618
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | C5 | doub | 1.23Å | 1.22Å | |
| C5 | N7 | sing | 1.39Å | 1.34Å | |
| C5 | C3 | sing | 1.52Å | 1.55Å | |
| C3 | N2 | sing | 1.44Å | 1.49Å | |
| C3 | C4 | sing | 1.52Å | 1.54Å | |
| C3 | H3 | sing | 1.10Å | 1.10Å | |
| N2 | C1 | sing | 1.46Å | 1.48Å | |
| N2 | HN2 | sing | 1.03Å | 1.00Å | |
| C1 | H11A | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13A | sing | 1.09Å | 1.10Å | |
| C4 | H41 | sing | 1.10Å | 1.10Å | |
| C4 | H42 | sing | 1.10Å | 1.10Å | |
| C4 | H43 | sing | 1.09Å | 1.10Å | |
| N7 | C8 | sing | 1.44Å | 1.49Å | |
| N7 | HN7 | sing | 1.02Å | 1.00Å | |
| C8 | C14 | sing | 1.50Å | 1.54Å | |
| C8 | C9 | sing | 1.53Å | 1.56Å | |
| C8 | H8 | sing | 1.10Å | 1.10Å | |
| C9 | N10 | sing | 1.39Å | 1.37Å | |
| C9 | O15 | doub | 1.24Å | 1.23Å | |
| C14 | C13 | doub | 1.34Å | 1.54Å | |
| C14 | H14 | sing | 1.09Å | 1.08Å | |
| C13 | C12 | sing | 1.50Å | 1.55Å | |
| C13 | H13 | sing | 1.09Å | 1.08Å | |
| C12 | C11 | sing | 1.53Å | 1.54Å | |
| C12 | H121 | sing | 1.10Å | 1.10Å | |
| C12 | H122 | sing | 1.10Å | 1.10Å | |
| C11 | S16 | sing | 1.81Å | 1.80Å | |
| C11 | N10 | sing | 1.46Å | 1.48Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| N10 | C18 | sing | 1.47Å | 1.50Å | |
| S16 | C17 | sing | 1.82Å | 1.80Å | |
| C17 | C19 | sing | 1.53Å | 1.54Å | |
| C17 | C20 | sing | 1.54Å | 1.55Å | |
| C17 | C18 | sing | 1.55Å | 1.55Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H193 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.10Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H203 | sing | 1.09Å | 1.10Å | |
| C18 | C21 | sing | 1.50Å | 1.57Å | |
| C18 | H18 | sing | 1.10Å | 1.10Å | |
| C21 | O22 | doub | 1.23Å | 1.23Å | |
| C21 | N23 | sing | 1.39Å | 1.34Å | |
| N23 | C24 | sing | 1.41Å | 1.46Å | |
| N23 | HN23 | sing | 1.02Å | 1.00Å | |
| C24 | C25 | doub | 1.34Å | 1.38Å | Aromatic |
| C24 | N28 | sing | 1.34Å | 1.42Å | Aromatic |
| C25 | C26 | sing | 1.41Å | 1.39Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | C29 | sing | 1.47Å | 1.52Å | |
| C26 | N27 | doub | 1.34Å | 1.37Å | Aromatic |
| C29 | H291 | sing | 1.10Å | 1.10Å | |
| C29 | H292 | sing | 1.10Å | 1.10Å | |
| C29 | H293 | sing | 1.11Å | 1.10Å | |
