3Q6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | doub | 1.36Å | 1.38Å | Aromatic |
| C5 | C1 | sing | 1.41Å | 1.39Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | C2 | sing | 1.41Å | 1.38Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | C6 | doub | 1.38Å | 1.38Å | Aromatic |
| C3 | C7 | sing | 1.41Å | 1.38Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C9 | C4 | doub | 1.39Å | 1.38Å | Aromatic |
| C8 | C4 | sing | 1.39Å | 1.38Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C7 | C5 | sing | 1.47Å | 1.38Å | Aromatic |
| C5 | C10 | doub | 1.39Å | 1.43Å | Aromatic |
| C8 | C6 | sing | 1.48Å | 1.45Å | Aromatic |
| N26 | C7 | doub | 1.32Å | 1.37Å | Aromatic |
| N23 | C8 | doub | 1.33Å | 1.34Å | Aromatic |
| N24 | C9 | sing | 1.33Å | 1.34Å | Aromatic |
| C9 | N27 | sing | 1.39Å | 1.41Å | |
| N25 | C10 | sing | 1.34Å | 1.34Å | Aromatic |
| C10 | N28 | sing | 1.39Å | 1.36Å | |
| N29 | C11 | sing | 1.38Å | 1.40Å | |
| C11 | N24 | doub | 1.32Å | 1.34Å | Aromatic |
| C11 | N23 | sing | 1.32Å | 1.34Å | Aromatic |
| O32 | C12 | sing | 1.35Å | 1.35Å | |
| N30 | C12 | sing | 1.35Å | 1.37Å | |
| C12 | O31 | doub | 1.22Å | 1.22Å | |
| C17 | C13 | sing | 1.53Å | 1.53Å | |
| C13 | C16 | sing | 1.53Å | 1.53Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| N27 | C14 | sing | 1.47Å | 1.45Å | |
| C14 | C16 | sing | 1.53Å | 1.52Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C15 | N27 | sing | 1.47Å | 1.45Å | |
| C15 | C17 | sing | 1.53Å | 1.52Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C16 | C18 | sing | 1.53Å | 1.51Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| N30 | C17 | sing | 1.46Å | 1.43Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C18 | H18B | sing | 1.09Å | 1.10Å | |
| C22 | C19 | sing | 1.53Å | 1.52Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C19 | H19B | sing | 1.09Å | 1.10Å | |
| C20 | C22 | sing | 1.53Å | 1.51Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C20 | H20B | sing | 1.09Å | 1.10Å | |
| C21 | C22 | sing | 1.53Å | 1.51Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C21 | H21B | sing | 1.09Å | 1.10Å | |
| O32 | C22 | sing | 1.45Å | 1.43Å | |
| N26 | N25 | sing | 1.40Å | 1.34Å | Aromatic |
| N28 | HN28 | sing | 0.97Å | 1.00Å | |
| N28 | HN2A | sing | 0.97Å | 1.00Å | |
| N29 | HN29 | sing | 0.97Å | 1.00Å | |
