | F32 | 120.1° | 120.0° |
| C2 | C1 | F33 | F32 | 121.6° | 120.0° |
| C1 | C2 | C6 | C7 | 1.6° | 0.4° |
| C6 | C2 | C1 | F34 | 65.3° | 174.5° |
| C6 | C2 | C1 | F33 | 57.1° | 54.5° |
| C6 | C2 | C1 | F32 | 176.6° | 65.4° |
| C2 | C6 | C7 | C8 | 179.5° | 180.0° |
| C2 | C6 | C7 | H7 | 0.5° | 0.1° |
| F34 | C1 | F33 | F32 | 117.3° | 120.0° |
| C6 | C7 | C8 | H7 | 180.0° | 179.9° |
| C6 | C7 | C8 | C9 | 0.1° | 0.1° |
| C6 | C7 | C8 | H8 | 179.9° | 180.0° |
| C7 | C8 | C9 | H8 | 180.0° | 179.9° |
| C7 | C8 | C9 | O14 | 173.6° | 180.0° |
| H7 | C7 | C8 | C9 | 179.9° | 180.0° |
| H7 | C7 | C8 | H8 | 0.1° | 0.1° |
| C8 | C9 | O14 | C15 | 35.9° | 0.0° |
| H8 | C8 | C9 | O14 | 6.4° | 0.0° |
| C9 | O14 | C15 | C16 | 130.7° | 180.0° |
| C9 | O14 | C15 | H151 | 9.8° | 60.0° |
| C9 | O14 | C15 | H152 | 109.3° | 60.0° |
| O14 | C15 | C16 | H151 | 120.9° | 120.0° |
| O14 | C15 | C16 | H152 | 120.0° | 120.0° |
| O14 | C15 | H151 | H152 | 120.6° | 120.0° |
| O14 | C15 | C16 | C17 | 49.7° | 180.0° |
| O14 | C15 | C16 | H161 | 171.2° | 60.0° |
| O14 | C15 | C16 | H162 | 70.2° | 60.0° |
| C16 | C15 | H151 | H152 | 120.7° | 120.0° |
| C15 | C16 | C17 | H161 | 121.5° | 120.0° |
| C15 | C16 | C17 | H162 | 120.0° | 120.0° |
| C15 | C16 | H161 | H162 | 121.0° | 120.0° |
| C15 | C16 | C17 | O18 | 160.9° | 180.0° |
| C15 | C16 | C17 | H171 | 79.0° | 60.0° |
| C15 | C16 | C17 | H172 | 40.9° | 60.0° |
| H151 | C15 | C16 | C17 | 71.2° | 60.0° |
| H151 | C15 | C16 | H161 | 50.3° | 180.0° |
| H151 | C15 | C16 | H162 | 168.8° | 60.0° |
| H152 | C15 | C16 | C17 | 169.7° | 60.0° |
| H152 | C15 | C16 | H161 | 68.8° | 60.0° |
| H152 | C15 | C16 | H162 | 49.7° | 180.0° |
| C17 | C16 | H161 | H162 | 121.0° | 120.0° |
| C16 | C17 | O18 | H171 | 120.2° | 120.0° |
| C16 | C17 | O18 | H172 | 120.0° | 120.0° |
| C16 | C17 | H171 | H172 | 120.2° | 120.0° |
| C16 | C17 | O18 | C19 | 168.1° | 180.0° |
| H161 | C16 | C17 | O18 | 39.4° | 60.0° |
| H161 | C16 | C17 | H171 | 159.6° | 180.0° |
| H161 | C16 | C17 | H172 | 80.6° | 60.0° |
| H162 | C16 | C17 | O18 | 79.1° | 60.0° |
| H162 | C16 | C17 | H171 | 41.1° | 60.0° |
| H162 | C16 | C17 | H172 | 160.9° | 180.0° |
| O18 | C17 | H171 | H172 | 120.1° | 120.0° |
| C17 | O18 | C19 | C20 | 83.4° | 179.7° |
| C17 | O18 | C19 | C24 | 96.6° | 0.0° |
| H171 | C17 | O18 | C19 | 71.8° | 60.0° |
| H172 | C17 | O18 | C19 | 48.1° | 60.0° |
| O18 | C19 | C20 | C24 | 180.0° | 179.7° |
| O18 | C19 | C20 | C21 | 179.8° | 179.8° |
| O18 | C19 | C20 | H20 | 0.2° | 0.1° |
| O18 | C19 | C24 | C23 | 180.0° | 180.0° |
| O18 | C19 | C24 | H24 | 0.0° | 0.1° |
| C19 | C20 | C21 | H20 | 180.0° | 179.9° |
