474
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.56Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | C5 | sing | 1.51Å | 1.41Å | |
| C1 | C32 | sing | 1.53Å | 1.61Å | |
| C2 | N6 | sing | 1.47Å | 1.47Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | C3 | sing | 1.51Å | 1.55Å | |
| C3 | O7 | doub | 1.21Å | 1.22Å | |
| C3 | N4 | sing | 1.35Å | 1.37Å | |
| N4 | C21 | sing | 1.47Å | 1.46Å | |
| N4 | C18 | sing | 1.47Å | 1.48Å | |
| C5 | O8 | doub | 1.21Å | 1.24Å | |
| C5 | N9 | sing | 1.35Å | 1.40Å | |
| N6 | HN61 | sing | 1.01Å | 1.00Å | |
| N6 | HN62 | sing | 1.01Å | 1.00Å | |
| N9 | C10 | sing | 1.46Å | 1.48Å | |
| N9 | C14 | sing | 1.47Å | 1.48Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H103 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H143 | sing | 1.09Å | 1.10Å | |
| C18 | C19 | sing | 1.55Å | 1.51Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C19 | C20 | sing | 1.55Å | 1.50Å | |
| C19 | F62 | sing | 1.40Å | 1.33Å | |
| C19 | F28 | sing | 1.40Å | 1.35Å | |
| C20 | C21 | sing | 1.54Å | 1.53Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C29 | C30 | sing | 1.53Å | 1.55Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | C51 | sing | 1.51Å | 1.55Å | |
| C29 | C34 | sing | 1.53Å | 1.57Å | |
| C30 | C31 | sing | 1.53Å | 1.52Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C31 | C32 | sing | 1.53Å | 1.56Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | C33 | sing | 1.53Å | 1.59Å | |
| C33 | C34 | sing | 1.53Å | 1.56Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| C48 | N53 | sing | 1.37Å | 1.36Å | Aromatic |
| C48 | N56 | doub | 1.33Å | 1.34Å | Aromatic |
| C48 | C49 | sing | 1.41Å | 1.49Å | Aromatic |
| C49 | H49 | sing | 1.08Å | 1.08Å | |
| C49 | C50 | doub | 1.36Å | 1.37Å | Aromatic |
| C50 | C51 | sing | 1.40Å | 1.51Å | Aromatic |
| C50 | H50 | sing | 1.08Å | 1.08Å | |
| C51 | C52 | doub | 1.35Å | 1.37Å | Aromatic |
| C52 | H52 | sing | 1.08Å | 1.08Å | |
| C52 | N53 | sing | 1.36Å | 1.50Å | Aromatic |
| N53 | N54 | sing | 1.40Å | 1.25Å | Aromatic |
| N54 | C55 | doub | 1.31Å | 1.35Å | Aromatic |
| C55 | N56 | sing | 1.32Å | 1.36Å | Aromatic |
| C55 | H55 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | H1 | 103.8° | 109.4° |
| C2 | C1 | C5 | 113.4° | 109.5° |
| C2 | C1 | C32 | 113.3° | 109.5° |
| C1 | C2 | N6 | 113.7° | 109.5° |
| C1 | C2 | H2 | 103.6° | 109.4° |
| C1 | C2 | C3 | 111.8° | 109.5° |
| H1 | C1 | C5 | 108.2° | 109.4° |
| H1 | C1 | C32 | 108.3° | 109.5° |
| C5 | C1 | C32 | 109.5° | 109.5° |