| N29 | HN2B | sing | 0.97Å | 1.00Å | |
| N30 | HN30 | sing | 0.97Å | 1.00Å | |
| N25 | HN25 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C5 | 117.6° | 119.8° |
| C2 | C1 | H1 | 121.2° | 120.1° |
| C1 | C2 | C6 | 122.9° | 121.6° |
| C1 | C2 | H2 | 118.5° | 119.2° |
| C5 | C1 | H1 | 121.2° | 120.1° |
| C1 | C5 | C7 | 118.5° | 119.2° |
| C1 | C5 | C10 | 137.1° | 134.5° |
| C6 | C2 | H2 | 118.5° | 119.2° |
| C2 | C6 | C3 | 119.5° | 121.4° |
| C2 | C6 | C8 | 123.7° | 119.3° |
| C6 | C3 | C7 | 117.3° | 119.4° |
| C6 | C3 | H3 | 121.3° | 120.3° |
| C3 | C6 | C8 | 116.8° | 119.3° |
| C7 | C3 | H3 | 121.4° | 120.3° |
| C3 | C7 | C5 | 124.1° | 118.7° |
| C3 | C7 | N26 | 129.7° | 134.5° |
| C9 | C4 | C8 | 116.3° | 118.4° |
| C9 | C4 | H4 | 121.8° | 120.8° |
| C4 | C9 | N24 | 123.0° | 119.1° |
| C4 | C9 | N27 | 117.7° | 120.5° |
| C8 | C4 | H4 | 121.9° | 120.8° |
| C4 | C8 | C6 | 123.3° | 120.4° |
| C4 | C8 | N23 | 121.6° | 119.1° |
| C7 | C5 | C10 | 104.4° | 106.3° |
| C5 | C7 | N26 | 106.2° | 106.9° |
| C5 | C10 | N25 | 111.5° | 107.7° |
| C5 | C10 | N28 | 124.2° | 126.1° |
| C6 | C8 | N23 | 115.0° | 120.5° |
| C7 | N26 | N25 | 113.4° | 109.2° |
| C8 | N23 | C11 | 118.1° | 120.8° |
| N24 | C9 | N27 | 119.2° | 120.5° |
| C9 | N24 | C11 | 116.9° | 120.9° |
| C9 | N27 | C14 | 117.2° | 111.0° |
| C9 | N27 | C15 | 118.0° | 111.0° |
| N25 | C10 | N28 | 124.2° | 126.1° |
| C10 | N25 | N26 | 104.4° | 110.0° |
| C10 | N25 | HN25 | 127.8° | 125.0° |
| C10 | N28 | HN28 | 109.5° | 120.0° |
| C10 | N28 | HN2A | 109.5° | 120.0° |
| N29 | C11 | N24 | 117.4° | 119.1° |
| N29 | C11 | N23 | 118.6° | 119.1° |
| C11 | N29 | HN29 | 109.5° | 120.0° |
| C11 | N29 | HN2B | 109.5° | 120.0° |
| N24 | C11 | N23 | 124.0° | 121.8° |
| O32 | C12 | N30 | 106.7° | 120.0° |
| O32 | C12 | O31 | 126.3° | 120.0° |
| C12 | O32 | C22 | 119.0° | 117.1° |
| N30 | C12 | O31 | 127.0° | 120.0° |
| C12 | N30 | C17 | 120.7° | 120.0° |
| C12 | N30 | HN30 | 119.7° | 120.0° |
| C17 | C13 | C16 | 113.8° | 109.2° |
| C17 | C13 | H13 | 108.0° | 109.5° |
| C17 | C13 | H13A | 108.0° | 109.6° |
| C13 | C17 | C15 | 112.1° | 109.3° |
| C13 | C17 | N30 | 110.1° | 109.5° |
| C13 | C17 | H17 | 108.0° | 109.5° |
| C16 | C13 | H13 | 108.1° | 109.5° |
| C16 | C13 | H13A | 108.1° | 109.5° |
| C13 | C16 | C14 | 111.1° | 109.3° |
| C13 | C16 | C18 | 110.1° | 109.5° |
