A1C2Z
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.56Å | |
| C2 | C3 | sing | 1.51Å | 1.56Å | |
| C3 | N4 | sing | 1.35Å | 1.33Å | |
| C3 | O34 | doub | 1.21Å | 1.23Å | |
| N4 | C5 | sing | 1.46Å | 1.52Å | |
| C5 | C6 | sing | 1.51Å | 1.53Å | |
| C5 | C29 | sing | 1.53Å | 1.56Å | |
| C5 | C33 | sing | 1.53Å | 1.55Å | |
| C6 | C7 | doub | 1.38Å | 1.41Å | Aromatic |
| C6 | C28 | sing | 1.38Å | 1.41Å | Aromatic |
| C7 | C8 | sing | 1.39Å | 1.42Å | Aromatic |
| C8 | N9 | sing | 1.40Å | 1.48Å | |
| C8 | C26 | doub | 1.39Å | 1.41Å | Aromatic |
| N9 | C10 | sing | 1.35Å | 1.42Å | |
| C10 | C11 | sing | 1.49Å | 1.51Å | |
| C10 | O25 | doub | 1.21Å | 1.22Å | |
| C11 | N12 | sing | 1.35Å | 1.41Å | |
| C11 | O24 | doub | 1.21Å | 1.22Å | |
| N12 | C13 | sing | 1.47Å | 1.45Å | |
| N12 | C15 | sing | 1.47Å | 1.46Å | |
| C13 | C14 | sing | 1.54Å | 1.56Å | |
| C14 | C15 | sing | 1.53Å | 1.56Å | |
| C14 | C16 | sing | 1.53Å | 1.55Å | |
| C16 | O17 | sing | 1.43Å | 1.43Å | |
| O17 | C18 | sing | 1.36Å | 1.40Å | |
| C18 | C19 | doub | 1.39Å | 1.42Å | Aromatic |
| C18 | C23 | sing | 1.39Å | 1.41Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.40Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.40Å | Aromatic |
| C27 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
| C29 | C30 | sing | 1.53Å | 1.55Å | |
| C30 | O31 | sing | 1.43Å | 1.40Å | |
| O31 | C32 | sing | 1.43Å | 1.41Å | |
| C32 | C33 | sing | 1.53Å | 1.56Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C15 | H15B | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H16B | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C2 | H2B | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C29 | H29B | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C30 | H30B | sing | 1.09Å | 1.10Å | |
| C32 | H32B | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C33 | H33B | sing | 1.09Å | 1.10Å | |
| N4 | H4 | sing | 0.97Å | 1.00Å | |
| N9 | H9 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 113.5° | 109.4° |
| C2 | C1 | H1B | 109.5° | 109.4° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.5° | 109.5° |
| C1 | C2 | H2B | 108.4° | 109.5° |
| C1 | C2 | H2A | 108.4° | 109.5° |
| C2 | C3 | N4 | 120.6° | 120.0° |
| C2 | C3 | O34 | 119.2° | 120.0° |
| C3 | C2 | H2B | 108.5° | 109.5° |
| C3 | C2 | H2A | 108.4° | 109.5° |
| N4 | C3 | O34 | 120.2° | 120.0° |