| N27 | N28 | sing | 1.34Å | 1.36Å | Aromatic |
| N28 | C30 | sing | 1.40Å | 1.29Å | Aromatic |
| C30 | C35 | doub | 1.39Å | 1.42Å | Aromatic |
| C30 | C31 | sing | 1.39Å | 1.42Å | Aromatic |
| C31 | C32 | doub | 1.40Å | 1.39Å | Aromatic |
| C31 | H31 | sing | 1.09Å | 1.08Å | |
| C32 | C33 | sing | 1.39Å | 1.39Å | Aromatic |
| C32 | H32 | sing | 1.09Å | 1.08Å | |
| C33 | C34 | doub | 1.40Å | 1.40Å | Aromatic |
| C33 | H33 | sing | 1.09Å | 1.08Å | |
| C34 | C35 | sing | 1.39Å | 1.39Å | Aromatic |
| C34 | H34 | sing | 1.09Å | 1.08Å | |
| C35 | H35 | sing | 1.09Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | C5 | N7 | 124.6° | 124.5° |
| O6 | C5 | C3 | 119.4° | 123.1° |
| N7 | C5 | C3 | 116.0° | 112.4° |
| C5 | N7 | C8 | 129.8° | 123.0° |
| C5 | N7 | HN7 | 115.1° | 118.7° |
| C5 | C3 | N2 | 113.2° | 108.0° |
| C5 | C3 | C4 | 112.9° | 111.0° |
| C5 | C3 | H3 | 104.7° | 109.5° |
| N2 | C3 | C4 | 110.5° | 111.3° |
| N2 | C3 | H3 | 107.4° | 106.8° |
| C3 | N2 | C1 | 114.5° | 111.6° |
| C3 | N2 | HN2 | 107.8° | 110.1° |
| C4 | C3 | H3 | 107.7° | 110.1° |
| C3 | C4 | H41 | 109.5° | 111.2° |
| C3 | C4 | H42 | 109.5° | 111.2° |
| C3 | C4 | H43 | 109.4° | 110.9° |
| C1 | N2 | HN2 | 107.8° | 108.4° |
| N2 | C1 | H11A | 109.5° | 110.1° |
| N2 | C1 | H12 | 109.5° | 110.2° |
| N2 | C1 | H13A | 109.5° | 110.3° |
| H11A | C1 | H12 | 109.4° | 108.7° |
| H11A | C1 | H13A | 109.5° | 108.8° |
| H12 | C1 | H13A | 109.5° | 108.7° |
| H41 | C4 | H42 | 109.4° | 107.6° |
| H41 | C4 | H43 | 109.5° | 107.7° |
| H42 | C4 | H43 | 109.5° | 108.2° |
| C8 | N7 | HN7 | 115.1° | 118.3° |
| N7 | C8 | C14 | 114.5° | 111.0° |
| N7 | C8 | C9 | 103.3° | 109.9° |
| N7 | C8 | H8 | 114.8° | 105.2° |
| C14 | C8 | C9 | 119.6° | 118.2° |
| C14 | C8 | H8 | 96.2° | 106.2° |
| C8 | C14 | C13 | 117.7° | 129.6° |
| C8 | C14 | H14 | 121.1° | 114.4° |
| C9 | C8 | H8 | 108.9° | 105.3° |
| C8 | C9 | N10 | 128.0° | 118.3° |
| C8 | C9 | O15 | 113.9° | 118.7° |
| N10 | C9 | O15 | 118.1° | 123.0° |
| C9 | N10 | C11 | 126.2° | 122.5° |
| C9 | N10 | C18 | 119.0° | 120.6° |
| C13 | C14 | H14 | 121.1° | 115.9° |
| C14 | C13 | C12 | 118.0° | 128.7° |
| C14 | C13 | H13 | 121.0° | 116.8° |
| C12 | C13 | H13 | 121.0° | 114.5° |
| C13 | C12 | C11 | 118.1° | 114.7° |
