F20
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.55Å | 1.50Å | |
| C1 | S5 | sing | 1.84Å | 1.77Å | |
| C1 | C11 | sing | 1.51Å | 1.52Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | C3 | sing | 1.50Å | 1.50Å | |
| C2 | H2C1 | sing | 1.09Å | 1.10Å | |
| C2 | H2C2 | sing | 1.09Å | 1.10Å | |
| C3 | N4 | sing | 1.34Å | 1.34Å | |
| C3 | O9 | doub | 1.21Å | 1.24Å | |
| N4 | S5 | sing | 1.68Å | 1.82Å | |
| N4 | H4 | sing | 0.97Å | 1.00Å | |
| S5 | O6 | doub | 1.42Å | 1.65Å | |
| S5 | O7 | doub | 1.42Å | 1.69Å | |
| C11 | C12 | doub | 1.38Å | 1.46Å | Aromatic |
| C11 | C16 | sing | 1.38Å | 1.47Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.46Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | C14 | doub | 1.38Å | 1.47Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C14 | C15 | sing | 1.38Å | 1.45Å | Aromatic |
| C14 | C21 | sing | 1.51Å | 1.51Å | |
| C15 | C16 | doub | 1.38Å | 1.46Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C21 | C22 | sing | 1.53Å | 1.53Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C22 | C25 | sing | 1.51Å | 1.51Å | |
| C22 | N45 | sing | 1.47Å | 1.46Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | O26 | doub | 1.21Å | 1.21Å | |
| C25 | N27 | sing | 1.35Å | 1.33Å | |
| N27 | H271 | sing | 0.97Å | 1.00Å | |
| N27 | H272 | sing | 0.97Å | 1.00Å | |
| N45 | C47 | sing | 1.35Å | 1.32Å | |
| N45 | H45 | sing | 0.97Å | 1.00Å | |
| C47 | C48 | sing | 1.51Å | 1.52Å | |
| C47 | O49 | doub | 1.21Å | 1.22Å | |
| C48 | N51 | sing | 1.46Å | 1.47Å | |
| C48 | C4 | sing | 1.53Å | 1.52Å | |
| C48 | H48 | sing | 1.09Å | 1.10Å | |
| N51 | C67 | sing | 1.35Å | 1.33Å | |
| N51 | H51 | sing | 0.97Å | 1.00Å | |
| C4 | C5 | sing | 1.51Å | 1.51Å | |
| C4 | H4C1 | sing | 1.09Å | 1.10Å | |
| C4 | H4C2 | sing | 1.09Å | 1.10Å | |
| C5 | C30 | doub | 1.38Å | 1.47Å | Aromatic |
| C5 | C34 | sing | 1.38Å | 1.47Å | Aromatic |
| C30 | C31 | sing | 1.38Å | 1.47Å | Aromatic |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C31 | C6 | doub | 1.38Å | 1.47Å | Aromatic |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C6 | C33 | sing | 1.38Å | 1.47Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C33 | C34 | doub | 1.38Å | 1.46Å | Aromatic |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C67 | O70 | doub | 1.22Å | 1.23Å | |
| C67 | C71 | sing | 1.48Å | 1.52Å | |
| C71 | C74 | doub | 1.40Å | 1.47Å | Aromatic |
| C71 | C78 | sing | 1.40Å | 1.47Å | Aromatic |
| C74 | C75 | sing | 1.38Å | 1.47Å | Aromatic |