| C1 | C5 | O8 | 112.9° | 120.0° |
| C1 | C5 | N9 | 126.6° | 120.0° |
| C1 | C32 | C31 | 112.3° | 109.5° |
| C1 | C32 | H32 | 103.3° | 109.5° |
| C1 | C32 | C33 | 114.5° | 109.5° |
| N6 | C2 | H2 | 110.3° | 109.5° |
| N6 | C2 | C3 | 105.2° | 109.5° |
| C2 | N6 | HN61 | 109.5° | 111.0° |
| C2 | N6 | HN62 | 109.5° | 111.0° |
| H2 | C2 | C3 | 112.4° | 109.4° |
| C2 | C3 | O7 | 120.5° | 120.0° |
| C2 | C3 | N4 | 117.1° | 120.0° |
| O7 | C3 | N4 | 122.3° | 120.0° |
| C3 | N4 | C21 | 121.0° | 125.6° |
| C3 | N4 | C18 | 127.6° | 125.7° |
| C21 | N4 | C18 | 111.5° | 108.7° |
| N4 | C21 | C20 | 100.7° | 107.3° |
| N4 | C21 | H211 | 112.5° | 109.9° |
| N4 | C21 | H212 | 114.3° | 109.9° |
| N4 | C18 | C19 | 103.4° | 104.9° |
| N4 | C18 | H181 | 111.5° | 110.3° |
| N4 | C18 | H182 | 112.9° | 110.4° |
| O8 | C5 | N9 | 120.5° | 120.0° |
| C5 | N9 | C10 | 127.0° | 120.0° |
| C5 | N9 | C14 | 115.6° | 120.0° |
| HN61 | N6 | HN62 | 109.5° | 110.9° |
| C10 | N9 | C14 | 117.4° | 120.0° |
| N9 | C10 | H101 | 109.5° | 109.5° |
| N9 | C10 | H102 | 109.5° | 109.5° |
| N9 | C10 | H103 | 109.5° | 109.5° |
| N9 | C14 | H141 | 109.5° | 109.5° |
| N9 | C14 | H142 | 109.5° | 109.5° |
| N9 | C14 | H143 | 109.4° | 109.5° |
| H101 | C10 | H102 | 109.4° | 109.5° |
| H101 | C10 | H103 | 109.4° | 109.4° |
| H102 | C10 | H103 | 109.5° | 109.4° |
| H141 | C14 | H142 | 109.5° | 109.5° |
| H141 | C14 | H143 | 109.5° | 109.5° |
| H142 | C14 | H143 | 109.5° | 109.4° |
| C19 | C18 | H181 | 111.5° | 110.4° |
| C19 | C18 | H182 | 112.8° | 110.4° |
| C18 | C19 | C20 | 103.4° | 101.6° |
| C18 | C19 | F62 | 112.2° | 111.0° |
| C18 | C19 | F28 | 108.8° | 111.0° |
| H181 | C18 | H182 | 104.9° | 110.4° |
| C20 | C19 | F62 | 113.7° | 111.0° |
| C20 | C19 | F28 | 108.2° | 111.0° |
| C19 | C20 | C21 | 102.9° | 102.9° |
| C19 | C20 | H201 | 111.7° | 110.7° |
| C19 | C20 | H202 | 113.1° | 110.8° |
| F62 | C19 | F28 | 110.2° | 110.9° |
| C21 | C20 | H201 | 111.7° | 110.9° |
| C21 | C20 | H202 | 113.2° | 110.6° |
| C20 | C21 | H211 | 112.5° | 110.0° |
| C20 | C21 | H212 | 114.3° | 109.8° |
| H201 | C20 | H202 | 104.5° | 110.8° |
| H211 | C21 | H212 | 103.0° | 110.0° |
| C30 | C29 | H29 | 104.8° | 109.5° |
| C30 | C29 | C51 | 117.2° | 109.5° |
| C30 | C29 | C34 | 107.7° | 109.4° |
| C29 | C30 | C31 | 114.4° | 109.5° |
| C29 | C30 | H301 | 107.8° | 109.4° |
| C29 | C30 | H302 | 106.7° | 109.5° |
| H29 | C29 | C51 | 105.0° | 109.5° |
| H29 | C29 | C34 | 115.0° | 109.5° |
| C51 | C29 | C34 | 107.5° | 109.5° |
| C29 | C51 | C50 | 133.1° | 119.9° |