| C13 | C12 | H121 | 106.7° | 107.1° |
| C13 | C12 | H122 | 104.7° | 107.7° |
| C11 | C12 | H121 | 106.7° | 109.2° |
| C11 | C12 | H122 | 104.7° | 110.7° |
| C12 | C11 | S16 | 107.1° | 111.5° |
| C12 | C11 | N10 | 115.3° | 111.8° |
| C12 | C11 | H11 | 105.7° | 110.3° |
| H121 | C12 | H122 | 116.5° | 107.0° |
| S16 | C11 | N10 | 104.3° | 107.3° |
| S16 | C11 | H11 | 116.5° | 106.2° |
| C11 | S16 | C17 | 95.7° | 94.7° |
| N10 | C11 | H11 | 108.5° | 109.6° |
| C11 | N10 | C18 | 114.7° | 115.3° |
| N10 | C18 | C17 | 108.1° | 111.6° |
| N10 | C18 | C21 | 106.4° | 107.8° |
| N10 | C18 | H18 | 114.9° | 107.2° |
| S16 | C17 | C19 | 110.8° | 108.9° |
| S16 | C17 | C20 | 110.7° | 107.7° |
| S16 | C17 | C18 | 100.3° | 104.2° |
| C19 | C17 | C20 | 106.1° | 109.4° |
| C19 | C17 | C18 | 115.7° | 110.7° |
| C17 | C19 | H191 | 109.5° | 110.6° |
| C17 | C19 | H192 | 109.5° | 110.5° |
| C17 | C19 | H193 | 109.5° | 110.5° |
| C20 | C17 | C18 | 113.2° | 115.5° |
| C17 | C20 | H201 | 109.5° | 110.5° |
| C17 | C20 | H202 | 109.5° | 110.7° |
| C17 | C20 | H203 | 109.5° | 110.6° |
| C17 | C18 | C21 | 116.1° | 111.3° |
| C17 | C18 | H18 | 105.0° | 111.5° |
| H191 | C19 | H192 | 109.5° | 108.4° |
| H191 | C19 | H193 | 109.4° | 108.3° |
| H192 | C19 | H193 | 109.5° | 108.4° |
| H201 | C20 | H202 | 109.4° | 108.3° |
| H201 | C20 | H203 | 109.5° | 108.3° |
| H202 | C20 | H203 | 109.5° | 108.3° |
| C21 | C18 | H18 | 106.7° | 107.3° |
| C18 | C21 | O22 | 120.7° | 120.8° |
| C18 | C21 | N23 | 115.2° | 111.1° |
| O22 | C21 | N23 | 124.1° | 128.1° |
| C21 | N23 | C24 | 130.4° | 127.5° |
| C21 | N23 | HN23 | 114.8° | 117.1° |
| C24 | N23 | HN23 | 114.8° | 115.4° |
| N23 | C24 | C25 | 123.1° | 128.8° |
| N23 | C24 | N28 | 129.3° | 122.3° |
| C25 | C24 | N28 | 107.6° | 108.9° |
| C24 | C25 | C26 | 107.1° | 103.0° |
| C24 | C25 | H25 | 126.4° | 128.5° |
| C24 | N28 | N27 | 107.8° | 112.2° |
| C24 | N28 | C30 | 128.7° | 128.1° |
| C26 | C25 | H25 | 126.4° | 128.4° |
| C25 | C26 | C29 | 127.7° | 127.5° |
| C25 | C26 | N27 | 109.1° | 112.7° |
| C29 | C26 | N27 | 123.2° | 119.8° |
| C26 | C29 | H291 | 109.5° | 111.3° |
| C26 | C29 | H292 | 109.5° | 112.2° |
| C26 | C29 | H293 | 109.5° | 112.2° |
| C26 | N27 | N28 | 108.4° | 103.1° |