| C13 | C16 | H16 | 107.7° | 109.5° |
| H13 | C13 | H13A | 110.9° | 109.6° |
| N27 | C14 | C16 | 99.1° | 109.5° |
| N27 | C14 | H14 | 113.1° | 109.4° |
| N27 | C14 | H14A | 113.1° | 109.5° |
| C14 | N27 | C15 | 116.2° | 111.3° |
| C16 | C14 | H14 | 113.1° | 109.5° |
| C16 | C14 | H14A | 113.1° | 109.5° |
| C14 | C16 | C18 | 108.7° | 109.5° |
| C14 | C16 | H16 | 109.1° | 109.5° |
| H14 | C14 | H14A | 105.6° | 109.4° |
| N27 | C15 | C17 | 96.6° | 109.5° |
| N27 | C15 | H15 | 114.0° | 109.5° |
| N27 | C15 | H15A | 114.0° | 109.4° |
| C17 | C15 | H15 | 114.0° | 109.5° |
| C17 | C15 | H15A | 114.0° | 109.4° |
| C15 | C17 | N30 | 111.9° | 109.5° |
| C15 | C17 | H17 | 106.2° | 109.5° |
| H15 | C15 | H15A | 104.6° | 109.5° |
| C18 | C16 | H16 | 110.1° | 109.6° |
| C16 | C18 | H18 | 109.5° | 109.5° |
| C16 | C18 | H18A | 109.5° | 109.5° |
| C16 | C18 | H18B | 109.5° | 109.4° |
| N30 | C17 | H17 | 108.3° | 109.5° |
| C17 | N30 | HN30 | 119.7° | 120.0° |
| H18 | C18 | H18A | 109.4° | 109.5° |
| H18 | C18 | H18B | 109.4° | 109.5° |
| H18A | C18 | H18B | 109.5° | 109.4° |
| C22 | C19 | H19 | 109.5° | 109.5° |
| C22 | C19 | H19A | 109.4° | 109.5° |
| C22 | C19 | H19B | 109.5° | 109.5° |
| C19 | C22 | C20 | 110.0° | 109.5° |
| C19 | C22 | C21 | 111.5° | 109.5° |
| C19 | C22 | O32 | 111.2° | 109.5° |
| H19 | C19 | H19A | 109.5° | 109.5° |
| H19 | C19 | H19B | 109.4° | 109.4° |
| H19A | C19 | H19B | 109.5° | 109.4° |
| C22 | C20 | H20 | 109.5° | 109.5° |
| C22 | C20 | H20A | 109.5° | 109.5° |
| C22 | C20 | H20B | 109.5° | 109.5° |
| C20 | C22 | C21 | 107.6° | 109.4° |
| C20 | C22 | O32 | 104.2° | 109.5° |
| H20 | C20 | H20A | 109.4° | 109.4° |
| H20 | C20 | H20B | 109.5° | 109.5° |
| H20A | C20 | H20B | 109.5° | 109.4° |
| C22 | C21 | H21 | 109.5° | 109.4° |
| C22 | C21 | H21A | 109.5° | 109.5° |
| C22 | C21 | H21B | 109.5° | 109.5° |
| C21 | C22 | O32 | 112.1° | 109.4° |
| H21 | C21 | H21A | 109.5° | 109.5° |
| H21 | C21 | H21B | 109.4° | 109.4° |
| H21A | C21 | H21B | 109.5° | 109.5° |
| N26 | N25 | HN25 | 127.8° | 125.0° |
| HN28 | N28 | HN2A | 109.5° | 120.0° |
| HN29 | N29 | HN2B | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C5 | H1 | 180.0° | 179.8° |
| C1 | C2 | C6 | H2 | 180.0° | 179.9° |
| C1 | C2 | C6 | C3 | 1.0° | 0.1° |
| C2 | C1 | C5 | C7 | 0.3° | 0.2° |