| C3 | N4 | C5 | 128.5° | 120.0° |
| C3 | N4 | H4 | 115.8° | 120.1° |
| N4 | C5 | C6 | 111.1° | 109.5° |
| N4 | C5 | C29 | 107.5° | 109.6° |
| N4 | C5 | C33 | 106.8° | 109.6° |
| C5 | N4 | H4 | 115.7° | 120.0° |
| C6 | C5 | C29 | 109.0° | 109.5° |
| C6 | C5 | C33 | 115.6° | 109.6° |
| C5 | C6 | C7 | 121.3° | 119.9° |
| C5 | C6 | C28 | 121.6° | 120.0° |
| C29 | C5 | C33 | 106.6° | 109.0° |
| C5 | C29 | C30 | 112.2° | 109.2° |
| C5 | C29 | H29A | 108.8° | 109.5° |
| C5 | C29 | H29B | 108.8° | 109.5° |
| C5 | C33 | C32 | 114.0° | 109.2° |
| C5 | C33 | H33A | 108.3° | 109.6° |
| C5 | C33 | H33B | 108.3° | 109.5° |
| C7 | C6 | C28 | 117.1° | 120.1° |
| C6 | C7 | C8 | 122.5° | 119.9° |
| C6 | C7 | H7 | 118.7° | 120.0° |
| C6 | C28 | C27 | 121.2° | 120.1° |
| C6 | C28 | H28 | 119.4° | 119.9° |
| C7 | C8 | N9 | 122.5° | 120.0° |
| C7 | C8 | C26 | 118.0° | 119.9° |
| C8 | C7 | H7 | 118.7° | 120.1° |
| N9 | C8 | C26 | 119.4° | 120.1° |
| C8 | N9 | C10 | 127.6° | 120.0° |
| C8 | N9 | H9 | 116.2° | 120.0° |
| C8 | C26 | C27 | 120.3° | 119.9° |
| C8 | C26 | H26 | 119.8° | 120.1° |
| N9 | C10 | C11 | 114.8° | 120.0° |
| N9 | C10 | O25 | 122.8° | 120.0° |
| C10 | N9 | H9 | 116.2° | 120.0° |
| C11 | C10 | O25 | 122.4° | 120.0° |
| C10 | C11 | N12 | 122.5° | 120.0° |
| C10 | C11 | O24 | 115.9° | 120.0° |
| N12 | C11 | O24 | 121.7° | 120.0° |
| C11 | N12 | C13 | 130.6° | 136.1° |
| C11 | N12 | C15 | 136.6° | 136.1° |
| C13 | N12 | C15 | 92.8° | 87.9° |
| N12 | C13 | C14 | 90.7° | 88.0° |
| N12 | C13 | H13A | 114.0° | 113.5° |
| N12 | C13 | H13B | 114.0° | 113.4° |
| N12 | C15 | C14 | 90.1° | 88.0° |
| N12 | C15 | H15A | 114.0° | 113.5° |
| N12 | C15 | H15B | 114.1° | 113.5° |
| C13 | C14 | C15 | 85.3° | 83.4° |
| C13 | C14 | C16 | 113.7° | 114.2° |
| C14 | C13 | H13A | 113.9° | 113.5° |
| C14 | C13 | H13B | 113.9° | 113.5° |
| C13 | C14 | H14 | 112.2° | 114.2° |
| C15 | C14 | C16 | 118.6° | 114.2° |
| C14 | C15 | H15A | 114.1° | 113.4° |
| C14 | C15 | H15B | 114.1° | 113.5° |
| C15 | C14 | H14 | 112.1° | 114.2° |
| C14 | C16 | O17 | 113.8° | 109.5° |
| C16 | C14 | H14 | 112.3° | 113.4° |
| C14 | C16 | H16B | 108.4° | 109.4° |
| C14 | C16 | H16A | 108.4° | 109.5° |
| C16 | O17 | C18 | 118.6° | 117.0° |
| O17 | C16 | H16B | 108.4° | 109.5° |
| O17 | C16 | H16A | 108.4° | 109.5° |
| O17 | C18 | C19 | 119.8° | 120.1° |
| O17 | C18 | C23 | 122.5° | 120.1° |