| C74 | H74 | sing | 1.08Å | 1.08Å | |
| C75 | C76 | doub | 1.38Å | 1.47Å | Aromatic |
| C75 | H75 | sing | 1.08Å | 1.08Å | |
| C76 | C77 | sing | 1.38Å | 1.47Å | Aromatic |
| C76 | H76 | sing | 1.08Å | 1.08Å | |
| C77 | C78 | doub | 1.38Å | 1.47Å | Aromatic |
| C77 | H77 | sing | 1.08Å | 1.08Å | |
| C78 | H78 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | S5 | 102.8° | 99.1° |
| C2 | C1 | C11 | 116.3° | 111.5° |
| C2 | C1 | H1 | 110.5° | 111.5° |
| C1 | C2 | C3 | 109.2° | 108.6° |
| C1 | C2 | H2C1 | 109.6° | 109.7° |
| C1 | C2 | H2C2 | 109.6° | 109.7° |
| S5 | C1 | C11 | 112.1° | 111.5° |
| S5 | C1 | H1 | 114.8° | 111.5° |
| C1 | S5 | N4 | 93.3° | 99.5° |
| C1 | S5 | O6 | 109.5° | 112.1° |
| C1 | S5 | O7 | 105.5° | 112.1° |
| C11 | C1 | H1 | 100.8° | 111.3° |
| C1 | C11 | C12 | 120.4° | 120.0° |
| C1 | C11 | C16 | 119.4° | 120.0° |
| C3 | C2 | H2C1 | 109.7° | 109.6° |
| C3 | C2 | H2C2 | 109.6° | 109.7° |
| C2 | C3 | N4 | 114.4° | 118.5° |
| C2 | C3 | O9 | 124.7° | 120.8° |
| H2C1 | C2 | H2C2 | 109.2° | 109.6° |
| N4 | C3 | O9 | 120.9° | 120.8° |
| C3 | N4 | S5 | 108.5° | 107.9° |
| C3 | N4 | H4 | 125.7° | 126.0° |
| S5 | N4 | H4 | 125.8° | 126.1° |
| N4 | S5 | O6 | 119.4° | 103.4° |
| N4 | S5 | O7 | 109.6° | 103.3° |
| O6 | S5 | O7 | 116.2° | 122.7° |
| C12 | C11 | C16 | 120.2° | 120.0° |
| C11 | C12 | C13 | 119.6° | 120.0° |
| C11 | C12 | H12 | 120.2° | 120.0° |
| C11 | C16 | C15 | 120.1° | 120.0° |
| C11 | C16 | H16 | 119.9° | 120.0° |
| C13 | C12 | H12 | 120.2° | 120.0° |
| C12 | C13 | C14 | 119.8° | 120.0° |
| C12 | C13 | H13 | 120.1° | 120.0° |
| C14 | C13 | H13 | 120.1° | 120.0° |
| C13 | C14 | C15 | 120.3° | 120.0° |
| C13 | C14 | C21 | 120.0° | 120.0° |
| C15 | C14 | C21 | 119.7° | 120.0° |
| C14 | C15 | C16 | 120.0° | 120.0° |
| C14 | C15 | H15 | 120.0° | 120.0° |
| C14 | C21 | C22 | 113.0° | 109.5° |
| C14 | C21 | H211 | 107.5° | 109.5° |
| C14 | C21 | H212 | 108.3° | 109.5° |
| C16 | C15 | H15 | 120.0° | 120.0° |
| C15 | C16 | H16 | 120.0° | 120.0° |
| C22 | C21 | H211 | 107.5° | 109.5° |
| C22 | C21 | H212 | 108.3° | 109.4° |
| C21 | C22 | C25 | 110.5° | 109.5° |
| C21 | C22 | N45 | 108.1° | 109.4° |
| C21 | C22 | H22 | 109.4° | 109.5° |
| H211 | C21 | H212 | 112.3° | 109.4° |
| C25 | C22 | N45 | 108.8° | 109.5° |
| C25 | C22 | H22 | 108.8° | 109.5° |
| C22 | C25 | O26 | 121.8° | 120.0° |
| C22 | C25 | N27 | 117.8° | 120.0° |
| N45 | C22 | H22 | 111.2° | 109.4° |
