J2I
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | sing | 1.39Å | 1.42Å | Aromatic |
| C1 | C6 | doub | 1.36Å | 1.38Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | C11 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C9 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C3 | C8 | sing | 1.39Å | 1.40Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C10 | C4 | sing | 1.38Å | 1.40Å | Aromatic |
| C8 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | C5 | doub | 1.36Å | 1.42Å | Aromatic |
| C12 | C5 | sing | 1.40Å | 1.38Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | N28 | sing | 1.35Å | 1.37Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C23 | C7 | sing | 1.51Å | 1.51Å | |
| C9 | C7 | sing | 1.38Å | 1.41Å | Aromatic |
| C7 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C8 | O33 | sing | 1.36Å | 1.37Å | |
| F34 | C9 | sing | 1.35Å | 1.33Å | |
| C10 | F35 | sing | 1.35Å | 1.34Å | |
| C11 | C14 | sing | 1.41Å | 1.45Å | Aromatic |
| C11 | N28 | sing | 1.38Å | 1.38Å | Aromatic |
| N27 | C12 | doub | 1.31Å | 1.36Å | Aromatic |
| C12 | C21 | sing | 1.51Å | 1.48Å | |
| N24 | C13 | sing | 1.36Å | 1.33Å | Aromatic |
| N31 | C13 | sing | 1.39Å | 1.40Å | |
| N31 | C14 | sing | 1.38Å | 1.37Å | |
| C14 | N25 | doub | 1.32Å | 1.32Å | Aromatic |
| N25 | C15 | sing | 1.34Å | 1.41Å | Aromatic |
| N26 | C15 | doub | 1.31Å | 1.33Å | Aromatic |
| C15 | N29 | sing | 1.39Å | 1.36Å | |
| N30 | C16 | sing | 1.35Å | 1.38Å | |
| C16 | C23 | sing | 1.51Å | 1.50Å | |
| C16 | O32 | doub | 1.21Å | 1.23Å | |
| N29 | C17 | sing | 1.47Å | 1.47Å | |
| C19 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C20 | C18 | sing | 1.54Å | 1.53Å | |
| N29 | C18 | sing | 1.47Å | 1.46Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C19 | N30 | sing | 1.47Å | 1.48Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C20 | N30 | sing | 1.47Å | 1.48Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C21 | H21B | sing | 1.09Å | 1.10Å | |
| O33 | C22 | sing | 1.43Å | 1.42Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C22 | H22B | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| N24 | N27 | sing | 1.40Å | 1.34Å | Aromatic |
| N28 | N26 | sing | 1.40Å | 1.37Å | Aromatic |
| N31 | HN31 | sing | 0.97Å | 1.00Å | |
| N24 | HN24 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 108.3° | 107.9° |
| C2 | C1 | H1 | 125.9° | 126.1° |
| C1 | C2 | C11 | 106.4° | 106.8° |
| C1 | C2 | H2 | 126.8° | 126.6° |
| C6 | C1 | H1 | 125.8° | 126.0° |