| H291 | C29 | H292 | 109.4° | 107.5° |
| H291 | C29 | H293 | 109.4° | 107.5° |
| H292 | C29 | H293 | 109.5° | 105.8° |
| N27 | N28 | C30 | 123.6° | 119.7° |
| N28 | C30 | C35 | 121.6° | 119.6° |
| N28 | C30 | C31 | 119.4° | 119.5° |
| C35 | C30 | C31 | 118.9° | 120.9° |
| C30 | C35 | C34 | 119.4° | 119.6° |
| C30 | C35 | H35 | 120.3° | 121.2° |
| C30 | C31 | C32 | 120.9° | 119.5° |
| C30 | C31 | H31 | 119.6° | 121.2° |
| C32 | C31 | H31 | 119.6° | 119.3° |
| C31 | C32 | C33 | 119.4° | 120.0° |
| C31 | C32 | H32 | 120.3° | 120.0° |
| C33 | C32 | H32 | 120.3° | 120.0° |
| C32 | C33 | C34 | 120.4° | 120.0° |
| C32 | C33 | H33 | 119.8° | 120.1° |
| C34 | C33 | H33 | 119.8° | 120.0° |
| C33 | C34 | C35 | 121.0° | 120.0° |
| C33 | C34 | H34 | 119.5° | 119.9° |
| C35 | C34 | H34 | 119.5° | 120.1° |
| C34 | C35 | H35 | 120.3° | 119.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | C5 | N7 | C3 | 177.5° | 178.0° |
| O6 | C5 | C3 | N2 | 9.9° | 34.1° |
| O6 | C5 | C3 | C4 | 116.6° | 88.2° |
| O6 | C5 | C3 | H3 | 126.5° | 150.0° |
| O6 | C5 | N7 | C8 | 44.3° | 0.0° |
| O6 | C5 | N7 | HN7 | 135.7° | 177.5° |
| N7 | C5 | C3 | N2 | 172.5° | 147.9° |
| N7 | C5 | C3 | C4 | 61.0° | 89.9° |
| N7 | C5 | C3 | H3 | 55.9° | 31.9° |
| C5 | N7 | C8 | HN7 | 180.0° | 177.5° |
| C5 | N7 | C8 | C14 | 17.7° | 144.5° |
| C5 | N7 | C8 | C9 | 149.4° | 82.8° |
| C5 | N7 | C8 | H8 | 92.2° | 30.1° |
| C5 | C3 | N2 | C4 | 127.8° | 122.0° |
| C5 | C3 | N2 | H3 | 115.0° | 117.7° |
| C5 | C3 | C4 | H3 | 115.1° | 121.5° |
| C5 | C3 | N2 | C1 | 67.0° | 179.6° |
| C5 | C3 | N2 | HN2 | 173.0° | 60.0° |
| C5 | C3 | C4 | H41 | 146.0° | 58.0° |
| C5 | C3 | C4 | H42 | 94.1° | 61.9° |
| C5 | C3 | C4 | H43 | 25.9° | 177.7° |
| C3 | C5 | N7 | C8 | 138.2° | 178.0° |
| C3 | C5 | N7 | HN7 | 41.8° | 4.5° |
| N2 | C3 | C4 | H3 | 117.0° | 118.3° |
| C3 | N2 | C1 | HN2 | 120.0° | 121.4° |
| C3 | N2 | C1 | H11A | 91.2° | 94.6° |
| C3 | N2 | C1 | H12 | 148.9° | 145.5° |
| C3 | N2 | C1 | H13A | 28.9° | 25.5° |
| N2 | C3 | C4 | H41 | 86.1° | 62.3° |
| N2 | C3 | C4 | H42 | 33.8° | 177.8° |
| N2 | C3 | C4 | H43 | 153.8° | 57.5° |
| C4 | C3 | N2 | C1 | 165.3° | 58.4° |
| C4 | C3 | N2 | HN2 | 45.3° | 62.0° |
| C3 | C4 | H41 | H42 | 120.0° | 122.0° |
| C3 | C4 | H41 | H43 | 120.0° | 121.6° |