| C22 | N45 | C47 | 116.1° | 120.0° |
| C22 | N45 | H45 | 121.9° | 120.0° |
| O26 | C25 | N27 | 120.4° | 120.0° |
| C25 | N27 | H271 | 124.8° | 120.0° |
| C25 | N27 | H272 | 110.3° | 120.0° |
| H271 | N27 | H272 | 124.8° | 120.0° |
| C47 | N45 | H45 | 121.9° | 120.0° |
| N45 | C47 | C48 | 117.4° | 120.0° |
| N45 | C47 | O49 | 120.3° | 120.0° |
| C48 | C47 | O49 | 122.3° | 120.0° |
| C47 | C48 | N51 | 111.4° | 109.5° |
| C47 | C48 | C4 | 110.2° | 109.5° |
| C47 | C48 | H48 | 107.3° | 109.4° |
| N51 | C48 | C4 | 108.4° | 109.5° |
| N51 | C48 | H48 | 109.2° | 109.5° |
| C48 | N51 | C67 | 108.9° | 120.0° |
| C48 | N51 | H51 | 125.6° | 120.0° |
| C4 | C48 | H48 | 110.4° | 109.5° |
| C48 | C4 | C5 | 113.2° | 109.5° |
| C48 | C4 | H4C1 | 107.4° | 109.4° |
| C48 | C4 | H4C2 | 108.2° | 109.4° |
| C67 | N51 | H51 | 125.5° | 120.0° |
| N51 | C67 | O70 | 119.8° | 120.0° |
| N51 | C67 | C71 | 120.2° | 120.0° |
| C5 | C4 | H4C1 | 107.4° | 109.5° |
| C5 | C4 | H4C2 | 108.3° | 109.5° |
| C4 | C5 | C30 | 119.8° | 120.0° |
| C4 | C5 | C34 | 120.0° | 120.0° |
| H4C1 | C4 | H4C2 | 112.4° | 109.5° |
| C30 | C5 | C34 | 120.2° | 120.0° |
| C5 | C30 | C31 | 119.9° | 120.0° |
| C5 | C30 | H30 | 120.0° | 120.0° |
| C5 | C34 | C33 | 119.9° | 120.0° |
| C5 | C34 | H34 | 120.0° | 120.0° |
| C31 | C30 | H30 | 120.0° | 120.0° |
| C30 | C31 | C6 | 119.8° | 120.0° |
| C30 | C31 | H31 | 120.1° | 120.0° |
| C6 | C31 | H31 | 120.1° | 120.0° |
| C31 | C6 | C33 | 120.3° | 120.0° |
| C31 | C6 | H6 | 119.8° | 120.0° |
| C33 | C6 | H6 | 119.9° | 120.0° |
| C6 | C33 | C34 | 119.8° | 120.0° |
| C6 | C33 | H33 | 120.1° | 120.0° |
| C34 | C33 | H33 | 120.1° | 120.0° |
| C33 | C34 | H34 | 120.0° | 120.1° |
| O70 | C67 | C71 | 120.0° | 120.0° |
| C67 | C71 | C74 | 119.8° | 120.1° |
| C67 | C71 | C78 | 120.1° | 120.1° |
| C74 | C71 | C78 | 120.1° | 119.7° |
| C71 | C74 | C75 | 119.9° | 119.9° |
| C71 | C74 | H74 | 120.0° | 120.1° |
| C71 | C78 | C77 | 119.9° | 119.8° |
| C71 | C78 | H78 | 120.0° | 120.1° |
| C75 | C74 | H74 | 120.0° | 120.0° |
| C74 | C75 | C76 | 119.9° | 120.1° |
| C74 | C75 | H75 | 120.0° | 120.0° |
| C76 | C75 | H75 | 120.0° | 119.9° |
| C75 | C76 | C77 | 120.2° | 120.3° |
| C75 | C76 | H76 | 119.9° | 119.8° |
| C77 | C76 | H76 | 119.9° | 119.9° |
| C76 | C77 | C78 | 119.9° | 120.2° |
| C76 | C77 | H77 | 120.1° | 119.9° |
| C78 | C77 | H77 | 120.0° | 119.9° |
| C77 | C78 | H78 | 120.0° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | S5 | C11 | 125.7° | 117.5° |
