051
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N30 | C30 | trip | 1.14Å | 1.16Å | |
| C30 | C27 | sing | 1.43Å | 1.29Å | |
| C27 | C26 | sing | 1.40Å | 1.39Å | Aromatic |
| C27 | C28 | doub | 1.40Å | 1.39Å | Aromatic |
| C26 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C25 | F25 | sing | 1.35Å | 1.35Å | |
| C25 | C24 | sing | 1.39Å | 1.38Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.51Å | 1.48Å | |
| C23 | O22 | sing | 1.43Å | 1.45Å | |
| O22 | C20 | sing | 1.36Å | 1.39Å | |
| C20 | C21 | sing | 1.37Å | 1.41Å | Aromatic |
| C20 | C19 | doub | 1.40Å | 1.40Å | Aromatic |
| C21 | C15 | doub | 1.40Å | 1.41Å | Aromatic |
| C15 | C14 | sing | 1.41Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.42Å | 1.42Å | Aromatic |
| C14 | C13 | doub | 1.36Å | 1.40Å | Aromatic |
| C13 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
| C19 | C18 | sing | 1.36Å | 1.41Å | Aromatic |
| C18 | C16 | doub | 1.41Å | 1.39Å | Aromatic |
| C16 | C17 | sing | 1.41Å | 1.40Å | Aromatic |
| C17 | C12 | doub | 1.36Å | 1.41Å | Aromatic |
| C12 | S11 | sing | 1.76Å | 1.64Å | |
| S11 | O32 | doub | 1.42Å | 1.47Å | |
| S11 | O33 | doub | 1.42Å | 1.48Å | |
| S11 | N | sing | 1.66Å | 1.56Å | |
| N | C1 | sing | 1.47Å | 1.47Å | |
| C1 | C3 | sing | 1.53Å | 1.53Å | |
| C1 | C2 | sing | 1.53Å | 1.47Å | |
| C3 | C6 | sing | 1.53Å | 1.53Å | |
| C6 | C4 | sing | 1.53Å | 1.54Å | |
| C4 | C8 | sing | 1.51Å | 1.50Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C8 | O4 | sing | 1.34Å | 1.26Å | |
| C8 | O3 | doub | 1.21Å | 1.26Å | |
| C5 | C2 | sing | 1.53Å | 1.53Å | |
| C2 | C7 | sing | 1.51Å | 1.36Å | |
| C7 | O1 | sing | 1.34Å | 1.26Å | |
| C7 | O2 | doub | 1.21Å | 1.23Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H31C | sing | 1.09Å | 1.10Å | |
| C3 | H32C | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H61C | sing | 1.09Å | 1.10Å | |
| C6 | H62C | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H51C | sing | 1.09Å | 1.10Å | |
| C5 | H52C | sing | 1.09Å | 1.10Å | |
| O4 | HA | sing | 0.97Å | 0.95Å | |
| O1 | HB | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N30 | C30 | C27 | 176.6° | 180.0° |
| C30 | C27 | C26 | 120.0° | 120.1° |
| C30 | C27 | C28 | 119.8° | 120.2° |
| C26 | C27 | C28 | 120.2° | 119.7° |
| C27 | C26 | C25 | 119.9° | 119.8° |
| C27 | C26 | H26 | 120.0° | 120.1° |
| C27 | C28 | C29 | 119.9° | 119.9° |
| C27 | C28 | H28 | 120.0° | 120.0° |
| C26 | C25 | F25 | 120.9° | 119.9° |
| C26 | C25 | C24 | 119.5° | 120.1° |
| C25 | C26 | H26 | 120.1° | 120.1° |