| C3 | C4 | H42 | H43 | 120.0° | 122.0° |
| H3 | C3 | N2 | C1 | 48.1° | 61.9° |
| H3 | C3 | N2 | HN2 | 71.9° | 177.7° |
| H3 | C3 | C4 | H41 | 30.9° | 179.4° |
| H3 | C3 | C4 | H42 | 150.9° | 59.6° |
| H3 | C3 | C4 | H43 | 89.1° | 60.8° |
| N2 | C1 | H11A | H12 | 120.0° | 120.8° |
| N2 | C1 | H11A | H13A | 120.0° | 120.9° |
| N2 | C1 | H12 | H13A | 120.0° | 121.0° |
| HN2 | N2 | C1 | H11A | 148.8° | 26.9° |
| HN2 | N2 | C1 | H12 | 28.8° | 93.1° |
| HN2 | N2 | C1 | H13A | 91.2° | 146.9° |
| H11A | C1 | H12 | H13A | 120.0° | 118.3° |
| H41 | C4 | H42 | H43 | 120.0° | 116.0° |
| N7 | C8 | C14 | C9 | 123.2° | 128.3° |
| N7 | C8 | C14 | H8 | 120.8° | 113.8° |
| N7 | C8 | C9 | H8 | 122.4° | 112.8° |
| N7 | C8 | C9 | N10 | 132.5° | 82.3° |
| N7 | C8 | C9 | O15 | 50.1° | 95.4° |
| N7 | C8 | C14 | C13 | 177.3° | 90.6° |
| N7 | C8 | C14 | H14 | 2.7° | 90.7° |
| HN7 | N7 | C8 | C14 | 162.3° | 38.0° |
| HN7 | N7 | C8 | C9 | 30.6° | 94.6° |
| HN7 | N7 | C8 | H8 | 87.8° | 152.5° |
| C14 | C8 | C9 | H8 | 109.1° | 118.3° |
| C14 | C8 | C9 | N10 | 3.9° | 46.6° |
| C14 | C8 | C9 | O15 | 178.6° | 135.7° |
| C8 | C14 | C13 | H14 | 180.0° | 178.7° |
| C8 | C14 | C13 | C12 | 63.7° | 2.7° |
| C8 | C14 | C13 | H13 | 116.3° | 178.3° |
| C8 | C9 | N10 | O15 | 177.4° | 177.6° |
| C9 | C8 | C14 | C13 | 54.0° | 37.7° |
| C9 | C8 | C14 | H14 | 126.0° | 141.0° |
| C8 | C9 | N10 | C11 | 6.8° | 14.3° |
| C8 | C9 | N10 | C18 | 171.6° | 179.2° |
| H8 | C8 | C9 | N10 | 105.1° | 164.9° |
| H8 | C8 | C9 | O15 | 72.3° | 17.4° |
| H8 | C8 | C14 | C13 | 61.9° | 155.5° |
| H8 | C8 | C14 | H14 | 118.1° | 23.2° |
| C9 | N10 | C11 | C12 | 58.4° | 80.4° |
| C9 | N10 | C11 | S16 | 175.4° | 157.0° |
| C9 | N10 | C11 | C18 | 178.4° | 165.6° |
| C9 | N10 | C11 | H11 | 59.9° | 42.1° |
| C9 | N10 | C18 | C17 | 156.5° | 176.0° |
| C9 | N10 | C18 | C21 | 78.2° | 61.5° |
| C9 | N10 | C18 | H18 | 39.6° | 53.7° |
| O15 | C9 | N10 | C11 | 175.9° | 163.2° |
| O15 | C9 | N10 | C18 | 5.7° | 1.6° |
| C14 | C13 | C12 | H13 | 180.0° | 179.0° |
| C14 | C13 | C12 | C11 | 1.6° | 9.5° |
| C14 | C13 | C12 | H121 | 121.6° | 130.9° |
| C14 | C13 | C12 | H122 | 114.3° | 114.3° |
| H14 | C14 | C13 | C12 | 116.3° | 178.6° |
| H14 | C14 | C13 | H13 | 63.7° | 0.4° |