| C1 | C6 | N28 | 107.5° | 109.1° |
| C1 | C6 | H6 | 126.3° | 125.5° |
| C11 | C2 | H2 | 126.8° | 126.6° |
| C2 | C11 | C14 | 133.1° | 133.7° |
| C2 | C11 | N28 | 108.3° | 107.6° |
| C9 | C3 | C8 | 120.1° | 119.9° |
| C9 | C3 | H3 | 120.0° | 120.0° |
| C3 | C9 | C7 | 121.0° | 120.0° |
| C3 | C9 | F34 | 119.0° | 120.0° |
| C8 | C3 | H3 | 119.9° | 120.1° |
| C3 | C8 | C4 | 118.9° | 120.0° |
| C3 | C8 | O33 | 122.6° | 120.0° |
| C10 | C4 | C8 | 121.1° | 119.9° |
| C10 | C4 | H4 | 119.5° | 120.0° |
| C4 | C10 | C7 | 120.5° | 120.0° |
| C4 | C10 | F35 | 118.2° | 120.0° |
| C8 | C4 | H4 | 119.4° | 120.1° |
| C4 | C8 | O33 | 118.5° | 120.0° |
| C13 | C5 | C12 | 104.8° | 107.8° |
| C13 | C5 | H5 | 127.6° | 126.1° |
| C5 | C13 | N24 | 111.7° | 107.5° |
| C5 | C13 | N31 | 125.8° | 126.3° |
| C12 | C5 | H5 | 127.6° | 126.1° |
| C5 | C12 | N27 | 105.3° | 108.5° |
| C5 | C12 | C21 | 133.8° | 125.7° |
| N28 | C6 | H6 | 126.3° | 125.4° |
| C6 | N28 | C11 | 109.5° | 108.6° |
| C6 | N28 | N26 | 126.7° | 133.0° |
| C23 | C7 | C9 | 120.3° | 120.0° |
| C23 | C7 | C10 | 121.4° | 119.9° |
| C7 | C23 | C16 | 114.3° | 109.4° |
| C7 | C23 | H23 | 107.9° | 109.4° |
| C7 | C23 | H23A | 107.9° | 109.5° |
| C9 | C7 | C10 | 118.3° | 120.1° |
| C7 | C9 | F34 | 120.0° | 120.0° |
| C7 | C10 | F35 | 121.3° | 120.0° |
| C8 | O33 | C22 | 120.1° | 117.0° |
| C14 | C11 | N28 | 118.4° | 118.7° |
| C11 | C14 | N31 | 120.6° | 120.4° |
| C11 | C14 | N25 | 116.8° | 119.3° |
| C11 | N28 | N26 | 123.6° | 118.4° |
| N27 | C12 | C21 | 120.8° | 125.8° |
| C12 | N27 | N24 | 114.1° | 108.4° |
| C12 | C21 | H21 | 109.5° | 109.5° |
| C12 | C21 | H21A | 109.5° | 109.4° |
| C12 | C21 | H21B | 109.4° | 109.4° |
| N24 | C13 | N31 | 122.3° | 126.3° |
| C13 | N24 | N27 | 104.0° | 107.8° |
| C13 | N24 | HN24 | 128.0° | 126.1° |
| C13 | N31 | C14 | 133.3° | 120.0° |
| C13 | N31 | HN31 | 113.4° | 120.0° |
| N31 | C14 | N25 | 122.5° | 120.4° |
| C14 | N31 | HN31 | 113.3° | 120.0° |
| C14 | N25 | C15 | 121.8° | 121.6° |
| N25 | C15 | N26 | 123.4° | 122.0° |
| N25 | C15 | N29 | 117.5° | 119.0° |
| N26 | C15 | N29 | 119.0° | 119.0° |
| C15 | N26 | N28 | 115.8° | 120.0° |
| C15 | N29 | C17 | 122.4° | 120.6° |
| C15 | N29 | C18 | 122.2° | 120.6° |
| N30 | C16 | C23 | 117.2° | 120.0° |
| N30 | C16 | O32 | 122.1° | 120.0° |
| C16 | N30 | C19 | 117.2° | 120.6° |
| C16 | N30 | C20 | 125.1° | 120.6° |
| C23 | C16 | O32 | 120.7° | 120.0° |
| C16 | C23 | H23 | 107.9° | 109.5° |
| C16 | C23 | H23A | 107.9° | 109.5° |