| C20 | C19 | C24 | C23 | 0.0° | 0.3° |
| C20 | C19 | C24 | H24 | 180.0° | 179.8° |
| C19 | C20 | C21 | C22 | 0.1° | 0.5° |
| C19 | C20 | C21 | C25 | 176.1° | 179.8° |
| C24 | C19 | C20 | C21 | 0.2° | 0.5° |
| C24 | C19 | C20 | H20 | 179.8° | 179.6° |
| C19 | C24 | C23 | H24 | 180.0° | 180.0° |
| C19 | C24 | C23 | C22 | 0.2° | 0.0° |
| C19 | C24 | C23 | H23 | 179.8° | 180.0° |
| C20 | C21 | C22 | C23 | 0.1° | 0.2° |
| C20 | C21 | C22 | C25 | 177.0° | 179.8° |
| C20 | C21 | C22 | N27 | 176.9° | 179.8° |
| C20 | C21 | C25 | C26 | 176.3° | 179.8° |
| C20 | C21 | C25 | H25 | 3.8° | 0.2° |
| H20 | C20 | C21 | C22 | 179.9° | 179.6° |
| H20 | C20 | C21 | C25 | 4.0° | 0.1° |
| C24 | C23 | C22 | H23 | 180.0° | 180.0° |
| C24 | C23 | C22 | C21 | 0.3° | 0.0° |
| C24 | C23 | C22 | N27 | 175.7° | 180.0° |
| H24 | C24 | C23 | C22 | 179.8° | 180.0° |
| H24 | C24 | C23 | H23 | 0.2° | 0.0° |
| C23 | C22 | C21 | N27 | 177.0° | 180.0° |
| C23 | C22 | C21 | C25 | 177.2° | 180.0° |
| C23 | C22 | N27 | C26 | 176.4° | 180.0° |
| C23 | C22 | N27 | C28 | 5.3° | 0.1° |
| H23 | C23 | C22 | C21 | 179.7° | 180.0° |
| H23 | C23 | C22 | N27 | 4.3° | 0.1° |
| C22 | C21 | C25 | C26 | 0.2° | 0.0° |
| C22 | C21 | C25 | H25 | 179.7° | 180.0° |
| C21 | C22 | N27 | C26 | 0.0° | 0.0° |
| C21 | C22 | N27 | C28 | 178.3° | 179.9° |
| N27 | C22 | C21 | C25 | 0.2° | 0.0° |
| C22 | N27 | C26 | C25 | 0.1° | 0.0° |
| C22 | N27 | C26 | C28 | 178.3° | 179.9° |
| C22 | N27 | C26 | H26 | 179.9° | 180.0° |
| C22 | N27 | C28 | C29 | 77.4° | 85.0° |
| C22 | N27 | C28 | H281 | 43.2° | 155.0° |
| C22 | N27 | C28 | H282 | 162.6° | 35.1° |
| C21 | C25 | C26 | H25 | 180.0° | 180.0° |
| C21 | C25 | C26 | N27 | 0.2° | 0.0° |
| C21 | C25 | C26 | H26 | 179.8° | 180.0° |
| C25 | C26 | N27 | H26 | 180.0° | 180.0° |
| C25 | C26 | N27 | C28 | 178.1° | 179.9° |
| H25 | C25 | C26 | N27 | 179.7° | 180.0° |
| H25 | C25 | C26 | H26 | 0.2° | 0.0° |
| C26 | N27 | C28 | C29 | 104.6° | 94.9° |
| C26 | N27 | C28 | H281 | 134.8° | 25.1° |
| C26 | N27 | C28 | H282 | 15.4° | 145.0° |
| H26 | C26 | N27 | C28 | 1.9° | 0.1° |
| N27 | C28 | C29 | H281 | 120.6° | 119.9° |
| N27 | C28 | C29 | H282 | 120.0° | 120.1° |
| N27 | C28 | H281 | H282 | 120.4° | 120.0° |
| N27 | C28 | C29 | O31 | 64.4° | 180.0° |
| N27 | C28 | C29 | O30 | 114.7° | 0.0° |
| C29 | C28 | H281 | H282 | 120.4° | 120.0° |
| C28 | C29 | O31 | O30 | 179.0° | 180.0° |
| C28 | C29 | O31 | H31 | 179.0° | 179.9° |
| H281 | C28 | C29 | O31 | 56.2° | 60.0° |
| H281 | C28 | C29 | O30 | 124.6° | 120.0° |
| H282 | C28 | C29 | O31 | 175.6° | 60.0° |
| H282 | C28 | C29 | O30 | 5.2° | 120.0° |
| O30 | C29 | O31 | H31 | 0.0° | 0.1° |