| F25 | C25 | C24 | 119.6° | 119.9° |
| C25 | C24 | C29 | 121.3° | 120.3° |
| C25 | C24 | C23 | 119.9° | 119.9° |
| C28 | C29 | C24 | 119.2° | 120.1° |
| C29 | C28 | H28 | 120.1° | 120.0° |
| C28 | C29 | H29 | 120.4° | 119.9° |
| C29 | C24 | C23 | 118.8° | 119.8° |
| C24 | C29 | H29 | 120.4° | 120.0° |
| C24 | C23 | O22 | 119.3° | 109.5° |
| C24 | C23 | H231 | 106.3° | 109.5° |
| C24 | C23 | H232 | 104.0° | 109.5° |
| C23 | O22 | C20 | 102.8° | 117.1° |
| O22 | C23 | H231 | 106.3° | 109.4° |
| O22 | C23 | H232 | 104.0° | 109.5° |
| O22 | C20 | C21 | 119.5° | 119.6° |
| O22 | C20 | C19 | 121.1° | 119.5° |
| C21 | C20 | C19 | 119.3° | 120.9° |
| C20 | C21 | C15 | 120.9° | 119.6° |
| C20 | C21 | H21 | 119.6° | 120.2° |
| C20 | C19 | C18 | 119.6° | 120.9° |
| C20 | C19 | H19 | 120.2° | 119.6° |
| C21 | C15 | C14 | 120.7° | 121.2° |
| C21 | C15 | C16 | 119.5° | 119.4° |
| C15 | C21 | H21 | 119.5° | 120.2° |
| C14 | C15 | C16 | 119.7° | 119.4° |
| C15 | C14 | C13 | 120.2° | 119.6° |
| C15 | C14 | H14 | 119.9° | 120.2° |
| C15 | C16 | C18 | 118.8° | 119.5° |
| C15 | C16 | C17 | 119.1° | 119.3° |
| C14 | C13 | C12 | 120.8° | 121.0° |
| C13 | C14 | H14 | 119.8° | 120.2° |
| C14 | C13 | H13 | 119.6° | 119.6° |
| C13 | C12 | C17 | 118.7° | 121.0° |
| C13 | C12 | S11 | 116.6° | 119.5° |
| C12 | C13 | H13 | 119.6° | 119.5° |
| C19 | C18 | C16 | 121.9° | 119.7° |
| C18 | C19 | H19 | 120.2° | 119.5° |
| C19 | C18 | H18 | 119.1° | 120.1° |
| C18 | C16 | C17 | 122.0° | 121.2° |
| C16 | C18 | H18 | 119.1° | 120.2° |
| C16 | C17 | C12 | 121.3° | 119.7° |
| C16 | C17 | H17 | 119.4° | 120.2° |
| C17 | C12 | S11 | 124.6° | 119.5° |
| C12 | C17 | H17 | 119.3° | 120.2° |
| C12 | S11 | O32 | 114.1° | 106.4° |
| C12 | S11 | O33 | 110.1° | 106.4° |
| C12 | S11 | N | 103.0° | 107.2° |
| O32 | S11 | O33 | 115.3° | 123.2° |
| O32 | S11 | N | 104.5° | 106.4° |
| O33 | S11 | N | 108.8° | 106.4° |
| S11 | N | C1 | 123.3° | 120.0° |
| S11 | N | H | 105.1° | 120.0° |
| N | C1 | C3 | 117.3° | 109.5° |
| N | C1 | C2 | 117.6° | 109.5° |
| C1 | N | H | 105.1° | 119.9° |
| N | C1 | H1 | 97.4° | 109.4° |
| C3 | C1 | C2 | 113.4° | 109.5° |
| C1 | C3 | C6 | 106.4° | 109.5° |
| C3 | C1 | H1 | 103.9° | 109.5° |
| C1 | C3 | H31C | 110.5° | 109.4° |
| C1 | C3 | H32C | 111.2° | 109.5° |
| C1 | C2 | C5 | 110.6° | 109.4° |
| C1 | C2 | C7 | 113.1° | 109.4° |
| C2 | C1 | H1 | 103.4° | 109.4° |
| C1 | C2 | H2 | 108.3° | 109.5° |
| C3 | C6 | C4 | 106.0° | 109.5° |
| C6 | C3 | H31C | 110.5° | 109.5° |
| C6 | C3 | H32C | 111.2° | 109.5° |
| C3 | C6 | H61C | 110.7° | 109.5° |