| C29 | C51 | C52 | 105.4° | 119.9° |
| C29 | C34 | C33 | 112.1° | 109.5° |
| C29 | C34 | H341 | 108.6° | 109.5° |
| C29 | C34 | H342 | 108.0° | 109.4° |
| C31 | C30 | H301 | 107.8° | 109.5° |
| C31 | C30 | H302 | 106.7° | 109.5° |
| C30 | C31 | C32 | 111.7° | 109.4° |
| C30 | C31 | H311 | 108.7° | 109.5° |
| C30 | C31 | H312 | 108.3° | 109.5° |
| H301 | C30 | H302 | 113.5° | 109.5° |
| C32 | C31 | H311 | 108.7° | 109.5° |
| C32 | C31 | H312 | 108.2° | 109.4° |
| C31 | C32 | H32 | 110.6° | 109.5° |
| C31 | C32 | C33 | 107.8° | 109.4° |
| H311 | C31 | H312 | 111.2° | 109.5° |
| H32 | C32 | C33 | 108.2° | 109.5° |
| C32 | C33 | C34 | 113.2° | 109.4° |
| C32 | C33 | H331 | 108.3° | 109.5° |
| C32 | C33 | H332 | 107.4° | 109.5° |
| C34 | C33 | H331 | 108.3° | 109.5° |
| C34 | C33 | H332 | 107.4° | 109.5° |
| C33 | C34 | H341 | 108.6° | 109.5° |
| C33 | C34 | H342 | 108.0° | 109.4° |
| H331 | C33 | H332 | 112.4° | 109.5° |
| H341 | C34 | H342 | 111.5° | 109.5° |
| N53 | C48 | N56 | 109.9° | 107.4° |
| N53 | C48 | C49 | 120.7° | 119.7° |
| C48 | N53 | C52 | 121.5° | 120.6° |
| C48 | N53 | N54 | 110.5° | 106.2° |
| N56 | C48 | C49 | 129.2° | 132.9° |
| C48 | N56 | C55 | 101.2° | 109.7° |
| C48 | C49 | H49 | 120.7° | 120.4° |
| C48 | C49 | C50 | 118.6° | 119.3° |
| H49 | C49 | C50 | 120.7° | 120.4° |
| C49 | C50 | C51 | 120.1° | 119.6° |
| C49 | C50 | H50 | 119.9° | 120.1° |
| C51 | C50 | H50 | 119.9° | 120.2° |
| C50 | C51 | C52 | 121.4° | 120.2° |
| C51 | C52 | H52 | 121.3° | 119.7° |
| C51 | C52 | N53 | 117.3° | 120.6° |
| H52 | C52 | N53 | 121.4° | 119.7° |
| C52 | N53 | N54 | 127.7° | 133.2° |
| N53 | N54 | C55 | 105.0° | 107.0° |
| N54 | C55 | N56 | 113.3° | 109.7° |
| N54 | C55 | H55 | 123.4° | 125.2° |
| N56 | C55 | H55 | 123.4° | 125.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | H1 | C5 | 120.7° | 120.0° |
| C2 | C1 | H1 | C32 | 120.7° | 120.0° |
| C2 | C1 | C5 | C32 | 127.6° | 120.0° |
| C1 | C2 | N6 | H2 | 115.9° | 120.0° |
| C1 | C2 | N6 | C3 | 122.7° | 120.0° |
| C1 | C2 | H2 | C3 | 120.8° | 120.0° |
| C1 | C2 | C3 | O7 | 56.0° | 72.0° |
| C1 | C2 | C3 | N4 | 124.0° | 108.0° |
| C2 | C1 | C5 | O8 | 43.0° | 55.0° |
| C2 | C1 | C5 | N9 | 136.9° | 125.0° |
| C1 | C2 | N6 | HN61 | 50.7° | 176.0° |
| C1 | C2 | N6 | HN62 | 69.3° | 60.1° |
| C2 | C1 | C32 | C31 | 173.5° | 178.9° |
| C2 | C1 | C32 | H32 | 54.3° | 61.0° |
| C2 | C1 | C32 | C33 | 63.2° | 58.9° |
| H1 | C1 | C5 | C32 | 117.8° | 120.0° |
| H1 | C1 | C2 | N6 | 75.9° | 60.4° |
| H1 | C1 | C2 | H2 | 164.4° | 179.6° |