| C2 | C1 | S5 | H1 | 120.0° | 117.5° |
| C2 | C1 | C11 | H1 | 119.5° | 125.1° |
| C1 | C2 | C3 | H2C1 | 120.1° | 119.8° |
| C1 | C2 | C3 | H2C2 | 120.0° | 119.9° |
| C1 | C2 | H2C1 | H2C2 | 120.1° | 120.5° |
| C1 | C2 | C3 | N4 | 23.1° | 19.2° |
| C1 | C2 | C3 | O9 | 156.9° | 161.0° |
| C2 | C1 | S5 | N4 | 30.0° | 21.9° |
| C2 | C1 | S5 | O6 | 152.9° | 86.9° |
| C2 | C1 | S5 | O7 | 81.3° | 130.6° |
| C2 | C1 | C11 | C12 | 29.7° | 124.4° |
| C2 | C1 | C11 | C16 | 149.8° | 55.5° |
| S5 | C1 | C11 | H1 | 122.6° | 125.1° |
| S5 | C1 | C2 | C3 | 34.4° | 24.0° |
| S5 | C1 | C2 | H2C1 | 154.5° | 143.8° |
| S5 | C1 | C2 | H2C2 | 85.6° | 95.9° |
| C1 | S5 | N4 | C3 | 18.8° | 13.0° |
| C1 | S5 | N4 | O6 | 114.7° | 115.6° |
| C1 | S5 | N4 | O7 | 107.8° | 115.6° |
| C1 | S5 | N4 | H4 | 161.2° | 167.0° |
| C1 | S5 | O6 | O7 | 119.4° | 138.0° |
| S5 | C1 | C11 | C12 | 88.2° | 125.9° |
| S5 | C1 | C11 | C16 | 92.3° | 54.3° |
| C11 | C1 | C2 | C3 | 157.3° | 93.5° |
| C11 | C1 | C2 | H2C1 | 82.6° | 26.3° |
| C11 | C1 | C2 | H2C2 | 37.3° | 146.6° |
| C11 | C1 | S5 | N4 | 155.7° | 95.7° |
| C11 | C1 | S5 | O6 | 81.4° | 155.6° |
| C11 | C1 | S5 | O7 | 44.4° | 13.1° |
| C1 | C11 | C12 | C16 | 179.5° | 179.9° |
| C1 | C11 | C12 | C13 | 180.0° | 180.0° |
| C1 | C11 | C12 | H12 | 0.0° | 0.1° |
| C1 | C11 | C16 | C15 | 180.0° | 179.8° |
| C1 | C11 | C16 | H16 | 0.0° | 0.1° |
| H1 | C1 | C2 | C3 | 88.6° | 141.5° |
| H1 | C1 | C2 | H2C1 | 31.5° | 98.8° |
| H1 | C1 | C2 | H2C2 | 151.4° | 21.6° |
| H1 | C1 | S5 | N4 | 90.0° | 139.3° |
| H1 | C1 | S5 | O6 | 32.9° | 30.6° |
| H1 | C1 | S5 | O7 | 158.7° | 111.9° |
| H1 | C1 | C11 | C12 | 149.2° | 0.8° |
| H1 | C1 | C11 | C16 | 30.3° | 179.3° |
| C3 | C2 | H2C1 | H2C2 | 120.1° | 120.4° |
| C2 | C3 | N4 | O9 | 179.9° | 179.9° |
| C2 | C3 | N4 | S5 | 0.3° | 1.8° |
| C2 | C3 | N4 | H4 | 179.7° | 178.2° |
| H2C1 | C2 | C3 | N4 | 143.3° | 139.0° |
| H2C1 | C2 | C3 | O9 | 36.8° | 41.1° |
| H2C2 | C2 | C3 | N4 | 96.9° | 100.7° |
| H2C2 | C2 | C3 | O9 | 83.1° | 79.2° |
| C3 | N4 | S5 | H4 | 180.0° | 180.0° |
| C3 | N4 | S5 | O6 | 133.5° | 102.6° |
| C3 | N4 | S5 | O7 | 89.0° | 128.6° |
| O9 | C3 | N4 | S5 | 179.6° | 178.4° |
| O9 | C3 | N4 | H4 | 0.3° | 1.6° |
| N4 | S5 | O6 | O7 | 134.9° | 115.7° |
| H4 | N4 | S5 | O6 | 46.6° | 77.4° |
| H4 | N4 | S5 | O7 | 91.0° | 51.4° |
| C11 | C12 | C13 | H12 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 0.1° | 0.1° |
| C11 | C12 | C13 | H13 | 179.9° | 180.0° |