| C19 | C18 | C23 | 117.7° | 119.9° |
| C18 | C19 | C20 | 120.9° | 119.9° |
| C18 | C19 | H19 | 119.5° | 120.0° |
| C18 | C23 | C22 | 120.7° | 119.9° |
| C18 | C23 | H23 | 119.6° | 120.1° |
| C19 | C20 | C21 | 120.8° | 120.0° |
| C19 | C20 | H20 | 119.6° | 120.0° |
| C20 | C19 | H19 | 119.5° | 120.1° |
| C20 | C21 | C22 | 119.0° | 120.2° |
| C21 | C20 | H20 | 119.6° | 120.0° |
| C20 | C21 | H21 | 120.5° | 119.9° |
| C21 | C22 | C23 | 120.8° | 120.1° |
| C22 | C21 | H21 | 120.5° | 120.0° |
| C21 | C22 | H22 | 119.6° | 120.0° |
| C23 | C22 | H22 | 119.6° | 120.0° |
| C22 | C23 | H23 | 119.7° | 120.0° |
| C26 | C27 | C28 | 120.8° | 120.1° |
| C27 | C26 | H26 | 119.9° | 120.0° |
| C26 | C27 | H27 | 119.6° | 119.9° |
| C27 | C28 | H28 | 119.4° | 119.9° |
| C28 | C27 | H27 | 119.6° | 120.0° |
| C29 | C30 | O31 | 112.3° | 109.4° |
| C30 | C29 | H29A | 108.8° | 109.5° |
| C30 | C29 | H29B | 108.8° | 109.5° |
| C29 | C30 | H30A | 108.8° | 109.5° |
| C29 | C30 | H30B | 108.7° | 109.5° |
| C30 | O31 | C32 | 115.0° | 114.1° |
| O31 | C30 | H30A | 108.7° | 109.5° |
| O31 | C30 | H30B | 108.8° | 109.5° |
| O31 | C32 | C33 | 113.8° | 109.4° |
| O31 | C32 | H32B | 108.4° | 109.5° |
| O31 | C32 | H32A | 108.4° | 109.5° |
| C33 | C32 | H32B | 108.3° | 109.5° |
| C33 | C32 | H32A | 108.4° | 109.5° |
| C32 | C33 | H33A | 108.3° | 109.6° |
| C32 | C33 | H33B | 108.3° | 109.5° |
| H13A | C13 | H13B | 109.5° | 112.8° |
| H15A | C15 | H15B | 109.5° | 112.7° |
| H1B | C1 | H1 | 109.4° | 109.5° |
| H1B | C1 | H1A | 109.5° | 109.5° |
| H1 | C1 | H1A | 109.5° | 109.5° |
| H16B | C16 | H16A | 109.4° | 109.5° |
| H2B | C2 | H2A | 109.5° | 109.5° |
| H29A | C29 | H29B | 109.5° | 109.5° |
| H30A | C30 | H30B | 109.5° | 109.5° |
| H32B | C32 | H32A | 109.5° | 109.5° |
| H33A | C33 | H33B | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | H2B | 120.6° | 120.0° |
| C1 | C2 | C3 | H2A | 120.6° | 120.0° |
| C1 | C2 | C3 | N4 | 124.5° | 180.0° |
| C1 | C2 | C3 | O34 | 55.5° | 0.0° |
| C2 | C1 | H1B | H1 | 120.0° | 120.0° |
| C2 | C1 | H1B | H1A | 120.0° | 120.0° |
| C2 | C1 | H1 | H1A | 120.0° | 120.0° |
| C1 | C2 | H2B | H2A | 118.2° | 120.0° |
| C2 | C3 | N4 | O34 | 179.9° | 180.0° |
| C2 | C3 | N4 | C5 | 179.7° | 174.7° |
| C3 | C2 | C1 | H1B | 180.0° | 60.0° |
| C3 | C2 | C1 | H1 | 60.0° | 60.0° |
| C3 | C2 | C1 | H1A | 60.0° | 180.0° |