| N29 | C17 | C19 | 109.4° | 108.8° |
| N29 | C17 | H17 | 109.5° | 109.7° |
| N29 | C17 | H17A | 109.5° | 109.6° |
| C17 | N29 | C18 | 114.6° | 118.8° |
| C19 | C17 | H17 | 109.5° | 109.6° |
| C19 | C17 | H17A | 109.5° | 109.5° |
| C17 | C19 | N30 | 108.9° | 108.6° |
| C17 | C19 | H19 | 109.7° | 109.6° |
| C17 | C19 | H19A | 109.7° | 109.7° |
| H17 | C17 | H17A | 109.4° | 109.6° |
| C20 | C18 | N29 | 107.8° | 108.6° |
| C20 | C18 | H18 | 110.0° | 109.6° |
| C20 | C18 | H18A | 110.0° | 109.6° |
| C18 | C20 | N30 | 111.8° | 108.7° |
| C18 | C20 | H20 | 108.7° | 109.6° |
| C18 | C20 | H20A | 108.7° | 109.6° |
| N29 | C18 | H18 | 110.0° | 109.8° |
| N29 | C18 | H18A | 110.0° | 109.7° |
| H18 | C18 | H18A | 109.0° | 109.6° |
| N30 | C19 | H19 | 109.7° | 109.6° |
| N30 | C19 | H19A | 109.7° | 109.6° |
| C19 | N30 | C20 | 117.7° | 118.8° |
| H19 | C19 | H19A | 109.3° | 109.8° |
| N30 | C20 | H20 | 108.7° | 109.6° |
| N30 | C20 | H20A | 108.7° | 109.6° |
| H20 | C20 | H20A | 110.2° | 109.8° |
| H21 | C21 | H21A | 109.4° | 109.5° |
| H21 | C21 | H21B | 109.5° | 109.5° |
| H21A | C21 | H21B | 109.5° | 109.5° |
| O33 | C22 | H22 | 109.5° | 109.5° |
| O33 | C22 | H22A | 109.5° | 109.5° |
| O33 | C22 | H22B | 109.4° | 109.5° |
| H22 | C22 | H22A | 109.5° | 109.4° |
| H22 | C22 | H22B | 109.5° | 109.4° |
| H22A | C22 | H22B | 109.5° | 109.4° |
| H23 | C23 | H23A | 111.0° | 109.5° |
| N27 | N24 | HN24 | 128.0° | 126.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H1 | 180.0° | 179.7° |
| C1 | C2 | C11 | H2 | 180.0° | 180.0° |
| C2 | C1 | C6 | N28 | 2.0° | 0.3° |
| C2 | C1 | C6 | H6 | 178.0° | 179.7° |
| C1 | C2 | C11 | C14 | 173.4° | 180.0° |
| C1 | C2 | C11 | N28 | 1.1° | 0.3° |
| C6 | C1 | C2 | C11 | 1.9° | 0.0° |
| C6 | C1 | C2 | H2 | 178.1° | 180.0° |
| C1 | C6 | N28 | H6 | 180.0° | 180.0° |
| C1 | C6 | N28 | C11 | 1.3° | 0.5° |
| C1 | C6 | N28 | N26 | 173.8° | 180.0° |
| H1 | C1 | C2 | C11 | 178.1° | 179.7° |
| H1 | C1 | C2 | H2 | 1.9° | 0.2° |
| H1 | C1 | C6 | N28 | 178.0° | 180.0° |
| H1 | C1 | C6 | H6 | 2.0° | 0.0° |
| C2 | C11 | N28 | C6 | 0.1° | 0.5° |
| C2 | C11 | C14 | N28 | 174.1° | 179.7° |
| C2 | C11 | C14 | N31 | 4.0° | 0.0° |
| C2 | C11 | C14 | N25 | 176.1° | 180.0° |
| C2 | C11 | N28 | N26 | 175.2° | 179.9° |
| H2 | C2 | C11 | C14 | 6.6° | 0.0° |
| H2 | C2 | C11 | N28 | 178.9° | 179.7° |
| C9 | C3 | C8 | H3 | 180.0° | 179.7° |
| C9 | C3 | C8 | C4 | 2.1° | 0.3° |
| C3 | C9 | C7 | C23 | 178.5° | 179.7° |
| C3 | C9 | C7 | F34 | 177.7° | 179.9° |