| C2 | C1 | C5 | C10 | 179.5° | 179.8° |
| C1 | C2 | C6 | C8 | 178.1° | 179.8° |
| C5 | C1 | C2 | C6 | 0.6° | 0.2° |
| C5 | C1 | C2 | H2 | 179.4° | 179.7° |
| C1 | C5 | C7 | C3 | 0.9° | 0.1° |
| C1 | C5 | C7 | C10 | 179.9° | 180.0° |
| C1 | C5 | C7 | N26 | 179.9° | 179.8° |
| C1 | C5 | C10 | N25 | 179.7° | 180.0° |
| C1 | C5 | C10 | N28 | 0.2° | 0.0° |
| H1 | C1 | C2 | C6 | 179.4° | 180.0° |
| H1 | C1 | C2 | H2 | 0.6° | 0.1° |
| H1 | C1 | C5 | C7 | 179.7° | 180.0° |
| H1 | C1 | C5 | C10 | 0.5° | 0.0° |
| C2 | C6 | C3 | C8 | 179.2° | 179.7° |
| C2 | C6 | C3 | C7 | 0.5° | 0.3° |
| C2 | C6 | C3 | H3 | 179.5° | 180.0° |
| C2 | C6 | C8 | C4 | 6.2° | 0.3° |
| C2 | C6 | C8 | N23 | 174.8° | 179.7° |
| H2 | C2 | C6 | C3 | 178.9° | 180.0° |
| H2 | C2 | C6 | C8 | 2.0° | 0.3° |
| C6 | C3 | C7 | H3 | 180.0° | 179.7° |
| C3 | C6 | C8 | C4 | 174.7° | 180.0° |
| C6 | C3 | C7 | C5 | 0.4° | 0.3° |
| C6 | C3 | C7 | N26 | 179.2° | 180.0° |
| C3 | C6 | C8 | N23 | 4.3° | 0.0° |
| C3 | C7 | C5 | N26 | 179.0° | 179.8° |
| C3 | C7 | C5 | C10 | 179.0° | 179.9° |
| C7 | C3 | C6 | C8 | 178.6° | 180.0° |
| C3 | C7 | N26 | N25 | 178.8° | 179.9° |
| H3 | C3 | C7 | C5 | 179.6° | 180.0° |
| H3 | C3 | C6 | C8 | 1.4° | 0.3° |
| H3 | C3 | C7 | N26 | 0.8° | 0.3° |
| C9 | C4 | C8 | H4 | 180.0° | 179.7° |
| C9 | C4 | C8 | C6 | 178.7° | 179.7° |
| C9 | C4 | C8 | N23 | 0.2° | 0.3° |
| C4 | C9 | N24 | N27 | 176.4° | 180.0° |
| C4 | C9 | N24 | C11 | 1.8° | 0.0° |
| C4 | C9 | N27 | C14 | 23.4° | 179.7° |
| C4 | C9 | N27 | C15 | 170.1° | 56.0° |
| C4 | C8 | C6 | N23 | 179.0° | 180.0° |
| C8 | C4 | C9 | N24 | 1.2° | 0.3° |
| C8 | C4 | C9 | N27 | 177.6° | 179.7° |
| C4 | C8 | N23 | C11 | 0.9° | 0.0° |
| H4 | C4 | C8 | C6 | 1.3° | 0.0° |
| H4 | C4 | C8 | N23 | 179.8° | 180.0° |
| H4 | C4 | C9 | N24 | 178.8° | 180.0° |
| H4 | C4 | C9 | N27 | 2.4° | 0.0° |
| C7 | C5 | C10 | N25 | 0.1° | 0.0° |
| C7 | C5 | C10 | N28 | 179.9° | 180.0° |
| C5 | C7 | N26 | N25 | 0.2° | 0.2° |
| C10 | C5 | C7 | N26 | 0.0° | 0.2° |
| C5 | C10 | N25 | N28 | 179.9° | 180.0° |
| C5 | C10 | N25 | N26 | 0.2° | 0.1° |
| C5 | C10 | N28 | HN28 | 180.0° | 0.0° |
| C5 | C10 | N28 | HN2A | 60.0° | 180.0° |
| C5 | C10 | N25 | HN25 | 179.7° | 180.0° |
| C6 | C8 | N23 | C11 | 178.1° | 180.0° |
| C7 | N26 | N25 | C10 | 0.3° | 0.2° |
| C7 | N26 | N25 | HN25 | 179.7° | 179.9° |