| C3 | C6 | H62C | 111.4° | 109.5° |
| C6 | C4 | C8 | 110.4° | 109.5° |
| C6 | C4 | C5 | 113.4° | 109.5° |
| C4 | C6 | H61C | 110.6° | 109.5° |
| C4 | C6 | H62C | 111.4° | 109.4° |
| C6 | C4 | H4 | 106.8° | 109.4° |
| C8 | C4 | C5 | 111.4° | 109.5° |
| C4 | C8 | O4 | 115.9° | 120.0° |
| C4 | C8 | O3 | 118.4° | 120.0° |
| C8 | C4 | H4 | 109.0° | 109.5° |
| C4 | C5 | C2 | 108.5° | 109.5° |
| C5 | C4 | H4 | 105.7° | 109.4° |
| C4 | C5 | H51C | 109.8° | 109.4° |
| C4 | C5 | H52C | 110.1° | 109.4° |
| O4 | C8 | O3 | 125.7° | 120.0° |
| C8 | O4 | HA | 109.5° | 117.0° |
| C5 | C2 | C7 | 115.0° | 109.5° |
| C5 | C2 | H2 | 106.0° | 109.5° |
| C2 | C5 | H51C | 109.8° | 109.5° |
| C2 | C5 | H52C | 110.0° | 109.5° |
| C2 | C7 | O1 | 119.8° | 120.0° |
| C2 | C7 | O2 | 117.6° | 120.1° |
| C7 | C2 | H2 | 103.1° | 109.5° |
| O1 | C7 | O2 | 122.6° | 120.0° |
| C7 | O1 | HB | 109.5° | 117.0° |
| H231 | C23 | H232 | 117.6° | 109.4° |
| H31C | C3 | H32C | 107.1° | 109.4° |
| H61C | C6 | H62C | 106.8° | 109.5° |
| H51C | C5 | H52C | 108.7° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N30 | C30 | C27 | C26 | 173.9° | 126.1° |
| N30 | C30 | C27 | C28 | 5.1° | 54.1° |
| C30 | C27 | C26 | C28 | 178.9° | 179.7° |
| C30 | C27 | C26 | C25 | 179.4° | 180.0° |
| C30 | C27 | C28 | C29 | 179.0° | 180.0° |
| C30 | C27 | C26 | H26 | 0.6° | 0.1° |
| C30 | C27 | C28 | H28 | 1.0° | 0.1° |
| C27 | C26 | C25 | H26 | 180.0° | 179.9° |
| C27 | C26 | C25 | F25 | 179.6° | 180.0° |
| C27 | C26 | C25 | C24 | 0.9° | 0.0° |
| C26 | C27 | C28 | C29 | 0.1° | 0.2° |
| C26 | C27 | C28 | H28 | 179.9° | 179.6° |
| C28 | C27 | C26 | C25 | 0.5° | 0.3° |
| C27 | C28 | C29 | H28 | 180.0° | 179.9° |
| C27 | C28 | C29 | C24 | 0.2° | 0.0° |
| C28 | C27 | C26 | H26 | 179.5° | 179.8° |
| C27 | C28 | C29 | H29 | 179.8° | 179.9° |
| C26 | C25 | F25 | C24 | 179.5° | 180.0° |
| C26 | C25 | C24 | C29 | 1.0° | 0.2° |
| C26 | C25 | C24 | C23 | 177.4° | 180.0° |
| F25 | C25 | C24 | C29 | 179.5° | 179.8° |
| F25 | C25 | C24 | C23 | 2.0° | 0.1° |
| F25 | C25 | C26 | H26 | 0.4° | 0.0° |
| C25 | C24 | C29 | C28 | 0.6° | 0.3° |
| C25 | C24 | C29 | C23 | 178.4° | 179.7° |
| C25 | C24 | C23 | O22 | 175.2° | 180.0° |
| C24 | C25 | C26 | H26 | 179.1° | 180.0° |
| C25 | C24 | C29 | H29 | 179.4° | 179.7° |
| C25 | C24 | C23 | H231 | 64.8° | 60.0° |
| C25 | C24 | C23 | H232 | 60.0° | 60.0° |
| C28 | C29 | C24 | H29 | 180.0° | 179.9° |
| C28 | C29 | C24 | C23 | 177.8° | 180.0° |
| C29 | C24 | C23 | O22 | 6.3° | 0.3° |
| C24 | C29 | C28 | H28 | 179.8° | 179.9° |
