77D
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N01 | C30 | sing | 1.35Å | 1.37Å | |
| N01 | C02 | sing | 1.46Å | 1.44Å | |
| N01 | HN01 | sing | 0.97Å | 1.00Å | |
| C02 | C03 | sing | 1.53Å | 1.52Å | |
| C02 | H02 | sing | 1.09Å | 1.10Å | |
| C02 | H02A | sing | 1.09Å | 1.10Å | |
| C05 | C03 | sing | 1.53Å | 1.51Å | |
| C03 | C04 | sing | 1.53Å | 1.51Å | |
| C03 | C06 | sing | 1.53Å | 1.53Å | |
| C04 | H04 | sing | 1.09Å | 1.10Å | |
| C04 | H04A | sing | 1.09Å | 1.10Å | |
| C04 | H04B | sing | 1.09Å | 1.10Å | |
| C05 | H05 | sing | 1.09Å | 1.10Å | |
| C05 | H05A | sing | 1.09Å | 1.10Å | |
| C05 | H05B | sing | 1.09Å | 1.10Å | |
| C07 | C06 | sing | 1.52Å | 1.48Å | |
| C06 | H06 | sing | 1.09Å | 1.10Å | |
| C06 | H06A | sing | 1.09Å | 1.10Å | |
| C29 | C07 | doub | 1.36Å | 1.38Å | Aromatic |
| C07 | C08 | sing | 1.40Å | 1.43Å | Aromatic |
| C18 | C08 | doub | 1.38Å | 1.38Å | Aromatic |
| C08 | C09 | sing | 1.47Å | 1.44Å | |
| C09 | O17 | doub | 1.22Å | 1.22Å | |
| C09 | N10 | sing | 1.35Å | 1.37Å | |
| N10 | C11 | sing | 1.47Å | 1.44Å | |
| N10 | HN10 | sing | 0.97Å | 1.00Å | |
| C16 | C11 | sing | 1.53Å | 1.52Å | |
| C11 | C12 | sing | 1.53Å | 1.51Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | N13 | sing | 1.47Å | 1.49Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C14 | N13 | sing | 1.47Å | 1.50Å | |
| N13 | HN13 | sing | 1.01Å | 1.00Å | |
| C15 | C14 | sing | 1.53Å | 1.51Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C16 | C15 | sing | 1.53Å | 1.51Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| S28 | C18 | sing | 1.71Å | 1.71Å | Aromatic |
| C18 | N19 | sing | 1.38Å | 1.36Å | |
| C20 | N19 | sing | 1.40Å | 1.41Å | |
| N19 | HN19 | sing | 0.97Å | 1.00Å | |
| C27 | C20 | doub | 1.39Å | 1.38Å | Aromatic |
| C21 | C20 | sing | 1.39Å | 1.38Å | Aromatic |
| C23 | C21 | doub | 1.38Å | 1.37Å | Aromatic |
| C21 | F22 | sing | 1.35Å | 1.33Å | |
| C24 | C23 | sing | 1.38Å | 1.37Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| I25 | C24 | sing | 2.09Å | 2.08Å | |
| C24 | C26 | doub | 1.38Å | 1.38Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| S28 | C29 | sing | 1.75Å | 1.71Å | Aromatic |
| C30 | C29 | sing | 1.48Å | 1.44Å | |
| O31 | C30 | doub | 1.22Å | 1.22Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C30 | N01 | C02 | 119.9° | 119.5° |