| C3 | C9 | C7 | C10 | 0.8° | 0.6° |
| C9 | C3 | C8 | O33 | 179.9° | 179.8° |
| C3 | C8 | C4 | C10 | 0.6° | 0.0° |
| C3 | C8 | C4 | O33 | 178.1° | 179.9° |
| C3 | C8 | C4 | H4 | 179.4° | 179.9° |
| C8 | C3 | C9 | C7 | 2.2° | 0.0° |
| C8 | C3 | C9 | F34 | 180.0° | 180.0° |
| C3 | C8 | O33 | C22 | 36.8° | 180.0° |
| H3 | C3 | C8 | C4 | 177.9° | 180.0° |
| H3 | C3 | C9 | C7 | 177.8° | 179.7° |
| H3 | C3 | C8 | O33 | 0.1° | 0.1° |
| H3 | C3 | C9 | F34 | 0.0° | 0.3° |
| C10 | C4 | C8 | H4 | 180.0° | 180.0° |
| C4 | C10 | C7 | C23 | 177.0° | 180.0° |
| C4 | C10 | C7 | C9 | 0.7° | 0.9° |
| C4 | C10 | C7 | F35 | 179.2° | 179.1° |
| C10 | C4 | C8 | O33 | 178.7° | 180.0° |
| C8 | C4 | C10 | C7 | 0.8° | 0.6° |
| C8 | C4 | C10 | F35 | 180.0° | 179.7° |
| C4 | C8 | O33 | C22 | 145.2° | 0.0° |
| H4 | C4 | C10 | C7 | 179.2° | 179.5° |
| H4 | C4 | C8 | O33 | 1.3° | 0.0° |
| H4 | C4 | C10 | F35 | 0.0° | 0.4° |
| C13 | C5 | C12 | H5 | 180.0° | 179.8° |
| C13 | C5 | C12 | N27 | 3.4° | 0.2° |
| C13 | C5 | C12 | C21 | 178.1° | 179.8° |
| C5 | C13 | N24 | N31 | 175.3° | 179.9° |
| C5 | C13 | N31 | C14 | 1.4° | 8.7° |
| C5 | C13 | N24 | N27 | 0.9° | 0.1° |
| C5 | C13 | N31 | HN31 | 178.5° | 171.3° |
| C5 | C13 | N24 | HN24 | 179.1° | 179.9° |
| C5 | C12 | N27 | C21 | 175.5° | 180.0° |
| C12 | C5 | C13 | N24 | 2.8° | 0.2° |
| C12 | C5 | C13 | N31 | 177.9° | 179.7° |
| C5 | C12 | C21 | H21 | 174.1° | 90.0° |
| C5 | C12 | C21 | H21A | 66.0° | 150.0° |
| C5 | C12 | C21 | H21B | 54.0° | 30.0° |
| C5 | C12 | N27 | N24 | 3.2° | 0.1° |
| H5 | C5 | C12 | N27 | 176.6° | 180.0° |
| H5 | C5 | C12 | C21 | 1.9° | 0.1° |
| H5 | C5 | C13 | N24 | 177.2° | 180.0° |
| H5 | C5 | C13 | N31 | 2.1° | 0.1° |
| C6 | N28 | C11 | C14 | 175.6° | 179.8° |
| C6 | N28 | C11 | N26 | 175.3° | 179.6° |
| C6 | N28 | N26 | C15 | 177.0° | 179.2° |
| H6 | C6 | N28 | C11 | 178.7° | 179.5° |
| H6 | C6 | N28 | N26 | 6.2° | 0.0° |
| C23 | C7 | C9 | C10 | 177.7° | 179.1° |
| C23 | C7 | C9 | F34 | 3.8° | 0.3° |
| C23 | C7 | C10 | F35 | 2.2° | 0.9° |
| C7 | C23 | C16 | N30 | 70.2° | 180.0° |
| C7 | C23 | C16 | H23 | 120.0° | 119.9° |
| C7 | C23 | C16 | H23A | 120.0° | 120.0° |
| C7 | C23 | C16 | O32 | 108.1° | 0.0° |
| C7 | C23 | H23 | H23A | 118.0° | 120.0° |
| C9 | C7 | C10 | F35 | 179.9° | 180.0° |
| C9 | C7 | C23 | C16 | 136.5° | 90.9° |
| C9 | C7 | C23 | H23 | 16.5° | 29.1° |
| C9 | C7 | C23 | H23A | 103.4° | 149.1° |
| C10 | C7 | C9 | F34 | 178.5° | 179.4° |
| C10 | C7 | C23 | C16 | 45.8° | 90.1° |