| C3 | C2 | H2B | H2A | 118.2° | 120.0° |
| C2 | C3 | N4 | H4 | 0.2° | 5.4° |
| C3 | N4 | C5 | H4 | 180.0° | 179.9° |
| C3 | N4 | C5 | C6 | 53.0° | 58.9° |
| C3 | N4 | C5 | C29 | 172.1° | 179.1° |
| C3 | N4 | C5 | C33 | 73.8° | 61.3° |
| N4 | C3 | C2 | H2B | 3.9° | 60.0° |
| N4 | C3 | C2 | H2A | 114.9° | 60.0° |
| O34 | C3 | N4 | C5 | 0.2° | 5.3° |
| O34 | C3 | C2 | H2B | 176.0° | 120.0° |
| O34 | C3 | C2 | H2A | 65.1° | 120.0° |
| O34 | C3 | N4 | H4 | 179.8° | 174.6° |
| N4 | C5 | C6 | C29 | 118.2° | 120.2° |
| N4 | C5 | C6 | C33 | 121.8° | 120.3° |
| N4 | C5 | C29 | C33 | 114.2° | 120.0° |
| N4 | C5 | C6 | C7 | 52.2° | 148.6° |
| N4 | C5 | C6 | C28 | 127.5° | 31.6° |
| N4 | C5 | C29 | C30 | 62.6° | 63.0° |
| N4 | C5 | C33 | C32 | 67.4° | 62.9° |
| N4 | C5 | C29 | H29A | 57.8° | 57.0° |
| N4 | C5 | C29 | H29B | 177.0° | 177.1° |
| N4 | C5 | C33 | H33A | 172.0° | 177.1° |
| N4 | C5 | C33 | H33B | 53.3° | 56.9° |
| C6 | C5 | C29 | C33 | 125.4° | 119.9° |
| C5 | C6 | C7 | C28 | 179.8° | 179.8° |
| C5 | C6 | C7 | C8 | 180.0° | 180.0° |
| C5 | C6 | C28 | C27 | 180.0° | 179.7° |
| C6 | C5 | C29 | C30 | 176.9° | 176.9° |
| C6 | C5 | C33 | C32 | 168.5° | 176.9° |
| C5 | C6 | C7 | H7 | 0.0° | 0.0° |
| C5 | C6 | C28 | H28 | 0.1° | 0.0° |
| C6 | C5 | C29 | H29A | 62.6° | 63.2° |
| C6 | C5 | C29 | H29B | 56.5° | 56.9° |
| C6 | C5 | C33 | H33A | 47.9° | 56.9° |
| C6 | C5 | C33 | H33B | 70.8° | 63.3° |
| C6 | C5 | N4 | H4 | 127.1° | 121.0° |
| C29 | C5 | C6 | C7 | 66.0° | 91.2° |
| C29 | C5 | C6 | C28 | 114.3° | 88.6° |
| C5 | C29 | C30 | H29A | 120.4° | 119.9° |
| C5 | C29 | C30 | H29B | 120.4° | 119.9° |
| C5 | C29 | C30 | O31 | 57.5° | 57.6° |
| C29 | C5 | C33 | C32 | 47.2° | 57.0° |
| C5 | C29 | H29A | H29B | 118.7° | 120.1° |
| C5 | C29 | C30 | H30A | 63.0° | 62.3° |
| C5 | C29 | C30 | H30B | 177.9° | 177.6° |
| C29 | C5 | C33 | H33A | 73.4° | 63.0° |
| C29 | C5 | C33 | H33B | 167.9° | 176.8° |
| C29 | C5 | N4 | H4 | 7.9° | 0.8° |
| C33 | C5 | C6 | C7 | 174.0° | 28.3° |
| C33 | C5 | C6 | C28 | 5.7° | 151.9° |
| C33 | C5 | C29 | C30 | 51.5° | 57.0° |
| C5 | C33 | C32 | O31 | 48.1° | 57.7° |
| C5 | C33 | C32 | H33A | 120.7° | 120.0° |
| C5 | C33 | C32 | H33B | 120.7° | 119.8° |
| C33 | C5 | C29 | H29A | 172.0° | 176.9° |
| C33 | C5 | C29 | H29B | 68.9° | 62.9° |
| C5 | C33 | C32 | H32B | 72.5° | 177.6° |