| C8 | N23 | C11 | N29 | 179.5° | 180.0° |
| C8 | N23 | C11 | N24 | 0.1° | 0.2° |
| C9 | N24 | C11 | N29 | 179.2° | 180.0° |
| C9 | N24 | C11 | N23 | 1.2° | 0.2° |
| N24 | C9 | N27 | C14 | 160.0° | 0.3° |
| N24 | C9 | N27 | C15 | 13.3° | 124.0° |
| N27 | C9 | N24 | C11 | 178.2° | 180.0° |
| C9 | N27 | C14 | C15 | 147.3° | 124.1° |
| C9 | N27 | C14 | C16 | 132.1° | 174.2° |
| C9 | N27 | C14 | H14 | 12.1° | 65.8° |
| C9 | N27 | C14 | H14A | 107.9° | 54.1° |
| C9 | N27 | C15 | C17 | 131.7° | 174.2° |
| C9 | N27 | C15 | H15 | 108.4° | 54.1° |
| C9 | N27 | C15 | H15A | 11.7° | 65.8° |
| C10 | N25 | N26 | HN25 | 180.0° | 179.9° |
| N25 | C10 | N28 | HN28 | 0.1° | 180.0° |
| N25 | C10 | N28 | HN2A | 119.9° | 0.0° |
| N28 | C10 | N25 | N26 | 179.8° | 179.9° |
| C10 | N28 | HN28 | HN2A | 120.0° | 180.0° |
| N28 | C10 | N25 | HN25 | 0.2° | 0.0° |
| N29 | C11 | N24 | N23 | 179.7° | 179.8° |
| C11 | N29 | HN29 | HN2B | 120.0° | 180.0° |
| N24 | C11 | N29 | HN29 | 0.0° | 0.0° |
| N24 | C11 | N29 | HN2B | 120.0° | 180.0° |
| N23 | C11 | N29 | HN29 | 179.7° | 179.8° |
| N23 | C11 | N29 | HN2B | 60.4° | 0.2° |
| O32 | C12 | N30 | O31 | 179.6° | 179.9° |
| O32 | C12 | N30 | C17 | 170.0° | 180.0° |
| C12 | O32 | C22 | C19 | 58.7° | 180.0° |
| C12 | O32 | C22 | C20 | 177.1° | 59.9° |
| C12 | O32 | C22 | C21 | 66.9° | 60.0° |
| O32 | C12 | N30 | HN30 | 10.0° | 0.0° |
| C12 | N30 | C17 | C13 | 137.1° | 155.2° |
| C12 | N30 | C17 | C15 | 97.5° | 85.0° |
| C12 | N30 | C17 | HN30 | 180.0° | 180.0° |
| C12 | N30 | C17 | H17 | 19.2° | 35.2° |
| N30 | C12 | O32 | C22 | 174.4° | 180.0° |
| O31 | C12 | N30 | C17 | 9.6° | 0.1° |
| O31 | C12 | O32 | C22 | 6.0° | 0.0° |
| O31 | C12 | N30 | HN30 | 170.4° | 180.0° |
| C17 | C13 | C16 | H13 | 120.0° | 119.9° |
| C17 | C13 | C16 | H13A | 120.0° | 120.0° |
| C17 | C13 | H13 | H13A | 118.2° | 120.2° |
| C17 | C13 | C16 | C14 | 46.2° | 57.6° |
| C13 | C17 | C15 | N27 | 57.0° | 59.1° |
| C13 | C17 | C15 | N30 | 124.3° | 120.0° |
| C13 | C17 | C15 | H17 | 117.8° | 119.9° |
| C13 | C17 | C15 | H15 | 63.0° | 179.2° |
| C13 | C17 | C15 | H15A | 176.9° | 60.8° |
| C17 | C13 | C16 | C18 | 74.3° | 62.3° |
| C17 | C13 | C16 | H16 | 165.6° | 177.6° |
| C13 | C17 | N30 | H17 | 117.9° | 120.1° |
| C13 | C17 | N30 | HN30 | 42.9° | 24.8° |
| C16 | C13 | H13 | H13A | 118.2° | 120.1° |
| C13 | C16 | C14 | N27 | 53.6° | 59.1° |