| C13 | C12 | C11 | H121 | 120.0° | 120.3° |
| C13 | C12 | C11 | H122 | 115.9° | 122.1° |
| C13 | C12 | H121 | H122 | 116.5° | 115.2° |
| C13 | C12 | C11 | S16 | 178.0° | 175.4° |
| C13 | C12 | C11 | N10 | 66.6° | 64.4° |
| C13 | C12 | C11 | H11 | 53.2° | 57.7° |
| H13 | C13 | C12 | C11 | 178.4° | 169.6° |
| H13 | C13 | C12 | H121 | 58.4° | 48.1° |
| H13 | C13 | C12 | H122 | 65.7° | 66.7° |
| C11 | C12 | H121 | H122 | 116.5° | 119.9° |
| C12 | C11 | S16 | N10 | 122.6° | 122.7° |
| C12 | C11 | S16 | H11 | 118.0° | 120.1° |
| C12 | C11 | N10 | H11 | 118.2° | 122.6° |
| C12 | C11 | N10 | C18 | 120.1° | 114.0° |
| C12 | C11 | S16 | C17 | 147.2° | 103.0° |
| H121 | C12 | C11 | S16 | 58.0° | 55.1° |
| H121 | C12 | C11 | N10 | 173.4° | 175.3° |
| H121 | C12 | C11 | H11 | 66.8° | 62.5° |
| H122 | C12 | C11 | S16 | 66.1° | 62.5° |
| H122 | C12 | C11 | N10 | 49.4° | 57.7° |
| H122 | C12 | C11 | H11 | 169.1° | 179.9° |
| S16 | C11 | N10 | H11 | 124.7° | 114.9° |
| S16 | C11 | N10 | C18 | 3.0° | 8.5° |
| C11 | S16 | C17 | C19 | 159.9° | 142.6° |
| C11 | S16 | C17 | C20 | 82.6° | 98.8° |
| C11 | S16 | C17 | C18 | 37.2° | 24.4° |
| N10 | C11 | S16 | C17 | 24.6° | 19.8° |
| C11 | N10 | C18 | C17 | 25.0° | 10.1° |
| C11 | N10 | C18 | C21 | 100.4° | 132.6° |
| C11 | N10 | C18 | H18 | 141.8° | 112.2° |
| H11 | C11 | N10 | C18 | 121.7° | 123.4° |
| H11 | C11 | S16 | C17 | 94.8° | 136.9° |
| N10 | C18 | C17 | S16 | 39.6° | 23.3° |
| N10 | C18 | C17 | C19 | 158.8° | 140.3° |
| N10 | C18 | C17 | C20 | 78.4° | 94.7° |
| N10 | C18 | C17 | C21 | 119.4° | 120.5° |
| N10 | C18 | C17 | H18 | 123.1° | 119.8° |
| N10 | C18 | C21 | H18 | 123.1° | 115.1° |
| N10 | C18 | C21 | O22 | 31.1° | 34.9° |
| N10 | C18 | C21 | N23 | 150.0° | 145.3° |
| S16 | C17 | C19 | C20 | 120.3° | 117.5° |
| S16 | C17 | C19 | C18 | 113.3° | 114.1° |
| S16 | C17 | C20 | C18 | 111.7° | 116.0° |
| S16 | C17 | C19 | H191 | 160.3° | 156.8° |
| S16 | C17 | C19 | H192 | 79.7° | 36.8° |
| S16 | C17 | C19 | H193 | 40.3° | 83.2° |
| S16 | C17 | C20 | H201 | 150.8° | 71.0° |
| S16 | C17 | C20 | H202 | 30.8° | 169.0° |
| S16 | C17 | C20 | H203 | 89.2° | 48.9° |
| S16 | C17 | C18 | C21 | 79.8° | 143.8° |
| S16 | C17 | C18 | H18 | 162.7° | 96.5° |