| C30 | N01 | HN01 | 120.1° | 120.2° |
| N01 | C30 | C29 | 112.6° | 115.8° |
| N01 | C30 | O31 | 123.7° | 122.0° |
| C02 | N01 | HN01 | 120.0° | 120.3° |
| N01 | C02 | C03 | 113.6° | 113.1° |
| N01 | C02 | H02 | 108.1° | 108.8° |
| N01 | C02 | H02A | 108.1° | 108.7° |
| C03 | C02 | H02 | 108.1° | 108.8° |
| C03 | C02 | H02A | 108.1° | 108.7° |
| C02 | C03 | C05 | 110.7° | 109.5° |
| C02 | C03 | C04 | 107.1° | 109.4° |
| C02 | C03 | C06 | 111.9° | 109.7° |
| H02 | C02 | H02A | 110.8° | 108.7° |
| C05 | C03 | C04 | 106.1° | 109.5° |
| C05 | C03 | C06 | 112.6° | 109.4° |
| C03 | C05 | H05 | 109.5° | 109.5° |
| C03 | C05 | H05A | 109.5° | 109.5° |
| C03 | C05 | H05B | 109.5° | 109.4° |
| C04 | C03 | C06 | 108.2° | 109.4° |
| C03 | C04 | H04 | 109.5° | 109.5° |
| C03 | C04 | H04A | 109.4° | 109.5° |
| C03 | C04 | H04B | 109.4° | 109.5° |
| C03 | C06 | C07 | 117.1° | 109.9° |
| C03 | C06 | H06 | 107.0° | 109.4° |
| C03 | C06 | H06A | 107.0° | 109.3° |
| H04 | C04 | H04A | 109.5° | 109.5° |
| H04 | C04 | H04B | 109.5° | 109.4° |
| H04A | C04 | H04B | 109.5° | 109.5° |
| H05 | C05 | H05A | 109.5° | 109.5° |
| H05 | C05 | H05B | 109.4° | 109.4° |
| H05A | C05 | H05B | 109.5° | 109.4° |
| C07 | C06 | H06 | 107.0° | 109.4° |
| C07 | C06 | H06A | 107.0° | 109.3° |
| C06 | C07 | C29 | 122.3° | 122.7° |
| C06 | C07 | C08 | 126.2° | 124.9° |
| H06 | C06 | H06A | 111.8° | 109.4° |
| C29 | C07 | C08 | 111.6° | 112.4° |
| C07 | C29 | S28 | 111.6° | 111.1° |
| C07 | C29 | C30 | 129.7° | 121.9° |
| C07 | C08 | C18 | 113.4° | 114.4° |
| C07 | C08 | C09 | 127.0° | 122.8° |
| C18 | C08 | C09 | 119.7° | 122.8° |
| C08 | C18 | S28 | 110.3° | 110.4° |
| C08 | C18 | N19 | 126.1° | 124.8° |
| C08 | C09 | O17 | 123.6° | 120.0° |
| C08 | C09 | N10 | 112.5° | 120.0° |
| O17 | C09 | N10 | 123.8° | 120.0° |
| C09 | N10 | C11 | 119.9° | 120.0° |
| C09 | N10 | HN10 | 120.0° | 120.0° |
| C11 | N10 | HN10 | 120.1° | 120.0° |
| N10 | C11 | C16 | 110.1° | 109.5° |
| N10 | C11 | C12 | 109.6° | 109.5° |
| N10 | C11 | H11 | 109.4° | 109.5° |
| C16 | C11 | C12 | 110.7° | 109.3° |
| C16 | C11 | H11 | 108.2° | 109.6° |
| C11 | C16 | C15 | 111.2° | 109.2° |
| C11 | C16 | H16 | 108.9° | 109.5° |
| C11 | C16 | H16A | 108.9° | 109.5° |
| C12 | C11 | H11 | 108.7° | 109.5° |