| C13 | C16 | C14 | C18 | 121.4° | 119.9° |
| C13 | C16 | C14 | H16 | 118.5° | 120.0° |
| C13 | C16 | C14 | H14 | 173.6° | 60.8° |
| C13 | C16 | C14 | H14A | 66.4° | 179.2° |
| C16 | C13 | C17 | C15 | 48.8° | 57.6° |
| C13 | C16 | C18 | H16 | 118.6° | 120.1° |
| C16 | C13 | C17 | N30 | 174.1° | 177.6° |
| C16 | C13 | C17 | H17 | 67.8° | 62.3° |
| C13 | C16 | C18 | H18 | 180.0° | 59.9° |
| C13 | C16 | C18 | H18A | 60.0° | 180.0° |
| C13 | C16 | C18 | H18B | 60.0° | 60.1° |
| H13 | C13 | C16 | C14 | 73.8° | 177.5° |
| H13 | C13 | C17 | C15 | 71.2° | 177.5° |
| H13 | C13 | C16 | C18 | 165.7° | 57.6° |
| H13 | C13 | C16 | H16 | 45.6° | 62.5° |
| H13 | C13 | C17 | N30 | 54.1° | 62.5° |
| H13 | C13 | C17 | H17 | 172.2° | 57.6° |
| H13A | C13 | C16 | C14 | 166.2° | 62.3° |
| H13A | C13 | C17 | C15 | 168.8° | 62.3° |
| H13A | C13 | C16 | C18 | 45.7° | 177.8° |
| H13A | C13 | C16 | H16 | 74.4° | 57.7° |
| H13A | C13 | C17 | N30 | 65.9° | 57.7° |
| H13A | C13 | C17 | H17 | 52.2° | 177.8° |
| N27 | C14 | C16 | H14 | 120.0° | 120.0° |
| N27 | C14 | C16 | H14A | 120.0° | 120.0° |
| N27 | C14 | H14 | H14A | 124.2° | 119.9° |
| C14 | N27 | C15 | C17 | 81.3° | 61.7° |
| C14 | N27 | C15 | H15 | 38.7° | 178.2° |
| C14 | N27 | C15 | H15A | 158.7° | 58.3° |
| N27 | C14 | C16 | C18 | 67.8° | 60.8° |
| N27 | C14 | C16 | H16 | 172.1° | 179.1° |
| C16 | C14 | H14 | H14A | 124.2° | 120.0° |
| C16 | C14 | N27 | C15 | 80.6° | 61.7° |
| C14 | C16 | C18 | H16 | 119.5° | 120.1° |
| C14 | C16 | C18 | H18 | 58.0° | 59.8° |
| C14 | C16 | C18 | H18A | 178.0° | 60.2° |
| C14 | C16 | C18 | H18B | 62.0° | 179.8° |
| H14 | C14 | N27 | C15 | 159.4° | 58.3° |
| H14 | C14 | C16 | C18 | 52.2° | 179.3° |
| H14 | C14 | C16 | H16 | 67.9° | 59.1° |
| H14A | C14 | N27 | C15 | 39.4° | 178.2° |
| H14A | C14 | C16 | C18 | 172.2° | 59.3° |
| H14A | C14 | C16 | H16 | 52.1° | 60.8° |
| N27 | C15 | C17 | H15 | 120.0° | 120.1° |
| N27 | C15 | C17 | H15A | 120.0° | 120.0° |
| N27 | C15 | H15 | H15A | 125.2° | 120.0° |
| N27 | C15 | C17 | N30 | 178.8° | 179.1° |
| N27 | C15 | C17 | H17 | 60.8° | 60.8° |
| C17 | C15 | H15 | H15A | 125.2° | 120.0° |
| C15 | C17 | N30 | H17 | 116.7° | 120.1° |
| C15 | C17 | N30 | HN30 | 82.5° | 95.0° |
| H15 | C15 | C17 | N30 | 61.2° | 60.9° |
| H15 | C15 | C17 | H17 | 179.2° | 59.3° |