| C29 | C24 | C23 | H231 | 113.7° | 120.3° |
| C29 | C24 | C23 | H232 | 121.6° | 119.8° |
| C24 | C23 | O22 | H231 | 120.0° | 120.0° |
| C24 | C23 | O22 | H232 | 115.3° | 120.1° |
| C24 | C23 | O22 | C20 | 109.3° | 180.0° |
| C23 | C24 | C29 | H29 | 2.2° | 0.0° |
| C24 | C23 | H231 | H232 | 116.0° | 120.0° |
| C23 | O22 | C20 | C21 | 12.0° | 180.0° |
| C23 | O22 | C20 | C19 | 171.2° | 0.3° |
| O22 | C23 | H231 | H232 | 115.9° | 119.9° |
| O22 | C20 | C21 | C19 | 176.8° | 179.7° |
| O22 | C20 | C21 | C15 | 174.8° | 179.9° |
| O22 | C20 | C19 | C18 | 175.5° | 180.0° |
| C20 | O22 | C23 | H231 | 130.7° | 60.0° |
| C20 | O22 | C23 | H232 | 5.9° | 59.9° |
| O22 | C20 | C21 | H21 | 5.2° | 0.1° |
| O22 | C20 | C19 | H19 | 4.5° | 0.0° |
| C20 | C21 | C15 | H21 | 180.0° | 180.0° |
| C20 | C21 | C15 | C14 | 179.7° | 180.0° |
| C20 | C21 | C15 | C16 | 1.2° | 0.1° |
| C21 | C20 | C19 | C18 | 1.3° | 0.3° |
| C21 | C20 | C19 | H19 | 178.7° | 179.7° |
| C19 | C20 | C21 | C15 | 2.0° | 0.3° |
| C20 | C19 | C18 | H19 | 180.0° | 180.0° |
| C20 | C19 | C18 | C16 | 0.3° | 0.0° |
| C19 | C20 | C21 | H21 | 178.0° | 179.7° |
| C20 | C19 | C18 | H18 | 179.7° | 180.0° |
| C21 | C15 | C14 | C16 | 178.5° | 180.0° |
| C21 | C15 | C14 | C13 | 178.9° | 180.0° |
| C21 | C15 | C16 | C18 | 0.4° | 0.3° |
| C21 | C15 | C16 | C17 | 177.9° | 180.0° |
| C21 | C15 | C14 | H14 | 1.1° | 0.0° |
| C15 | C14 | C13 | H14 | 180.0° | 180.0° |
| C15 | C14 | C13 | C12 | 3.6° | 0.1° |
| C14 | C15 | C16 | C18 | 178.1° | 179.7° |
| C14 | C15 | C16 | C17 | 0.6° | 0.0° |
| C14 | C15 | C21 | H21 | 0.3° | 0.0° |
| C15 | C14 | C13 | H13 | 176.4° | 180.0° |
| C16 | C15 | C14 | C13 | 2.5° | 0.1° |
| C15 | C16 | C18 | C19 | 1.1° | 0.3° |
| C15 | C16 | C18 | C17 | 177.5° | 179.6° |
| C15 | C16 | C17 | C12 | 2.8° | 0.0° |
| C16 | C15 | C21 | H21 | 178.9° | 179.9° |
| C16 | C15 | C14 | H14 | 177.5° | 180.0° |
| C15 | C16 | C18 | H18 | 178.9° | 179.7° |
| C15 | C16 | C17 | H17 | 177.2° | 179.9° |
| C14 | C13 | C12 | H13 | 180.0° | 180.0° |
| C14 | C13 | C12 | C17 | 1.4° | 0.0° |
| C14 | C13 | C12 | S11 | 177.8° | 180.0° |
| C13 | C12 | C17 | C16 | 1.8° | 0.0° |
| C13 | C12 | C17 | S11 | 176.1° | 180.0° |
| C13 | C12 | S11 | O32 | 37.0° | 156.5° |
| C13 | C12 | S11 | O33 | 168.5° | 23.5° |
| C13 | C12 | S11 | N | 75.6° | 90.0° |
| C12 | C13 | C14 | H14 | 176.4° | 180.0° |
| C13 | C12 | C17 | H17 | 178.2° | 179.9° |
| C19 | C18 | C16 | H18 | 180.0° | 180.0° |
| C19 | C18 | C16 | C17 | 178.6° | 179.9° |
| C18 | C16 | C17 | C12 | 179.8° | 179.7° |