| C11 | C12 | N13 | 108.2° | 109.5° |
| C11 | C12 | H12 | 109.9° | 109.5° |
| C11 | C12 | H12A | 109.9° | 109.4° |
| N13 | C12 | H12 | 109.9° | 109.5° |
| N13 | C12 | H12A | 109.9° | 109.5° |
| C12 | N13 | C14 | 113.8° | 111.2° |
| C12 | N13 | HN13 | 108.0° | 111.0° |
| H12 | C12 | H12A | 109.1° | 109.4° |
| C14 | N13 | HN13 | 108.0° | 110.9° |
| N13 | C14 | C15 | 107.0° | 109.6° |
| N13 | C14 | H14 | 110.3° | 109.4° |
| N13 | C14 | H14A | 110.3° | 109.4° |
| C15 | C14 | H14 | 110.3° | 109.5° |
| C15 | C14 | H14A | 110.3° | 109.5° |
| C14 | C15 | C16 | 108.9° | 109.3° |
| C14 | C15 | H15 | 109.6° | 109.5° |
| C14 | C15 | H15A | 109.6° | 109.5° |
| H14 | C14 | H14A | 108.7° | 109.4° |
| C16 | C15 | H15 | 109.7° | 109.5° |
| C16 | C15 | H15A | 109.7° | 109.5° |
| C15 | C16 | H16 | 108.9° | 109.5° |
| C15 | C16 | H16A | 108.9° | 109.6° |
| H15 | C15 | H15A | 109.3° | 109.5° |
| H16 | C16 | H16A | 110.0° | 109.6° |
| S28 | C18 | N19 | 123.6° | 124.8° |
| C18 | S28 | C29 | 93.2° | 91.7° |
| C18 | N19 | C20 | 127.4° | 120.1° |
| C18 | N19 | HN19 | 116.3° | 120.0° |
| C20 | N19 | HN19 | 116.3° | 120.0° |
| N19 | C20 | C27 | 124.9° | 120.1° |
| N19 | C20 | C21 | 117.4° | 120.1° |
| C27 | C20 | C21 | 117.7° | 119.8° |
| C20 | C27 | C26 | 120.5° | 120.0° |
| C20 | C27 | H27 | 119.8° | 120.0° |
| C20 | C21 | C23 | 122.7° | 119.9° |
| C20 | C21 | F22 | 118.7° | 120.0° |
| C23 | C21 | F22 | 118.6° | 120.1° |
| C21 | C23 | C24 | 118.7° | 120.1° |
| C21 | C23 | H23 | 120.7° | 119.9° |
| C24 | C23 | H23 | 120.6° | 120.0° |
| C23 | C24 | I25 | 118.1° | 119.9° |
| C23 | C24 | C26 | 120.1° | 120.1° |
| I25 | C24 | C26 | 121.9° | 120.0° |
| C24 | C26 | C27 | 120.3° | 120.1° |
| C24 | C26 | H26 | 119.8° | 119.9° |
| C27 | C26 | H26 | 119.9° | 119.9° |
| C26 | C27 | H27 | 119.7° | 120.0° |
| S28 | C29 | C30 | 118.7° | 127.0° |
| C29 | C30 | O31 | 123.7° | 122.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C30 | N01 | C02 | HN01 | 180.0° | 179.7° |
| C30 | N01 | C02 | C03 | 77.0° | 85.5° |
| C30 | N01 | C02 | H02 | 43.0° | 35.4° |
| C30 | N01 | C02 | H02A | 163.0° | 153.6° |
| N01 | C30 | C29 | C07 | 50.6° | 44.3° |
| N01 | C30 | C29 | S28 | 129.4° | 136.3° |
| N01 | C30 | C29 | O31 | 179.4° | 180.0° |
| N01 | C02 | C03 | H02 | 120.0° | 121.0° |
| N01 | C02 | C03 | H02A | 120.0° | 120.9° |