| H1 | C1 | C2 | C3 | 43.2° | 59.7° |
| H1 | C1 | C5 | O8 | 157.6° | 175.0° |
| H1 | C1 | C5 | N9 | 22.3° | 5.1° |
| H1 | C1 | C32 | C31 | 58.9° | 61.1° |
| H1 | C1 | C32 | H32 | 60.3° | 59.0° |
| H1 | C1 | C32 | C33 | 177.8° | 178.9° |
| C5 | C1 | C2 | N6 | 167.0° | 179.7° |
| C5 | C1 | C2 | H2 | 47.2° | 59.7° |
| C5 | C1 | C2 | C3 | 74.0° | 60.3° |
| C1 | C5 | O8 | N9 | 179.9° | 180.0° |
| C1 | C5 | N9 | C10 | 0.8° | 175.7° |
| C1 | C5 | N9 | C14 | 179.3° | 4.3° |
| C5 | C1 | C32 | C31 | 58.8° | 58.9° |
| C5 | C1 | C32 | H32 | 178.0° | 179.0° |
| C5 | C1 | C32 | C33 | 64.5° | 61.1° |
| C32 | C1 | C2 | N6 | 41.4° | 59.7° |
| C32 | C1 | C2 | H2 | 78.4° | 60.4° |
| C32 | C1 | C2 | C3 | 160.4° | 179.7° |
| C32 | C1 | C5 | O8 | 84.6° | 65.0° |
| C32 | C1 | C5 | N9 | 95.5° | 115.0° |
| C1 | C32 | C31 | C30 | 178.2° | 180.0° |
| C1 | C32 | C31 | H32 | 114.9° | 120.0° |
| C1 | C32 | C31 | C33 | 127.0° | 120.0° |
| C1 | C32 | C31 | H311 | 61.8° | 60.0° |
| C1 | C32 | C31 | H312 | 59.1° | 60.1° |
| C1 | C32 | H32 | C33 | 121.8° | 120.0° |
| C1 | C32 | C33 | C34 | 179.3° | 180.0° |
| C1 | C32 | C33 | H331 | 59.3° | 60.0° |
| C1 | C32 | C33 | H332 | 62.3° | 60.0° |
| N6 | C2 | H2 | C3 | 117.1° | 120.0° |
| N6 | C2 | C3 | O7 | 68.0° | 48.0° |
| N6 | C2 | C3 | N4 | 112.0° | 132.0° |
| C2 | N6 | HN61 | HN62 | 120.0° | 123.9° |
| H2 | C2 | C3 | O7 | 172.0° | 168.1° |
| H2 | C2 | C3 | N4 | 8.0° | 12.0° |
| H2 | C2 | N6 | HN61 | 166.6° | 56.1° |
| H2 | C2 | N6 | HN62 | 46.6° | 180.0° |
| C2 | C3 | O7 | N4 | 180.0° | 180.0° |
| C2 | C3 | N4 | C21 | 178.9° | 176.5° |
| C2 | C3 | N4 | C18 | 1.2° | 3.8° |
| C3 | C2 | N6 | HN61 | 72.0° | 63.9° |
| C3 | C2 | N6 | HN62 | 168.0° | 60.0° |
| O7 | C3 | N4 | C21 | 1.1° | 3.5° |
| O7 | C3 | N4 | C18 | 178.8° | 176.1° |
| C3 | N4 | C21 | C18 | 180.0° | 179.7° |
| C3 | N4 | C18 | C19 | 178.3° | 155.8° |
| C3 | N4 | C18 | H181 | 61.7° | 85.3° |
| C3 | N4 | C18 | H182 | 56.1° | 36.9° |
| C3 | N4 | C21 | C20 | 156.6° | 179.0° |
| C3 | N4 | C21 | H211 | 83.4° | 59.5° |
| C3 | N4 | C21 | H212 | 33.6° | 61.7° |
| C21 | N4 | C18 | C19 | 1.6° | 23.9° |
| C21 | N4 | C18 | H181 | 118.4° | 95.0° |
| C21 | N4 | C18 | H182 | 123.8° | 142.7° |
| N4 | C21 | C20 | C19 | 39.5° | 22.5° |
| N4 | C21 | C20 | H211 | 120.0° | 119.5° |
| N4 | C21 | C20 | H212 | 123.0° | 119.3° |
| N4 | C21 | C20 | H201 | 80.5° | 95.9° |
| N4 | C21 | C20 | H202 | 162.0° | 140.8° |
| N4 | C21 | H211 | H212 | 123.6° | 121.1° |
| N4 | C18 | C19 | H181 | 120.0° | 118.8° |
| N4 | C18 | C19 | H182 | 122.2° | 118.9° |