| C19 | C17 | C20 | C18 | 127.9° | 125.7° |
| C17 | C19 | H191 | H192 | 120.0° | 121.3° |
| C17 | C19 | H191 | H193 | 120.0° | 121.3° |
| C17 | C19 | H192 | H193 | 120.0° | 121.3° |
| C19 | C17 | C20 | H201 | 88.9° | 170.7° |
| C19 | C17 | C20 | H202 | 151.2° | 50.7° |
| C19 | C17 | C20 | H203 | 31.1° | 69.4° |
| C19 | C17 | C18 | C21 | 39.4° | 99.2° |
| C19 | C17 | C18 | H18 | 78.1° | 20.5° |
| C20 | C17 | C19 | H191 | 79.4° | 85.7° |
| C20 | C17 | C19 | H192 | 40.6° | 154.3° |
| C20 | C17 | C19 | H193 | 160.6° | 34.3° |
| C17 | C20 | H201 | H202 | 120.0° | 121.4° |
| C17 | C20 | H201 | H203 | 120.0° | 121.3° |
| C17 | C20 | H202 | H203 | 120.0° | 121.4° |
| C20 | C17 | C18 | C21 | 162.2° | 25.8° |
| C20 | C17 | C18 | H18 | 44.7° | 145.5° |
| C18 | C17 | C19 | H191 | 47.0° | 42.7° |
| C18 | C17 | C19 | H192 | 167.0° | 77.3° |
| C18 | C17 | C19 | H193 | 72.9° | 162.7° |
| C18 | C17 | C20 | H201 | 39.0° | 45.0° |
| C18 | C17 | C20 | H202 | 80.9° | 75.0° |
| C18 | C17 | C20 | H203 | 159.1° | 164.9° |
| C17 | C18 | C21 | H18 | 116.6° | 122.2° |
| C17 | C18 | C21 | O22 | 89.1° | 87.8° |
| C17 | C18 | C21 | N23 | 89.7° | 92.1° |
| H191 | C19 | H192 | H193 | 120.0° | 117.3° |
| H201 | C20 | H202 | H203 | 120.0° | 117.3° |
| C18 | C21 | O22 | N23 | 178.8° | 179.9° |
| C18 | C21 | N23 | C24 | 162.9° | 179.9° |
| C18 | C21 | N23 | HN23 | 17.1° | 0.1° |
| H18 | C18 | C21 | O22 | 154.3° | 150.0° |
| H18 | C18 | C21 | N23 | 26.9° | 30.1° |
| O22 | C21 | N23 | C24 | 15.9° | 0.1° |
| O22 | C21 | N23 | HN23 | 164.1° | 179.8° |
| C21 | N23 | C24 | HN23 | 180.0° | 179.9° |
| C21 | N23 | C24 | C25 | 22.8° | 29.9° |
| C21 | N23 | C24 | N28 | 157.2° | 150.1° |
| N23 | C24 | C25 | N28 | 179.9° | 180.0° |
| N23 | C24 | C25 | C26 | 179.9° | 179.9° |
| N23 | C24 | C25 | H25 | 0.1° | 0.1° |
| N23 | C24 | N28 | N27 | 179.9° | 179.9° |
| N23 | C24 | N28 | C30 | 0.3° | 0.1° |
| HN23 | N23 | C24 | C25 | 157.2° | 150.0° |
| HN23 | N23 | C24 | N28 | 22.8° | 30.0° |
| C24 | C25 | C26 | H25 | 180.0° | 179.9° |
| C24 | C25 | C26 | C29 | 180.0° | 179.9° |
| C24 | C25 | C26 | N27 | 0.3° | 0.0° |
| C25 | C24 | N28 | N27 | 0.2° | 0.0° |
| C25 | C24 | N28 | C30 | 179.7° | 179.9° |
| N28 | C24 | C25 | C26 | 0.1° | 0.0° |
| N28 | C24 | C25 | H25 | 180.0° | 179.9° |