| C12 | C11 | C16 | C15 | 0.5° | 0.3° |
| C12 | C11 | C16 | H16 | 179.5° | 179.9° |
| C16 | C11 | C12 | C13 | 0.5° | 0.1° |
| C16 | C11 | C12 | H12 | 179.5° | 180.0° |
| C11 | C16 | C15 | C14 | 0.0° | 0.5° |
| C11 | C16 | C15 | H16 | 180.0° | 179.8° |
| C11 | C16 | C15 | H15 | 180.0° | 180.0° |
| C12 | C13 | C14 | H13 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 0.3° | 0.3° |
| C12 | C13 | C14 | C21 | 179.7° | 179.9° |
| H12 | C12 | C13 | C14 | 179.9° | 180.0° |
| H12 | C12 | C13 | H13 | 0.1° | 0.0° |
| C13 | C14 | C15 | C21 | 180.0° | 179.8° |
| C13 | C14 | C15 | C16 | 0.4° | 0.5° |
| C13 | C14 | C15 | H15 | 179.6° | 180.0° |
| C13 | C14 | C21 | C22 | 109.5° | 90.0° |
| C13 | C14 | C21 | H211 | 132.0° | 30.1° |
| C13 | C14 | C21 | H212 | 10.5° | 150.0° |
| H13 | C13 | C14 | C15 | 179.7° | 179.8° |
| H13 | C13 | C14 | C21 | 0.3° | 0.0° |
| C14 | C15 | C16 | H15 | 180.0° | 179.6° |
| C14 | C15 | C16 | H16 | 180.0° | 179.7° |
| C15 | C14 | C21 | C22 | 70.5° | 90.2° |
| C15 | C14 | C21 | H211 | 48.0° | 149.7° |
| C15 | C14 | C21 | H212 | 169.5° | 29.8° |
| C21 | C14 | C15 | C16 | 179.6° | 179.7° |
| C21 | C14 | C15 | H15 | 0.4° | 0.2° |
| C14 | C21 | C22 | H211 | 118.4° | 120.1° |
| C14 | C21 | C22 | H212 | 120.0° | 120.0° |
| C14 | C21 | H211 | H212 | 119.0° | 120.0° |
| C14 | C21 | C22 | C25 | 68.7° | 175.0° |
| C14 | C21 | C22 | N45 | 172.3° | 65.0° |
| C14 | C21 | C22 | H22 | 51.1° | 54.9° |
| H15 | C15 | C16 | H16 | 0.0° | 0.2° |
| C22 | C21 | H211 | H212 | 119.0° | 120.0° |
| C21 | C22 | C25 | N45 | 118.6° | 120.0° |
| C21 | C22 | C25 | H22 | 120.2° | 120.1° |
| C21 | C22 | N45 | H22 | 120.1° | 120.0° |
| C21 | C22 | C25 | O26 | 103.8° | 120.0° |
| C21 | C22 | C25 | N27 | 76.8° | 60.0° |
| C21 | C22 | N45 | C47 | 145.0° | 155.0° |
| C21 | C22 | N45 | H45 | 35.0° | 25.0° |
| H211 | C21 | C22 | C25 | 172.8° | 64.9° |
| H211 | C21 | C22 | N45 | 53.9° | 55.0° |
| H211 | C21 | C22 | H22 | 67.3° | 175.0° |
| H212 | C21 | C22 | C25 | 51.3° | 55.0° |
| H212 | C21 | C22 | N45 | 67.6° | 175.0° |
| H212 | C21 | C22 | H22 | 171.1° | 65.1° |
| C25 | C22 | N45 | H22 | 119.8° | 120.0° |
| C22 | C25 | O26 | N27 | 179.3° | 180.0° |
| C22 | C25 | N27 | H271 | 179.7° | 180.0° |
| C22 | C25 | N27 | H272 | 0.3° | 0.3° |
| C25 | C22 | N45 | C47 | 94.9° | 85.0° |
| C25 | C22 | N45 | H45 | 85.0° | 95.0° |
| N45 | C22 | C25 | O26 | 137.6° | 0.0° |
| N45 | C22 | C25 | N27 | 41.7° | 180.0° |
| C22 | N45 | C47 | H45 | 180.0° | 180.0° |