| N01 | C02 | H02 | H02A | 118.3° | 118.2° |
| N01 | C02 | C03 | C05 | 58.8° | 75.7° |
| N01 | C02 | C03 | C04 | 174.1° | 164.3° |
| N01 | C02 | C03 | C06 | 67.5° | 44.3° |
| C02 | N01 | C30 | C29 | 75.9° | 13.4° |
| C02 | N01 | C30 | O31 | 103.5° | 166.6° |
| HN01 | N01 | C02 | C03 | 103.0° | 94.1° |
| HN01 | N01 | C02 | H02 | 137.0° | 144.9° |
| HN01 | N01 | C02 | H02A | 17.0° | 26.7° |
| HN01 | N01 | C30 | C29 | 104.1° | 166.3° |
| HN01 | N01 | C30 | O31 | 76.5° | 13.8° |
| C03 | C02 | H02 | H02A | 118.3° | 118.2° |
| C02 | C03 | C05 | C04 | 115.8° | 120.0° |
| C02 | C03 | C05 | C06 | 126.0° | 120.2° |
| C02 | C03 | C04 | C06 | 120.7° | 120.2° |
| C02 | C03 | C04 | H04 | 180.0° | 60.0° |
| C02 | C03 | C04 | H04A | 60.0° | 180.0° |
| C02 | C03 | C04 | H04B | 60.0° | 59.9° |
| C02 | C03 | C05 | H05 | 180.0° | 60.0° |
| C02 | C03 | C05 | H05A | 60.0° | 180.0° |
| C02 | C03 | C05 | H05B | 60.0° | 60.0° |
| C02 | C03 | C06 | C07 | 69.4° | 42.1° |
| C02 | C03 | C06 | H06 | 50.6° | 162.3° |
| C02 | C03 | C06 | H06A | 170.6° | 77.9° |
| H02 | C02 | C03 | C05 | 178.9° | 163.3° |
| H02 | C02 | C03 | C04 | 65.9° | 43.3° |
| H02 | C02 | C03 | C06 | 52.5° | 76.7° |
| H02A | C02 | C03 | C05 | 61.1° | 45.1° |
| H02A | C02 | C03 | C04 | 54.1° | 74.8° |
| H02A | C02 | C03 | C06 | 172.5° | 165.2° |
| C05 | C03 | C04 | C06 | 121.0° | 119.8° |
| C05 | C03 | C04 | H04 | 61.8° | 60.0° |
| C05 | C03 | C04 | H04A | 178.3° | 60.0° |
| C05 | C03 | C04 | H04B | 58.2° | 179.9° |
| C03 | C05 | H05 | H05A | 120.0° | 120.1° |
| C03 | C05 | H05 | H05B | 120.0° | 120.0° |
| C03 | C05 | H05A | H05B | 120.0° | 120.0° |
| C05 | C03 | C06 | C07 | 55.9° | 162.2° |
| C05 | C03 | C06 | H06 | 175.9° | 77.6° |
| C05 | C03 | C06 | H06A | 64.1° | 42.2° |
| C03 | C04 | H04 | H04A | 120.0° | 120.0° |
| C03 | C04 | H04 | H04B | 120.0° | 120.0° |
| C03 | C04 | H04A | H04B | 120.0° | 120.1° |
| C04 | C03 | C05 | H05 | 64.2° | 179.9° |
| C04 | C03 | C05 | H05A | 55.8° | 60.0° |
| C04 | C03 | C05 | H05B | 175.8° | 60.0° |
| C04 | C03 | C06 | C07 | 172.9° | 77.9° |
| C04 | C03 | C06 | H06 | 67.1° | 42.2° |
| C04 | C03 | C06 | H06A | 52.9° | 162.1° |
| C06 | C03 | C04 | H04 | 59.3° | 179.8° |
| C06 | C03 | C04 | H04A | 60.7° | 59.8° |
| C06 | C03 | C04 | H04B | 179.3° | 60.2° |
| C06 | C03 | C05 | H05 | 54.0° | 60.2° |