| C5 | C33 | C32 | H32A | 168.8° | 62.3° |
| C5 | C33 | H33A | H33B | 117.9° | 120.1° |
| C33 | C5 | N4 | H4 | 106.1° | 118.7° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | N9 | 179.9° | 180.0° |
| C6 | C7 | C8 | C26 | 0.1° | 0.0° |
| C7 | C6 | C28 | C27 | 0.2° | 0.5° |
| C7 | C6 | C28 | H28 | 179.8° | 179.8° |
| C28 | C6 | C7 | C8 | 0.2° | 0.2° |
| C6 | C28 | C27 | C26 | 0.1° | 0.5° |
| C6 | C28 | C27 | H28 | 180.0° | 179.7° |
| C28 | C6 | C7 | H7 | 179.8° | 179.8° |
| C6 | C28 | C27 | H27 | 179.9° | 179.7° |
| C7 | C8 | N9 | C26 | 180.0° | 180.0° |
| C7 | C8 | N9 | C10 | 0.7° | 145.7° |
| C7 | C8 | C26 | C27 | 0.0° | 0.0° |
| C7 | C8 | C26 | H26 | 180.0° | 180.0° |
| C7 | C8 | N9 | H9 | 179.3° | 34.4° |
| C8 | N9 | C10 | H9 | 180.0° | 179.9° |
| C8 | N9 | C10 | C11 | 180.0° | 174.8° |
| C8 | N9 | C10 | O25 | 0.2° | 5.2° |
| N9 | C8 | C26 | C27 | 180.0° | 180.0° |
| N9 | C8 | C7 | H7 | 0.2° | 0.0° |
| N9 | C8 | C26 | H26 | 0.0° | 0.1° |
| C26 | C8 | N9 | C10 | 179.3° | 34.2° |
| C8 | C26 | C27 | H26 | 180.0° | 179.9° |
| C8 | C26 | C27 | C28 | 0.0° | 0.3° |
| C26 | C8 | C7 | H7 | 179.9° | 180.0° |
| C8 | C26 | C27 | H27 | 180.0° | 180.0° |
| C26 | C8 | N9 | H9 | 0.7° | 145.7° |
| N9 | C10 | C11 | O25 | 179.8° | 180.0° |
| N9 | C10 | C11 | N12 | 179.9° | 180.0° |
| N9 | C10 | C11 | O24 | 0.1° | 0.0° |
| C10 | C11 | N12 | O24 | 180.0° | 180.0° |
| C10 | C11 | N12 | C13 | 179.9° | 180.0° |
| C10 | C11 | N12 | C15 | 0.2° | 0.3° |
| C11 | C10 | N9 | H9 | 0.0° | 5.0° |
| O25 | C10 | C11 | N12 | 0.1° | 0.0° |
| O25 | C10 | C11 | O24 | 179.9° | 180.0° |
| O25 | C10 | N9 | H9 | 179.7° | 174.9° |
| C11 | N12 | C13 | C15 | 180.0° | 179.8° |
| C11 | N12 | C13 | C14 | 171.6° | 152.7° |
| C11 | N12 | C15 | C14 | 171.6° | 152.7° |
| C11 | N12 | C13 | H13A | 71.7° | 92.6° |
| C11 | N12 | C13 | H13B | 54.9° | 37.9° |
| C11 | N12 | C15 | H15A | 55.0° | 37.9° |
| C11 | N12 | C15 | H15B | 71.8° | 92.5° |
| O24 | C11 | N12 | C13 | 0.1° | 0.0° |
| O24 | C11 | N12 | C15 | 179.9° | 179.7° |
| N12 | C13 | C14 | H13A | 116.7° | 114.8° |
| N12 | C13 | C14 | H13B | 116.7° | 114.7° |
| C13 | N12 | C15 | C14 | 8.4° | 27.1° |
| N12 | C13 | C14 | C16 | 127.1° | 139.7° |
| N12 | C13 | H13A | H13B | 128.9° | 130.8° |
| C13 | N12 | C15 | H15A | 125.0° | 141.9° |
| C13 | N12 | C15 | H15B | 108.2° | 87.7° |
| N12 | C13 | C14 | H14 | 104.1° | 87.5° |