| C22 | N45 | C47 | C48 | 179.4° | 179.9° |
| C22 | N45 | C47 | O49 | 0.7° | 0.0° |
| H22 | C22 | C25 | O26 | 16.4° | 120.0° |
| H22 | C22 | C25 | N27 | 163.0° | 60.0° |
| H22 | C22 | N45 | C47 | 24.9° | 35.0° |
| H22 | C22 | N45 | H45 | 155.1° | 145.0° |
| O26 | C25 | N27 | H271 | 0.4° | 0.0° |
| O26 | C25 | N27 | H272 | 179.7° | 179.7° |
| C25 | N27 | H271 | H272 | 179.9° | 179.7° |
| N45 | C47 | C48 | O49 | 178.7° | 179.9° |
| N45 | C47 | C48 | N51 | 160.3° | 180.0° |
| N45 | C47 | C48 | C4 | 79.4° | 59.9° |
| N45 | C47 | C48 | H48 | 40.9° | 60.0° |
| H45 | N45 | C47 | C48 | 0.6° | 0.0° |
| H45 | N45 | C47 | O49 | 179.3° | 180.0° |
| C47 | C48 | N51 | C4 | 121.4° | 120.1° |
| C47 | C48 | N51 | H48 | 118.3° | 120.0° |
| C47 | C48 | C4 | H48 | 118.3° | 120.0° |
| C47 | C48 | N51 | C67 | 109.5° | 155.0° |
| C47 | C48 | N51 | H51 | 70.6° | 25.0° |
| C47 | C48 | C4 | C5 | 165.3° | 175.0° |
| C47 | C48 | C4 | H4C1 | 46.9° | 65.0° |
| C47 | C48 | C4 | H4C2 | 74.7° | 55.0° |
| O49 | C47 | C48 | N51 | 18.4° | 0.0° |
| O49 | C47 | C48 | C4 | 101.9° | 120.0° |
| O49 | C47 | C48 | H48 | 137.9° | 120.0° |
| N51 | C48 | C4 | H48 | 119.6° | 120.0° |
| C48 | N51 | C67 | H51 | 180.0° | 180.0° |
| N51 | C48 | C4 | C5 | 72.6° | 65.0° |
| N51 | C48 | C4 | H4C1 | 169.0° | 55.0° |
| N51 | C48 | C4 | H4C2 | 47.4° | 175.1° |
| C48 | N51 | C67 | O70 | 1.0° | 0.0° |
| C48 | N51 | C67 | C71 | 179.0° | 180.0° |
| C4 | C48 | N51 | C67 | 129.1° | 85.0° |
| C4 | C48 | N51 | H51 | 50.8° | 95.0° |
| C48 | C4 | C5 | H4C1 | 118.4° | 120.0° |
| C48 | C4 | C5 | H4C2 | 120.0° | 119.9° |
| C48 | C4 | H4C1 | H4C2 | 119.0° | 120.0° |
| C48 | C4 | C5 | C30 | 95.3° | 90.0° |
| C48 | C4 | C5 | C34 | 84.8° | 90.3° |
| H48 | C48 | N51 | C67 | 8.8° | 35.0° |
| H48 | C48 | N51 | H51 | 171.1° | 145.0° |
| H48 | C48 | C4 | C5 | 46.9° | 55.0° |
| H48 | C48 | C4 | H4C1 | 71.4° | 175.0° |
| H48 | C48 | C4 | H4C2 | 166.9° | 65.0° |
| N51 | C67 | O70 | C71 | 179.9° | 180.0° |
| N51 | C67 | C71 | C74 | 146.4° | 180.0° |
| N51 | C67 | C71 | C78 | 33.5° | 0.2° |
| H51 | N51 | C67 | O70 | 179.0° | 180.0° |
| H51 | N51 | C67 | C71 | 0.9° | 0.0° |
| C5 | C4 | H4C1 | H4C2 | 119.0° | 120.1° |
| C4 | C5 | C30 | C34 | 179.9° | 179.7° |
| C4 | C5 | C30 | C31 | 179.8° | 180.0° |
| C4 | C5 | C30 | H30 | 0.3° | 0.0° |
| C4 | C5 | C34 | C33 | 179.8° | 179.8° |
| C4 | C5 | C34 | H34 | 0.2° | 0.3° |
| H4C1 | C4 | C5 | C30 | 23.1° | 30.0° |
| H4C1 | C4 | C5 | C34 | 156.8° | 149.7° |