| N4 | C18 | H181 | H182 | 122.5° | 122.2° |
| N4 | C18 | C19 | C20 | 26.8° | 37.0° |
| N4 | C18 | C19 | F62 | 149.8° | 155.1° |
| N4 | C18 | C19 | F28 | 88.1° | 81.1° |
| C18 | N4 | C21 | C20 | 23.4° | 0.7° |
| C18 | N4 | C21 | H211 | 96.5° | 120.2° |
| C18 | N4 | C21 | H212 | 146.5° | 118.6° |
| O8 | C5 | N9 | C10 | 179.1° | 4.3° |
| O8 | C5 | N9 | C14 | 0.8° | 175.7° |
| C5 | N9 | C10 | C14 | 179.9° | 180.0° |
| C5 | N9 | C10 | H101 | 170.8° | 89.9° |
| C5 | N9 | C10 | H102 | 69.2° | 150.0° |
| C5 | N9 | C10 | H103 | 50.8° | 30.0° |
| C5 | N9 | C14 | H141 | 4.3° | 64.9° |
| C5 | N9 | C14 | H142 | 124.3° | 175.1° |
| C5 | N9 | C14 | H143 | 115.7° | 55.1° |
| N9 | C10 | H101 | H102 | 120.0° | 120.1° |
| N9 | C10 | H101 | H103 | 120.0° | 120.0° |
| N9 | C10 | H102 | H103 | 120.0° | 120.0° |
| C10 | N9 | C14 | H141 | 175.8° | 115.1° |
| C10 | N9 | C14 | H142 | 55.8° | 4.9° |
| C10 | N9 | C14 | H143 | 64.2° | 124.9° |
| C14 | N9 | C10 | H101 | 9.1° | 90.1° |
| C14 | N9 | C10 | H102 | 110.9° | 30.0° |
| C14 | N9 | C10 | H103 | 129.1° | 150.0° |
| N9 | C14 | H141 | H142 | 120.0° | 120.0° |
| N9 | C14 | H141 | H143 | 120.0° | 120.0° |
| N9 | C14 | H142 | H143 | 120.0° | 120.0° |
| H101 | C10 | H102 | H103 | 120.0° | 119.9° |
| H141 | C14 | H142 | H143 | 120.0° | 120.0° |
| C19 | C18 | H181 | H182 | 122.5° | 122.3° |
| C18 | C19 | C20 | F62 | 121.9° | 118.1° |
| C18 | C19 | C20 | F28 | 115.3° | 118.0° |
| C18 | C19 | F62 | F28 | 121.4° | 123.9° |
| C18 | C19 | C20 | C21 | 41.7° | 35.7° |
| C18 | C19 | C20 | H201 | 78.3° | 82.9° |
| C18 | C19 | C20 | H202 | 164.1° | 153.8° |
| H181 | C18 | C19 | C20 | 93.2° | 81.8° |
| H181 | C18 | C19 | F62 | 29.8° | 36.3° |
| H181 | C18 | C19 | F28 | 152.0° | 160.1° |
| H182 | C18 | C19 | C20 | 149.1° | 155.8° |
| H182 | C18 | C19 | F62 | 88.0° | 86.1° |
| H182 | C18 | C19 | F28 | 34.2° | 37.8° |
| C20 | C19 | F62 | F28 | 121.7° | 123.9° |
| C19 | C20 | C21 | H201 | 120.0° | 118.4° |
| C19 | C20 | C21 | H202 | 122.4° | 118.3° |
| C19 | C20 | H201 | H202 | 122.7° | 123.3° |
| C19 | C20 | C21 | H211 | 80.4° | 97.0° |
| C19 | C20 | C21 | H212 | 162.6° | 141.9° |
| F62 | C19 | C20 | C21 | 163.6° | 153.8° |
| F62 | C19 | C20 | H201 | 43.6° | 35.2° |
| F62 | C19 | C20 | H202 | 74.0° | 88.0° |
| F28 | C19 | C20 | C21 | 73.6° | 82.4° |
| F28 | C19 | C20 | H201 | 166.4° | 159.1° |
| F28 | C19 | C20 | H202 | 48.8° | 35.8° |
| C21 | C20 | H201 | H202 | 122.7° | 123.2° |
| C20 | C21 | H211 | H212 | 123.5° | 121.1° |
| H201 | C20 | C21 | H211 | 159.6° | 144.7° |