| C10 | C7 | C23 | H23 | 165.8° | 150.0° |
| C10 | C7 | C23 | H23A | 74.2° | 30.0° |
| C8 | O33 | C22 | H22 | 180.0° | 180.0° |
| C8 | O33 | C22 | H22A | 60.0° | 60.0° |
| C8 | O33 | C22 | H22B | 60.0° | 60.0° |
| C11 | C14 | N31 | C13 | 174.7° | 174.1° |
| C11 | C14 | N31 | N25 | 179.9° | 179.9° |
| C11 | C14 | N25 | C15 | 2.1° | 0.0° |
| C14 | C11 | N28 | N26 | 0.2° | 0.2° |
| C11 | C14 | N31 | HN31 | 5.3° | 5.9° |
| N28 | C11 | C14 | N31 | 178.0° | 179.7° |
| N28 | C11 | C14 | N25 | 2.1° | 0.3° |
| C11 | N28 | N26 | C15 | 2.5° | 0.2° |
| C12 | N27 | N24 | C13 | 1.4° | 0.0° |
| N27 | C12 | C21 | H21 | 0.0° | 90.0° |
| N27 | C12 | C21 | H21A | 120.0° | 30.1° |
| N27 | C12 | C21 | H21B | 120.0° | 150.0° |
| C12 | N27 | N24 | HN24 | 178.6° | 179.8° |
| C12 | C21 | H21 | H21A | 120.0° | 120.0° |
| C12 | C21 | H21 | H21B | 120.0° | 120.0° |
| C12 | C21 | H21A | H21B | 120.0° | 119.9° |
| C21 | C12 | N27 | N24 | 178.7° | 179.8° |
| N24 | C13 | N31 | C14 | 176.0° | 171.2° |
| C13 | N24 | N27 | HN24 | 180.0° | 179.8° |
| N24 | C13 | N31 | HN31 | 4.0° | 8.8° |
| C13 | N31 | C14 | HN31 | 180.0° | 180.0° |
| C13 | N31 | C14 | N25 | 5.2° | 6.0° |
| N31 | C13 | N24 | N27 | 176.2° | 179.8° |
| N31 | C13 | N24 | HN24 | 3.8° | 0.0° |
| N31 | C14 | N25 | C15 | 178.0° | 180.0° |
| C14 | N25 | C15 | N26 | 0.3° | 0.5° |
| C14 | N25 | C15 | N29 | 176.2° | 180.0° |
| N25 | C14 | N31 | HN31 | 174.7° | 174.1° |
| N25 | C15 | N26 | N29 | 176.4° | 179.5° |
| N25 | C15 | N29 | C17 | 176.9° | 174.8° |
| N25 | C15 | N29 | C18 | 8.3° | 5.2° |
| N25 | C15 | N26 | N28 | 2.5° | 0.6° |
| N26 | C15 | N29 | C17 | 6.5° | 5.8° |
| N26 | C15 | N29 | C18 | 175.1° | 174.3° |
| C15 | N29 | C17 | C18 | 169.4° | 180.0° |
| C15 | N29 | C17 | C19 | 106.8° | 124.7° |
| C15 | N29 | C17 | H17 | 133.2° | 115.5° |
| C15 | N29 | C17 | H17A | 13.2° | 4.9° |
| C15 | N29 | C18 | C20 | 109.6° | 124.9° |
| C15 | N29 | C18 | H18 | 130.4° | 5.1° |
| C15 | N29 | C18 | H18A | 10.4° | 115.4° |
| N29 | C15 | N26 | N28 | 173.9° | 180.0° |
| N30 | C16 | C23 | O32 | 178.3° | 180.0° |
| C16 | N30 | C19 | C17 | 128.6° | 124.8° |
| C16 | N30 | C20 | C18 | 128.9° | 124.9° |
| C16 | N30 | C19 | C20 | 177.6° | 180.0° |
| C16 | N30 | C19 | H19 | 8.6° | 115.5° |
| C16 | N30 | C19 | H19A | 111.4° | 5.0° |
| C16 | N30 | C20 | H20 | 111.1° | 5.1° |
| C16 | N30 | C20 | H20A | 8.9° | 115.3° |
| N30 | C16 | C23 | H23 | 49.8° | 60.1° |
| N30 | C16 | C23 | H23A | 169.7° | 60.0° |
| C23 | C16 | N30 | C19 | 176.3° | 180.0° |