| C06 | C03 | C05 | H05A | 174.0° | 59.8° |
| C06 | C03 | C05 | H05B | 66.0° | 179.8° |
| C03 | C06 | C07 | H06 | 120.0° | 120.2° |
| C03 | C06 | C07 | H06A | 120.0° | 120.0° |
| C03 | C06 | H06 | H06A | 116.9° | 119.8° |
| C03 | C06 | C07 | C29 | 51.4° | 71.0° |
| C03 | C06 | C07 | C08 | 128.6° | 108.8° |
| H04 | C04 | H04A | H04B | 120.0° | 119.9° |
| H05 | C05 | H05A | H05B | 120.0° | 119.9° |
| C07 | C06 | H06 | H06A | 116.9° | 119.7° |
| C06 | C07 | C29 | C08 | 179.9° | 179.9° |
| C06 | C07 | C08 | C18 | 180.0° | 179.5° |
| C06 | C07 | C08 | C09 | 0.6° | 0.5° |
| C06 | C07 | C29 | S28 | 180.0° | 179.4° |
| C06 | C07 | C29 | C30 | 0.1° | 1.1° |
| H06 | C06 | C07 | C29 | 68.6° | 168.8° |
| H06 | C06 | C07 | C08 | 111.5° | 11.3° |
| H06A | C06 | C07 | C29 | 171.4° | 49.0° |
| H06A | C06 | C07 | C08 | 8.6° | 131.1° |
| C29 | C07 | C08 | C18 | 0.0° | 0.4° |
| C29 | C07 | C08 | C09 | 179.4° | 179.6° |
| C07 | C29 | S28 | C18 | 0.1° | 0.3° |
| C07 | C29 | S28 | C30 | 180.0° | 179.5° |
| C07 | C29 | C30 | O31 | 128.7° | 135.8° |
| C07 | C08 | C18 | C09 | 179.5° | 179.9° |
| C07 | C08 | C09 | O17 | 144.8° | 90.0° |
| C07 | C08 | C09 | N10 | 37.4° | 90.1° |
| C07 | C08 | C18 | S28 | 0.0° | 0.1° |
| C07 | C08 | C18 | N19 | 179.9° | 179.9° |
| C08 | C07 | C29 | S28 | 0.0° | 0.4° |
| C08 | C07 | C29 | C30 | 180.0° | 179.1° |
| C18 | C08 | C09 | O17 | 35.8° | 89.9° |
| C18 | C08 | C09 | N10 | 142.0° | 90.0° |
| C08 | C18 | S28 | N19 | 179.9° | 180.0° |
| C08 | C18 | N19 | C20 | 179.5° | 174.0° |
| C08 | C18 | N19 | HN19 | 0.5° | 6.0° |
| C08 | C18 | S28 | C29 | 0.0° | 0.1° |
| C08 | C09 | O17 | N10 | 177.6° | 179.9° |
| C08 | C09 | N10 | C11 | 179.1° | 180.0° |
| C08 | C09 | N10 | HN10 | 0.9° | 0.1° |
| C09 | C08 | C18 | S28 | 179.5° | 179.8° |
| C09 | C08 | C18 | N19 | 0.6° | 0.1° |
| O17 | C09 | N10 | C11 | 3.1° | 0.1° |
| O17 | C09 | N10 | HN10 | 176.9° | 180.0° |
| C09 | N10 | C11 | HN10 | 180.0° | 179.9° |
| C09 | N10 | C11 | C16 | 95.2° | 155.2° |
| C09 | N10 | C11 | C12 | 142.8° | 85.1° |
| C09 | N10 | C11 | H11 | 23.7° | 35.0° |
| N10 | C11 | C16 | C12 | 121.3° | 119.9° |
| N10 | C11 | C16 | H11 | 119.6° | 120.1° |
| N10 | C11 | C12 | H11 | 119.6° | 120.1° |
| N10 | C11 | C12 | N13 | 176.0° | 179.1° |
| N10 | C11 | C12 | H12 | 64.1° | 60.9° |
| N10 | C11 | C12 | H12A | 56.0° | 59.1° |