| H201 | C20 | C21 | H212 | 42.6° | 23.5° |
| H202 | C20 | C21 | H211 | 42.0° | 21.3° |
| H202 | C20 | C21 | H212 | 75.0° | 99.8° |
| C30 | C29 | H29 | C51 | 124.1° | 120.0° |
| C30 | C29 | H29 | C34 | 118.0° | 120.0° |
| C30 | C29 | C51 | C34 | 121.3° | 119.9° |
| C29 | C30 | C31 | H301 | 120.0° | 119.9° |
| C29 | C30 | C31 | H302 | 117.8° | 120.1° |
| C29 | C30 | H301 | H302 | 118.0° | 120.0° |
| C29 | C30 | C31 | C32 | 60.1° | 60.1° |
| C29 | C30 | C31 | H311 | 59.9° | 59.9° |
| C29 | C30 | C31 | H312 | 179.2° | 180.0° |
| C30 | C29 | C34 | C33 | 53.5° | 60.1° |
| C30 | C29 | C34 | H341 | 66.5° | 60.0° |
| C30 | C29 | C34 | H342 | 172.4° | 180.0° |
| C30 | C29 | C51 | C50 | 77.9° | 59.9° |
| C30 | C29 | C51 | C52 | 98.1° | 120.0° |
| H29 | C29 | C51 | C34 | 122.9° | 120.0° |
| H29 | C29 | C30 | C31 | 65.8° | 59.9° |
| H29 | C29 | C30 | H301 | 54.1° | 60.0° |
| H29 | C29 | C30 | H302 | 176.4° | 180.0° |
| H29 | C29 | C34 | C33 | 62.9° | 60.0° |
| H29 | C29 | C34 | H341 | 177.1° | 180.0° |
| H29 | C29 | C34 | H342 | 56.0° | 60.0° |
| H29 | C29 | C51 | C50 | 166.4° | 180.0° |
| H29 | C29 | C51 | C52 | 17.7° | 0.1° |
| C51 | C29 | C30 | C31 | 178.3° | 180.0° |
| C51 | C29 | C30 | H301 | 61.8° | 60.0° |
| C51 | C29 | C30 | H302 | 60.5° | 60.0° |
| C51 | C29 | C34 | C33 | 179.4° | 180.0° |
| C51 | C29 | C34 | H341 | 60.6° | 60.0° |
| C51 | C29 | C34 | H342 | 60.5° | 60.0° |
| C29 | C51 | C50 | C49 | 178.4° | 180.0° |
| C29 | C51 | C50 | C52 | 175.4° | 179.9° |
| C29 | C51 | C50 | H50 | 1.6° | 0.1° |
| C29 | C51 | C52 | H52 | 0.1° | 0.1° |
| C29 | C51 | C52 | N53 | 179.9° | 180.0° |
| C34 | C29 | C30 | C31 | 57.1° | 60.1° |
| C34 | C29 | C30 | H301 | 177.0° | 180.0° |
| C34 | C29 | C30 | H302 | 60.7° | 60.0° |
| C29 | C34 | C33 | C32 | 55.1° | 60.0° |
| C29 | C34 | C33 | H341 | 120.0° | 120.1° |
| C29 | C34 | C33 | H342 | 118.9° | 119.9° |
| C29 | C34 | C33 | H331 | 65.0° | 59.9° |
| C29 | C34 | C33 | H332 | 173.5° | 180.0° |
| C29 | C34 | H341 | H342 | 119.0° | 120.0° |
| C34 | C29 | C51 | C50 | 43.5° | 60.0° |
| C34 | C29 | C51 | C52 | 140.6° | 120.1° |
| C31 | C30 | H301 | H302 | 118.0° | 120.0° |
| C30 | C31 | C32 | H311 | 120.0° | 120.0° |
| C30 | C31 | C32 | H312 | 119.1° | 119.9° |
| C30 | C31 | H311 | H312 | 119.1° | 120.0° |
| C30 | C31 | C32 | H32 | 63.3° | 60.0° |
| C30 | C31 | C32 | C33 | 54.8° | 60.0° |
| H301 | C30 | C31 | C32 | 179.9° | 180.0° |
| H301 | C30 | C31 | H311 | 60.1° | 60.0° |
| H301 | C30 | C31 | H312 | 60.9° | 60.1° |
| H302 | C30 | C31 | C32 | 57.7° | 60.0° |