| C23 | C16 | N30 | C20 | 1.1° | 0.0° |
| C16 | C23 | H23 | H23A | 118.0° | 120.0° |
| O32 | C16 | N30 | C19 | 2.0° | 0.0° |
| O32 | C16 | N30 | C20 | 179.4° | 180.0° |
| O32 | C16 | C23 | H23 | 131.9° | 119.9° |
| O32 | C16 | C23 | H23A | 11.9° | 120.0° |
| N29 | C17 | C19 | H17 | 120.0° | 119.9° |
| N29 | C17 | C19 | H17A | 120.0° | 119.8° |
| N29 | C17 | H17 | H17A | 120.0° | 120.4° |
| C17 | N29 | C18 | C20 | 59.9° | 55.1° |
| C17 | N29 | C18 | H18 | 60.1° | 174.9° |
| C17 | N29 | C18 | H18A | 179.8° | 64.6° |
| N29 | C17 | C19 | N30 | 52.7° | 49.5° |
| N29 | C17 | C19 | H19 | 172.7° | 70.2° |
| N29 | C17 | C19 | H19A | 67.3° | 169.2° |
| C19 | C17 | H17 | H17A | 120.1° | 120.2° |
| C19 | C17 | N29 | C18 | 62.6° | 55.3° |
| C17 | C19 | N30 | H19 | 120.0° | 119.7° |
| C17 | C19 | N30 | H19A | 120.0° | 119.8° |
| C17 | C19 | H19 | H19A | 120.3° | 120.5° |
| C17 | C19 | N30 | C20 | 49.0° | 55.2° |
| H17 | C17 | N29 | C18 | 57.4° | 64.5° |
| H17 | C17 | C19 | N30 | 67.3° | 70.4° |
| H17 | C17 | C19 | H19 | 52.7° | 169.9° |
| H17 | C17 | C19 | H19A | 172.7° | 49.3° |
| H17A | C17 | N29 | C18 | 177.4° | 175.1° |
| H17A | C17 | C19 | N30 | 172.6° | 169.3° |
| H17A | C17 | C19 | H19 | 67.4° | 49.6° |
| H17A | C17 | C19 | H19A | 52.6° | 70.9° |
| C20 | C18 | N29 | H18 | 120.0° | 119.8° |
| C20 | C18 | N29 | H18A | 120.0° | 119.7° |
| C20 | C18 | H18 | H18A | 120.7° | 120.3° |
| C18 | C20 | N30 | C19 | 48.5° | 55.1° |
| C18 | C20 | N30 | H20 | 120.0° | 119.8° |
| C18 | C20 | N30 | H20A | 120.0° | 119.8° |
| C18 | C20 | H20 | H20A | 119.0° | 120.4° |
| N29 | C18 | H18 | H18A | 120.7° | 120.5° |
| N29 | C18 | C20 | N30 | 49.7° | 49.3° |
| N29 | C18 | C20 | H20 | 70.2° | 169.0° |
| N29 | C18 | C20 | H20A | 169.8° | 70.4° |
| H18 | C18 | C20 | N30 | 70.2° | 169.2° |
| H18 | C18 | C20 | H20 | 169.8° | 71.1° |
| H18 | C18 | C20 | H20A | 49.8° | 49.4° |
| H18A | C18 | C20 | N30 | 169.7° | 70.5° |
| H18A | C18 | C20 | H20 | 49.7° | 49.3° |
| H18A | C18 | C20 | H20A | 70.3° | 169.8° |
| N30 | C19 | H19 | H19A | 120.2° | 120.4° |
| C19 | N30 | C20 | H20 | 71.5° | 174.9° |
| C19 | N30 | C20 | H20A | 168.5° | 64.6° |
| H19 | C19 | N30 | C20 | 169.0° | 64.5° |
| H19A | C19 | N30 | C20 | 71.0° | 175.0° |
| N30 | C20 | H20 | H20A | 119.0° | 120.4° |
| H21 | C21 | H21A | H21B | 120.0° | 120.1° |
| O33 | C22 | H22 | H22A | 120.0° | 120.0° |
| O33 | C22 | H22 | H22B | 120.0° | 120.1° |
| O33 | C22 | H22A | H22B | 120.0° | 120.1° |
| H22 | C22 | H22A | H22B | 120.0° | 119.9° |