| N10 | C11 | C16 | C15 | 178.2° | 177.5° |
| N10 | C11 | C16 | H16 | 58.1° | 57.7° |
| N10 | C11 | C16 | H16A | 61.8° | 62.5° |
| HN10 | N10 | C11 | C16 | 84.8° | 24.8° |
| HN10 | N10 | C11 | C12 | 37.2° | 95.0° |
| HN10 | N10 | C11 | H11 | 156.4° | 144.9° |
| C16 | C11 | C12 | H11 | 118.8° | 120.0° |
| C16 | C11 | C12 | N13 | 54.4° | 59.2° |
| C16 | C11 | C12 | H12 | 174.3° | 179.2° |
| C16 | C11 | C12 | H12A | 65.6° | 60.8° |
| C11 | C16 | C15 | C14 | 59.5° | 57.6° |
| C11 | C16 | C15 | H16 | 120.0° | 119.9° |
| C11 | C16 | C15 | H16A | 120.0° | 119.9° |
| C11 | C16 | C15 | H15 | 60.4° | 62.3° |
| C11 | C16 | C15 | H15A | 179.5° | 177.6° |
| C11 | C16 | H16 | H16A | 119.3° | 120.1° |
| C11 | C12 | N13 | H12 | 120.0° | 120.0° |
| C11 | C12 | N13 | H12A | 120.0° | 120.0° |
| C11 | C12 | H12 | H12A | 120.5° | 119.9° |
| C11 | C12 | N13 | C14 | 59.2° | 61.7° |
| C11 | C12 | N13 | HN13 | 60.8° | 62.3° |
| C12 | C11 | C16 | C15 | 56.9° | 57.7° |
| C12 | C11 | C16 | H16 | 63.2° | 62.2° |
| C12 | C11 | C16 | H16A | 176.8° | 177.6° |
| H11 | C11 | C12 | N13 | 64.5° | 60.8° |
| H11 | C11 | C12 | H12 | 55.5° | 59.2° |
| H11 | C11 | C12 | H12A | 175.6° | 179.2° |
| H11 | C11 | C16 | C15 | 62.3° | 62.3° |
| H11 | C11 | C16 | H16 | 177.7° | 177.8° |
| H11 | C11 | C16 | H16A | 57.7° | 57.6° |
| N13 | C12 | H12 | H12A | 120.5° | 120.0° |
| C12 | N13 | C14 | HN13 | 120.0° | 124.1° |
| C12 | N13 | C14 | C15 | 62.2° | 61.7° |
| C12 | N13 | C14 | H14 | 177.8° | 178.2° |
| C12 | N13 | C14 | H14A | 57.8° | 58.3° |
| H12 | C12 | N13 | C14 | 179.2° | 178.2° |
| H12 | C12 | N13 | HN13 | 59.2° | 57.7° |
| H12A | C12 | N13 | C14 | 60.8° | 58.3° |
| H12A | C12 | N13 | HN13 | 179.2° | 177.7° |
| N13 | C14 | C15 | H14 | 120.0° | 120.0° |
| N13 | C14 | C15 | H14A | 120.0° | 120.0° |
| N13 | C14 | H14 | H14A | 121.0° | 119.9° |
| N13 | C14 | C15 | C16 | 59.8° | 59.2° |
| N13 | C14 | C15 | H15 | 60.2° | 60.8° |
| N13 | C14 | C15 | H15A | 179.8° | 179.1° |
| HN13 | N13 | C14 | C15 | 57.8° | 62.4° |
| HN13 | N13 | C14 | H14 | 62.2° | 57.7° |
| HN13 | N13 | C14 | H14A | 177.7° | 177.6° |
| C15 | C14 | H14 | H14A | 121.0° | 120.0° |
| C14 | C15 | C16 | H15 | 120.0° | 119.9° |
| C14 | C15 | C16 | H15A | 120.0° | 120.0° |
| C14 | C15 | H15 | H15A | 120.2° | 120.1° |