| H15A | C15 | C17 | N30 | 58.8° | 59.1° |
| H15A | C15 | C17 | H17 | 59.2° | 179.3° |
| C16 | C18 | H18 | H18A | 120.0° | 120.0° |
| C16 | C18 | H18 | H18B | 120.0° | 120.0° |
| C16 | C18 | H18A | H18B | 120.0° | 119.9° |
| H16 | C16 | C18 | H18 | 61.4° | 180.0° |
| H16 | C16 | C18 | H18A | 58.6° | 59.9° |
| H16 | C16 | C18 | H18B | 178.6° | 60.1° |
| H17 | C17 | N30 | HN30 | 160.9° | 144.9° |
| H18 | C18 | H18A | H18B | 120.0° | 120.0° |
| C22 | C19 | H19 | H19A | 120.0° | 120.0° |
| C22 | C19 | H19 | H19B | 120.0° | 120.0° |
| C22 | C19 | H19A | H19B | 120.0° | 120.0° |
| C19 | C22 | C20 | C21 | 121.6° | 120.0° |
| C19 | C22 | C20 | O32 | 119.2° | 120.1° |
| C19 | C22 | C20 | H20 | 180.0° | 180.0° |
| C19 | C22 | C20 | H20A | 60.0° | 60.0° |
| C19 | C22 | C20 | H20B | 60.0° | 60.0° |
| C19 | C22 | C21 | O32 | 125.4° | 120.0° |
| C19 | C22 | C21 | H21 | 180.0° | 60.0° |
| C19 | C22 | C21 | H21A | 60.0° | 60.0° |
| C19 | C22 | C21 | H21B | 60.0° | 180.0° |
| H19 | C19 | H19A | H19B | 120.0° | 119.9° |
| H19 | C19 | C22 | C20 | 180.0° | 60.0° |
| H19 | C19 | C22 | C21 | 60.8° | 180.0° |
| H19 | C19 | C22 | O32 | 65.1° | 60.0° |
| H19A | C19 | C22 | C20 | 60.0° | 180.0° |
| H19A | C19 | C22 | C21 | 179.2° | 60.0° |
| H19A | C19 | C22 | O32 | 54.9° | 60.0° |
| H19B | C19 | C22 | C20 | 60.0° | 60.0° |
| H19B | C19 | C22 | C21 | 59.2° | 60.0° |
| H19B | C19 | C22 | O32 | 174.9° | 180.0° |
| C22 | C20 | H20 | H20A | 120.0° | 120.0° |
| C22 | C20 | H20 | H20B | 120.0° | 120.1° |
| C22 | C20 | H20A | H20B | 120.0° | 120.0° |
| C20 | C22 | C21 | O32 | 114.0° | 119.9° |
| C20 | C22 | C21 | H21 | 59.3° | 60.0° |
| C20 | C22 | C21 | H21A | 179.3° | 180.0° |
| C20 | C22 | C21 | H21B | 60.6° | 59.9° |
| H20 | C20 | H20A | H20B | 120.0° | 119.9° |
| H20 | C20 | C22 | C21 | 58.4° | 60.0° |
| H20 | C20 | C22 | O32 | 60.8° | 59.9° |
| H20A | C20 | C22 | C21 | 61.6° | 180.0° |
| H20A | C20 | C22 | O32 | 179.2° | 60.1° |
| H20B | C20 | C22 | C21 | 178.4° | 60.1° |
| H20B | C20 | C22 | O32 | 59.2° | 180.0° |
| C22 | C21 | H21 | H21A | 120.0° | 120.0° |
| C22 | C21 | H21 | H21B | 120.0° | 120.0° |
| C22 | C21 | H21A | H21B | 120.0° | 120.1° |
| H21 | C21 | H21A | H21B | 119.9° | 119.9° |
| H21 | C21 | C22 | O32 | 54.6° | 179.9° |
| H21A | C21 | C22 | O32 | 65.4° | 60.0° |
| H21B | C21 | C22 | O32 | 174.6° | 60.0° |