| N12 | C15 | C14 | H15A | 116.6° | 114.8° |
| N12 | C15 | C14 | H15B | 116.6° | 114.8° |
| N12 | C15 | C14 | C16 | 122.3° | 139.7° |
| C15 | N12 | C13 | H13A | 108.3° | 87.6° |
| C15 | N12 | C13 | H13B | 125.1° | 141.9° |
| N12 | C15 | H15A | H15B | 129.2° | 130.8° |
| N12 | C15 | C14 | H14 | 104.2° | 87.5° |
| C13 | C14 | C15 | C16 | 114.5° | 113.6° |
| C13 | C14 | C15 | H14 | 112.0° | 113.6° |
| C13 | C14 | C16 | H14 | 128.7° | 133.1° |
| C13 | C14 | C16 | O17 | 179.5° | 175.0° |
| C14 | C13 | H13A | H13B | 128.9° | 130.8° |
| C13 | C14 | C15 | H15A | 124.4° | 140.9° |
| C13 | C14 | C15 | H15B | 108.7° | 88.7° |
| C13 | C14 | C16 | H16B | 58.8° | 65.0° |
| C13 | C14 | C16 | H16A | 59.9° | 54.9° |
| C15 | C14 | C16 | H14 | 133.4° | 133.2° |
| C15 | C14 | C16 | O17 | 81.6° | 91.4° |
| C15 | C14 | C13 | H13A | 108.8° | 88.7° |
| C15 | C14 | C13 | H13B | 124.6° | 140.8° |
| C14 | C15 | H15A | H15B | 129.2° | 130.8° |
| C15 | C14 | C16 | H16B | 39.1° | 28.6° |
| C15 | C14 | C16 | H16A | 157.8° | 148.6° |
| C14 | C16 | O17 | H16B | 120.6° | 119.9° |
| C14 | C16 | O17 | H16A | 120.6° | 120.0° |
| C14 | C16 | O17 | C18 | 162.8° | 180.0° |
| C16 | C14 | C13 | H13A | 10.4° | 24.9° |
| C16 | C14 | C13 | H13B | 116.2° | 105.5° |
| C16 | C14 | C15 | H15A | 121.1° | 105.5° |
| C16 | C14 | C15 | H15B | 5.7° | 24.9° |
| C14 | C16 | H16B | H16A | 118.0° | 120.0° |
| C16 | O17 | C18 | C19 | 9.5° | 180.0° |
| C16 | O17 | C18 | C23 | 170.2° | 0.5° |
| O17 | C16 | C14 | H14 | 51.8° | 41.8° |
| O17 | C16 | H16B | H16A | 118.0° | 120.0° |
| O17 | C18 | C19 | C23 | 179.8° | 179.5° |
| O17 | C18 | C19 | C20 | 179.8° | 180.0° |
| O17 | C18 | C23 | C22 | 179.8° | 179.7° |
| C18 | O17 | C16 | H16B | 76.6° | 60.0° |
| C18 | O17 | C16 | H16A | 42.1° | 60.0° |
| O17 | C18 | C19 | H19 | 0.2° | 0.5° |
| O17 | C18 | C23 | H23 | 0.2° | 0.3° |
| C18 | C19 | C20 | H19 | 180.0° | 179.5° |
| C18 | C19 | C20 | C21 | 0.0° | 0.0° |
| C19 | C18 | C23 | C22 | 0.0° | 0.8° |
| C18 | C19 | C20 | H20 | 180.0° | 179.7° |
| C19 | C18 | C23 | H23 | 180.0° | 179.7° |
| C23 | C18 | C19 | C20 | 0.0° | 0.5° |
| C18 | C23 | C22 | C21 | 0.1° | 0.5° |
| C18 | C23 | C22 | H23 | 180.0° | 179.5° |
| C18 | C23 | C22 | H22 | 180.0° | 179.5° |
| C23 | C18 | C19 | H19 | 180.0° | 180.0° |
| C19 | C20 | C21 | H20 | 180.0° | 179.7° |
| C19 | C20 | C21 | C22 | 0.1° | 0.2° |