| C16 | C18 | C19 | H19 | 179.7° | 180.0° |
| C18 | C16 | C17 | H17 | 0.2° | 0.3° |
| C16 | C17 | C12 | H17 | 180.0° | 180.0° |
| C16 | C17 | C12 | S11 | 174.3° | 180.0° |
| C17 | C16 | C18 | H18 | 1.4° | 0.1° |
| C17 | C12 | S11 | O32 | 146.8° | 23.5° |
| C17 | C12 | S11 | O33 | 15.3° | 156.5° |
| C17 | C12 | S11 | N | 100.6° | 90.0° |
| C17 | C12 | C13 | H13 | 178.6° | 180.0° |
| C12 | S11 | O32 | O33 | 128.9° | 122.9° |
| C12 | S11 | O32 | N | 111.7° | 114.1° |
| C12 | S11 | O33 | N | 112.2° | 114.1° |
| C12 | S11 | N | C1 | 75.9° | 65.0° |
| S11 | C12 | C13 | H13 | 2.2° | 0.0° |
| S11 | C12 | C17 | H17 | 5.7° | 0.1° |
| C12 | S11 | N | H | 44.1° | 115.1° |
| O32 | S11 | O33 | N | 116.9° | 123.0° |
| O32 | S11 | N | C1 | 164.6° | 48.5° |
| O32 | S11 | N | H | 75.4° | 131.4° |
| O33 | S11 | N | C1 | 40.9° | 178.6° |
| O33 | S11 | N | H | 160.9° | 1.5° |
| S11 | N | C1 | H | 120.0° | 179.9° |
| S11 | N | C1 | C3 | 91.2° | 94.9° |
| S11 | N | C1 | C2 | 128.0° | 145.0° |
| S11 | N | C1 | H1 | 18.6° | 25.1° |
| N | C1 | C3 | C2 | 142.4° | 120.1° |
| N | C1 | C3 | H1 | 106.1° | 120.0° |
| N | C1 | C2 | H1 | 105.9° | 119.9° |
| N | C1 | C3 | C6 | 78.2° | 60.0° |
| N | C1 | C2 | C5 | 83.0° | 60.0° |
| N | C1 | C2 | C7 | 47.6° | 59.9° |
| N | C1 | C3 | H31C | 161.8° | 179.9° |
| N | C1 | C3 | H32C | 43.0° | 60.0° |
| N | C1 | C2 | H2 | 161.2° | 180.0° |
| C3 | C1 | C2 | H1 | 111.8° | 120.0° |
| C1 | C3 | C6 | H31C | 120.0° | 120.0° |
| C1 | C3 | C6 | H32C | 121.2° | 120.0° |
| C1 | C3 | C6 | C4 | 61.6° | 60.0° |
| C3 | C1 | C2 | C5 | 59.3° | 60.0° |
| C3 | C1 | C2 | C7 | 170.1° | 180.0° |
| C3 | C1 | N | H | 28.8° | 85.0° |
| C1 | C3 | H31C | H32C | 121.2° | 119.9° |
| C3 | C1 | C2 | H2 | 56.5° | 60.0° |
| C1 | C3 | C6 | H61C | 178.4° | 180.0° |
| C1 | C3 | C6 | H62C | 59.7° | 59.9° |
| C2 | C1 | C3 | C6 | 64.2° | 60.0° |
| C1 | C2 | C5 | C4 | 52.3° | 60.0° |
| C1 | C2 | C5 | C7 | 129.6° | 119.9° |
| C1 | C2 | C5 | H2 | 117.2° | 120.0° |
| C1 | C2 | C7 | H2 | 116.7° | 120.0° |
| C1 | C2 | C7 | O1 | 81.1° | 179.9° |
| C1 | C2 | C7 | O2 | 97.5° | 0.0° |
| C2 | C1 | N | H | 112.0° | 35.1° |
| C2 | C1 | C3 | H31C | 55.8° | 60.0° |
| C2 | C1 | C3 | H32C | 174.6° | 179.9° |
| C1 | C2 | C5 | H51C | 172.3° | 180.0° |
| C1 | C2 | C5 | H52C | 68.1° | 59.9° |
| C3 | C6 | C4 | H61C | 120.0° | 120.0° |
| C3 | C6 | C4 | H62C | 121.4° | 120.0° |
| C3 | C6 | C4 | C8 | 172.4° | 180.0° |
| C3 | C6 | C4 | C5 | 61.9° | 60.0° |
| C6 | C3 | C1 | H1 | 175.7° | 180.0° |
| C6 | C3 | H31C | H32C | 121.3° | 120.0° |
| C3 | C6 | H61C | H62C | 121.4° | 120.1° |