| H302 | C30 | C31 | H311 | 177.7° | 180.0° |
| H302 | C30 | C31 | H312 | 61.4° | 59.9° |
| C32 | C31 | H311 | H312 | 119.1° | 120.0° |
| C31 | C32 | H32 | C33 | 117.9° | 120.0° |
| C31 | C32 | C33 | C34 | 53.6° | 60.0° |
| C31 | C32 | C33 | H331 | 66.4° | 60.0° |
| C31 | C32 | C33 | H332 | 172.0° | 180.0° |
| H311 | C31 | C32 | H32 | 176.7° | 180.0° |
| H311 | C31 | C32 | C33 | 65.2° | 60.0° |
| H312 | C31 | C32 | H32 | 55.8° | 60.0° |
| H312 | C31 | C32 | C33 | 173.9° | 180.0° |
| H32 | C32 | C33 | C34 | 66.1° | 60.0° |
| H32 | C32 | C33 | H331 | 173.9° | 180.0° |
| H32 | C32 | C33 | H332 | 52.3° | 60.0° |
| C32 | C33 | C34 | H331 | 120.0° | 120.0° |
| C32 | C33 | C34 | H332 | 118.4° | 120.0° |
| C32 | C33 | H331 | H332 | 118.5° | 120.0° |
| C32 | C33 | C34 | H341 | 64.9° | 60.0° |
| C32 | C33 | C34 | H342 | 174.0° | 180.0° |
| C34 | C33 | H331 | H332 | 118.5° | 120.0° |
| C33 | C34 | H341 | H342 | 118.9° | 120.0° |
| H331 | C33 | C34 | H341 | 175.1° | 180.0° |
| H331 | C33 | C34 | H342 | 54.0° | 60.0° |
| H332 | C33 | C34 | H341 | 53.5° | 60.0° |
| H332 | C33 | C34 | H342 | 67.6° | 60.0° |
| N53 | C48 | N56 | C49 | 174.3° | 179.7° |
| N53 | C48 | C49 | H49 | 174.2° | 180.0° |
| N53 | C48 | C49 | C50 | 5.8° | 0.0° |
| C48 | N53 | C52 | C51 | 5.6° | 0.0° |
| C48 | N53 | C52 | H52 | 174.4° | 180.0° |
| C48 | N53 | C52 | N54 | 172.8° | 179.7° |
| C48 | N53 | N54 | C55 | 3.6° | 0.0° |
| N53 | C48 | N56 | C55 | 3.2° | 0.0° |
| N56 | C48 | C49 | H49 | 0.5° | 0.4° |
| N56 | C48 | C49 | C50 | 179.5° | 179.7° |
| N56 | C48 | N53 | C52 | 178.5° | 179.8° |
| N56 | C48 | N53 | N54 | 4.6° | 0.0° |
| C48 | N56 | C55 | N54 | 1.1° | 0.0° |
| C48 | N56 | C55 | H55 | 178.9° | 180.0° |
| C48 | C49 | H49 | C50 | 180.0° | 179.9° |
| C48 | C49 | C50 | C51 | 3.8° | 0.1° |
| C48 | C49 | C50 | H50 | 176.2° | 180.0° |
| C49 | C48 | N53 | C52 | 6.7° | 0.0° |
| C49 | C48 | N53 | N54 | 179.4° | 179.7° |
| C49 | C48 | N56 | C55 | 177.5° | 179.7° |
| H49 | C49 | C50 | C51 | 176.2° | 180.0° |
| H49 | C49 | C50 | H50 | 3.8° | 0.0° |
| C49 | C50 | C51 | H50 | 180.0° | 180.0° |
| C49 | C50 | C51 | C52 | 3.0° | 0.1° |
| C50 | C51 | C52 | H52 | 176.4° | 180.0° |
| C50 | C51 | C52 | N53 | 3.6° | 0.1° |
| H50 | C50 | C51 | C52 | 177.0° | 180.0° |
| C51 | C52 | H52 | N53 | 180.0° | 180.0° |
| C51 | C52 | N53 | N54 | 178.4° | 179.6° |
| H52 | C52 | N53 | N54 | 1.6° | 0.3° |
| C52 | N53 | N54 | C55 | 177.0° | 179.7° |
| N53 | N54 | C55 | N56 | 1.6° | 0.0° |
| N53 | N54 | C55 | H55 | 178.4° | 180.0° |
| N54 | C55 | N56 | H55 | 180.0° | 179.9° |