| C24 | N28 | N27 | C26 | 0.4° | 0.0° |
| C24 | N28 | N27 | C30 | 179.9° | 179.8° |
| C24 | N28 | C30 | C35 | 42.4° | 150.0° |
| C24 | N28 | C30 | C31 | 138.1° | 30.1° |
| C25 | C26 | C29 | N27 | 179.7° | 179.9° |
| C25 | C26 | C29 | H291 | 179.3° | 64.2° |
| C25 | C26 | C29 | H292 | 60.8° | 56.3° |
| C25 | C26 | C29 | H293 | 59.3° | 175.3° |
| C25 | C26 | N27 | N28 | 0.4° | 0.0° |
| H25 | C25 | C26 | C29 | 0.0° | 0.0° |
| H25 | C25 | C26 | N27 | 179.7° | 179.9° |
| C26 | C29 | H291 | H292 | 120.0° | 123.3° |
| C26 | C29 | H291 | H293 | 120.0° | 123.2° |
| C26 | C29 | H292 | H293 | 120.0° | 122.7° |
| C29 | C26 | N27 | N28 | 179.9° | 179.9° |
| N27 | C26 | C29 | H291 | 0.4° | 115.9° |
| N27 | C26 | C29 | H292 | 119.6° | 123.6° |
| N27 | C26 | C29 | H293 | 120.4° | 4.6° |
| C26 | N27 | N28 | C30 | 179.5° | 179.9° |
| H291 | C29 | H292 | H293 | 119.9° | 114.6° |
| N27 | N28 | C30 | C35 | 137.7° | 29.8° |
| N27 | N28 | C30 | C31 | 41.7° | 150.1° |
| N28 | C30 | C35 | C31 | 179.4° | 179.9° |
| N28 | C30 | C31 | C32 | 179.5° | 179.9° |
| N28 | C30 | C31 | H31 | 0.5° | 0.1° |
| N28 | C30 | C35 | C34 | 179.4° | 180.0° |
| N28 | C30 | C35 | H35 | 0.6° | 0.1° |
| C35 | C30 | C31 | C32 | 0.0° | 0.0° |
| C35 | C30 | C31 | H31 | 180.0° | 180.0° |
| C30 | C35 | C34 | C33 | 0.0° | 0.0° |
| C30 | C35 | C34 | H35 | 180.0° | 180.0° |
| C30 | C35 | C34 | H34 | 180.0° | 179.9° |
| C30 | C31 | C32 | H31 | 180.0° | 180.0° |
| C30 | C31 | C32 | C33 | 0.0° | 0.0° |
| C30 | C31 | C32 | H32 | 179.9° | 180.0° |
| C31 | C30 | C35 | C34 | 0.0° | 0.1° |
| C31 | C30 | C35 | H35 | 180.0° | 180.0° |
| C31 | C32 | C33 | H32 | 180.0° | 180.0° |
| C31 | C32 | C33 | C34 | 0.0° | 0.0° |
| C31 | C32 | C33 | H33 | 180.0° | 180.0° |
| H31 | C31 | C32 | C33 | 179.9° | 180.0° |
| H31 | C31 | C32 | H32 | 0.1° | 0.0° |
| C32 | C33 | C34 | H33 | 180.0° | 180.0° |
| C32 | C33 | C34 | C35 | 0.0° | 0.0° |
| C32 | C33 | C34 | H34 | 180.0° | 180.0° |
| H32 | C32 | C33 | C34 | 180.0° | 180.0° |
| H32 | C32 | C33 | H33 | 0.1° | 0.0° |
| C33 | C34 | C35 | H34 | 180.0° | 180.0° |
| C33 | C34 | C35 | H35 | 180.0° | 180.0° |
| H33 | C33 | C34 | C35 | 180.0° | 180.0° |
| H33 | C33 | C34 | H34 | 0.0° | 0.0° |
| H34 | C34 | C35 | H35 | 0.0° | 0.0° |