| C3 | C6 | C4 | H4 | 54.0° | 60.0° |
| C6 | C4 | C8 | C5 | 126.8° | 120.1° |
| C6 | C4 | C8 | H4 | 117.0° | 120.0° |
| C6 | C4 | C5 | H4 | 116.6° | 119.9° |
| C6 | C4 | C8 | O4 | 77.8° | 59.9° |
| C6 | C4 | C8 | O3 | 102.9° | 120.0° |
| C6 | C4 | C5 | C2 | 56.2° | 60.0° |
| C4 | C6 | C3 | H31C | 58.4° | 60.0° |
| C4 | C6 | C3 | H32C | 177.2° | 180.0° |
| C4 | C6 | H61C | H62C | 121.4° | 120.0° |
| C6 | C4 | C5 | H51C | 176.2° | 180.0° |
| C6 | C4 | C5 | H52C | 64.2° | 60.1° |
| C8 | C4 | C5 | H4 | 118.2° | 120.0° |
| C4 | C8 | O4 | O3 | 179.2° | 179.9° |
| C8 | C4 | C5 | C2 | 178.6° | 179.9° |
| C8 | C4 | C6 | H61C | 52.4° | 60.0° |
| C8 | C4 | C6 | H62C | 66.3° | 60.1° |
| C8 | C4 | C5 | H51C | 58.6° | 59.9° |
| C8 | C4 | C5 | H52C | 61.0° | 60.0° |
| C4 | C8 | O4 | HA | 179.3° | 180.0° |
| C5 | C4 | C8 | O4 | 155.4° | 180.0° |
| C5 | C4 | C8 | O3 | 23.9° | 0.0° |
| C4 | C5 | C2 | H51C | 120.0° | 120.0° |
| C4 | C5 | C2 | H52C | 120.4° | 120.0° |
| C4 | C5 | C2 | C7 | 178.2° | 180.0° |
| C4 | C5 | C2 | H2 | 64.9° | 60.0° |
| C5 | C4 | C6 | H61C | 178.1° | 179.9° |
| C5 | C4 | C6 | H62C | 59.4° | 60.0° |
| C4 | C5 | H51C | H52C | 120.4° | 119.9° |
| O4 | C8 | C4 | H4 | 39.2° | 60.0° |
| O3 | C8 | C4 | H4 | 140.1° | 120.0° |
| O3 | C8 | O4 | HA | 0.0° | 0.1° |
| C5 | C2 | C7 | H2 | 114.9° | 120.1° |
| C5 | C2 | C7 | O1 | 150.5° | 60.0° |
| C5 | C2 | C7 | O2 | 30.8° | 119.9° |
| C5 | C2 | C1 | H1 | 171.1° | 180.0° |
| C2 | C5 | C4 | H4 | 60.4° | 59.9° |
| C2 | C5 | H51C | H52C | 120.4° | 120.1° |
| C2 | C7 | O1 | O2 | 178.6° | 179.9° |
| C7 | C2 | C1 | H1 | 58.3° | 60.0° |
| C7 | C2 | C5 | H51C | 58.1° | 60.1° |
| C7 | C2 | C5 | H52C | 61.4° | 60.0° |
| C2 | C7 | O1 | HB | 178.6° | 180.0° |
| O1 | C7 | C2 | H2 | 35.6° | 60.1° |
| O2 | C7 | C2 | H2 | 145.8° | 120.0° |
| O2 | C7 | O1 | HB | 0.0° | 0.1° |
| H28 | C28 | C29 | H29 | 0.2° | 0.0° |
| H19 | C19 | C18 | H18 | 0.3° | 0.0° |
| H14 | C14 | C13 | H13 | 3.6° | 0.0° |
| H | N | C1 | H1 | 138.6° | 155.0° |
| H1 | C1 | C3 | H31C | 55.7° | 60.0° |
| H1 | C1 | C3 | H32C | 63.1° | 59.9° |
| H1 | C1 | C2 | H2 | 55.3° | 60.0° |
| H31C | C3 | C6 | H61C | 61.6° | 60.0° |
| H31C | C3 | C6 | H62C | 179.7° | 179.9° |
| H32C | C3 | C6 | H61C | 57.2° | 60.0° |
| H32C | C3 | C6 | H62C | 61.4° | 60.1° |
| H2 | C2 | C5 | H51C | 55.1° | 60.0° |
| H2 | C2 | C5 | H52C | 174.7° | 179.9° |
| H61C | C6 | C4 | H4 | 66.0° | 60.0° |
| H62C | C6 | C4 | H4 | 175.4° | 179.9° |
| H4 | C4 | C5 | H51C | 59.6° | 60.1° |
| H4 | C4 | C5 | H52C | 179.2° | 180.0° |