| H4C2 | C4 | C5 | C30 | 144.8° | 150.1° |
| H4C2 | C4 | C5 | C34 | 35.2° | 29.6° |
| C5 | C30 | C31 | H30 | 180.0° | 180.0° |
| C5 | C30 | C31 | C6 | 0.2° | 0.0° |
| C5 | C30 | C31 | H31 | 179.8° | 179.9° |
| C30 | C5 | C34 | C33 | 0.1° | 0.5° |
| C30 | C5 | C34 | H34 | 179.9° | 180.0° |
| C34 | C5 | C30 | C31 | 0.2° | 0.3° |
| C34 | C5 | C30 | H30 | 179.8° | 179.7° |
| C5 | C34 | C33 | C6 | 0.3° | 0.4° |
| C5 | C34 | C33 | H34 | 180.0° | 179.5° |
| C5 | C34 | C33 | H33 | 179.7° | 179.7° |
| C30 | C31 | C6 | H31 | 180.0° | 179.9° |
| C30 | C31 | C6 | C33 | 0.6° | 0.1° |
| C30 | C31 | C6 | H6 | 179.4° | 179.9° |
| H30 | C30 | C31 | C6 | 179.8° | 180.0° |
| H30 | C30 | C31 | H31 | 0.1° | 0.1° |
| C31 | C6 | C33 | H6 | 180.0° | 180.0° |
| C31 | C6 | C33 | C34 | 0.6° | 0.1° |
| C31 | C6 | C33 | H33 | 179.4° | 180.0° |
| H31 | C31 | C6 | C33 | 179.4° | 180.0° |
| H31 | C31 | C6 | H6 | 0.6° | 0.1° |
| C6 | C33 | C34 | H33 | 180.0° | 179.9° |
| C6 | C33 | C34 | H34 | 179.8° | 179.9° |
| H6 | C6 | C33 | C34 | 179.4° | 179.8° |
| H6 | C6 | C33 | H33 | 0.6° | 0.1° |
| H33 | C33 | C34 | H34 | 0.2° | 0.2° |
| O70 | C67 | C71 | C74 | 33.6° | 0.0° |
| O70 | C67 | C71 | C78 | 146.5° | 179.7° |
| C67 | C71 | C74 | C78 | 179.9° | 179.7° |
| C67 | C71 | C74 | C75 | 177.4° | 180.0° |
| C67 | C71 | C74 | H74 | 2.6° | 0.0° |
| C67 | C71 | C78 | C77 | 177.1° | 179.7° |
| C67 | C71 | C78 | H78 | 2.9° | 0.2° |
| C71 | C74 | C75 | H74 | 180.0° | 180.0° |
| C71 | C74 | C75 | C76 | 0.4° | 0.0° |
| C71 | C74 | C75 | H75 | 179.5° | 180.0° |
| C74 | C71 | C78 | C77 | 2.8° | 0.6° |
| C74 | C71 | C78 | H78 | 177.2° | 180.0° |
| C78 | C71 | C74 | C75 | 2.5° | 0.3° |
| C78 | C71 | C74 | H74 | 177.5° | 179.7° |
| C71 | C78 | C77 | C76 | 1.0° | 0.6° |
| C71 | C78 | C77 | H78 | 180.0° | 179.5° |
| C71 | C78 | C77 | H77 | 179.1° | 179.7° |
| C74 | C75 | C76 | H75 | 180.0° | 180.0° |
| C74 | C75 | C76 | C77 | 1.4° | 0.0° |
| C74 | C75 | C76 | H76 | 178.6° | 179.9° |
| H74 | C74 | C75 | C76 | 179.6° | 180.0° |
| H74 | C74 | C75 | H75 | 0.4° | 0.0° |
| C75 | C76 | C77 | H76 | 180.0° | 179.9° |
| C75 | C76 | C77 | C78 | 1.1° | 0.3° |
| C75 | C76 | C77 | H77 | 178.9° | 180.0° |
| H75 | C75 | C76 | C77 | 178.6° | 179.9° |
| H75 | C75 | C76 | H76 | 1.4° | 0.0° |
| C76 | C77 | C78 | H77 | 180.0° | 179.7° |
| C76 | C77 | C78 | H78 | 179.0° | 179.9° |
| H76 | C76 | C77 | C78 | 178.9° | 179.8° |
| H76 | C76 | C77 | H77 | 1.1° | 0.1° |
| H77 | C77 | C78 | H78 | 1.0° | 0.2° |