| C14 | C15 | C16 | H16 | 60.5° | 62.3° |
| C14 | C15 | C16 | H16A | 179.5° | 177.6° |
| H14 | C14 | C15 | C16 | 179.8° | 179.2° |
| H14 | C14 | C15 | H15 | 59.8° | 59.3° |
| H14 | C14 | C15 | H15A | 60.2° | 60.8° |
| H14A | C14 | C15 | C16 | 60.2° | 60.9° |
| H14A | C14 | C15 | H15 | 179.8° | 179.2° |
| H14A | C14 | C15 | H15A | 59.8° | 59.1° |
| C16 | C15 | H15 | H15A | 120.3° | 120.1° |
| C15 | C16 | H16 | H16A | 119.3° | 120.2° |
| H15 | C15 | C16 | H16 | 179.5° | 177.8° |
| H15 | C15 | C16 | H16A | 59.6° | 57.6° |
| H15A | C15 | C16 | H16 | 59.5° | 57.7° |
| H15A | C15 | C16 | H16A | 60.5° | 62.5° |
| S28 | C18 | N19 | C20 | 0.6° | 6.0° |
| S28 | C18 | N19 | HN19 | 179.4° | 174.0° |
| C18 | S28 | C29 | C30 | 180.0° | 179.1° |
| C18 | N19 | C20 | HN19 | 180.0° | 180.0° |
| C18 | N19 | C20 | C27 | 43.8° | 41.4° |
| C18 | N19 | C20 | C21 | 137.8° | 138.2° |
| N19 | C18 | S28 | C29 | 179.9° | 179.8° |
| N19 | C20 | C27 | C21 | 178.4° | 179.7° |
| N19 | C20 | C21 | C23 | 179.4° | 180.0° |
| N19 | C20 | C21 | F22 | 0.9° | 0.0° |
| N19 | C20 | C27 | C26 | 178.9° | 179.8° |
| N19 | C20 | C27 | H27 | 1.1° | 0.4° |
| HN19 | N19 | C20 | C27 | 136.2° | 138.6° |
| HN19 | N19 | C20 | C21 | 42.2° | 41.7° |
| C27 | C20 | C21 | C23 | 0.9° | 0.3° |
| C27 | C20 | C21 | F22 | 179.4° | 179.7° |
| C20 | C27 | C26 | C24 | 0.0° | 0.5° |
| C20 | C27 | C26 | H27 | 180.0° | 179.4° |
| C20 | C27 | C26 | H26 | 180.0° | 179.7° |
| C20 | C21 | C23 | F22 | 179.7° | 179.9° |
| C20 | C21 | C23 | C24 | 0.6° | 0.0° |
| C20 | C21 | C23 | H23 | 179.4° | 179.9° |
| C21 | C20 | C27 | C26 | 0.5° | 0.5° |
| C21 | C20 | C27 | H27 | 179.4° | 180.0° |
| C21 | C23 | C24 | H23 | 180.0° | 179.9° |
| C21 | C23 | C24 | I25 | 179.7° | 180.0° |
| C21 | C23 | C24 | C26 | 0.0° | 0.0° |
| F22 | C21 | C23 | C24 | 179.7° | 179.9° |
| F22 | C21 | C23 | H23 | 0.3° | 0.1° |
| C23 | C24 | I25 | C26 | 179.7° | 180.0° |
| C23 | C24 | C26 | C27 | 0.3° | 0.2° |
| C23 | C24 | C26 | H26 | 179.7° | 179.9° |
| H23 | C23 | C24 | I25 | 0.3° | 0.1° |
| H23 | C23 | C24 | C26 | 179.9° | 180.0° |
| I25 | C24 | C26 | C27 | 180.0° | 179.7° |
| I25 | C24 | C26 | H26 | 0.0° | 0.1° |
| C24 | C26 | C27 | H26 | 180.0° | 179.8° |
| C24 | C26 | C27 | H27 | 180.0° | 179.9° |
| H26 | C26 | C27 | H27 | 0.0° | 0.2° |
| S28 | C29 | C30 | O31 | 51.2° | 43.6° |