| C19 | C20 | C21 | H21 | 179.9° | 179.8° |
| C20 | C21 | C22 | H21 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 0.1° | 0.0° |
| C20 | C21 | C22 | H22 | 179.9° | 180.0° |
| C21 | C20 | C19 | H19 | 180.0° | 179.5° |
| C21 | C22 | C23 | H22 | 180.0° | 180.0° |
| C22 | C21 | C20 | H20 | 179.9° | 180.0° |
| C21 | C22 | C23 | H23 | 179.9° | 180.0° |
| C23 | C22 | C21 | H21 | 179.9° | 179.9° |
| C26 | C27 | C28 | H27 | 180.0° | 179.7° |
| C26 | C27 | C28 | H28 | 179.9° | 179.8° |
| C28 | C27 | C26 | H26 | 180.0° | 179.8° |
| C29 | C30 | O31 | H30A | 120.4° | 119.9° |
| C29 | C30 | O31 | H30B | 120.4° | 120.0° |
| C29 | C30 | O31 | C32 | 56.4° | 61.2° |
| C30 | C29 | H29A | H29B | 118.7° | 120.1° |
| C29 | C30 | H30A | H30B | 118.7° | 120.1° |
| C30 | O31 | C32 | C33 | 51.7° | 61.2° |
| O31 | C30 | C29 | H29A | 177.9° | 177.6° |
| O31 | C30 | C29 | H29B | 62.9° | 62.3° |
| O31 | C30 | H30A | H30B | 118.7° | 120.0° |
| C30 | O31 | C32 | H32B | 68.9° | 178.9° |
| C30 | O31 | C32 | H32A | 172.4° | 58.8° |
| O31 | C32 | C33 | H32B | 120.6° | 119.9° |
| O31 | C32 | C33 | H32A | 120.6° | 120.0° |
| C32 | O31 | C30 | H30A | 64.0° | 58.8° |
| C32 | O31 | C30 | H30B | 176.8° | 178.9° |
| O31 | C32 | H32B | H32A | 118.0° | 120.0° |
| O31 | C32 | C33 | H33A | 72.5° | 62.3° |
| O31 | C32 | C33 | H33B | 168.8° | 177.5° |
| C33 | C32 | H32B | H32A | 118.0° | 120.1° |
| C32 | C33 | H33A | H33B | 117.9° | 120.1° |
| H13A | C13 | C14 | H14 | 139.2° | 157.7° |
| H13B | C13 | C14 | H14 | 12.6° | 27.2° |
| H15A | C15 | C14 | H14 | 12.3° | 27.3° |
| H15B | C15 | C14 | H14 | 139.2° | 157.7° |
| H20 | C20 | C21 | H21 | 0.1° | 0.1° |
| H20 | C20 | C19 | H19 | 0.0° | 0.3° |
| H21 | C21 | C22 | H22 | 0.1° | 0.0° |
| H22 | C22 | C23 | H23 | 0.0° | 0.0° |
| H26 | C26 | C27 | H27 | 0.0° | 0.0° |
| H28 | C28 | C27 | H27 | 0.1° | 0.0° |
| H1B | C1 | H1 | H1A | 119.9° | 120.0° |
| H1B | C1 | C2 | H2B | 59.4° | 60.0° |
| H1B | C1 | C2 | H2A | 59.4° | 180.0° |
| H1 | C1 | C2 | H2B | 60.6° | 180.0° |
| H1 | C1 | C2 | H2A | 179.4° | 60.0° |
| H1A | C1 | C2 | H2B | 179.4° | 60.0° |
| H1A | C1 | C2 | H2A | 60.6° | 60.0° |
| H14 | C14 | C16 | H16B | 172.5° | 161.8° |
| H14 | C14 | C16 | H16A | 68.8° | 78.2° |
| H29A | C29 | C30 | H30A | 57.5° | 57.6° |
| H29A | C29 | C30 | H30B | 61.7° | 62.5° |
| H29B | C29 | C30 | H30A | 176.7° | 177.7° |
| H29B | C29 | C30 | H30B | 57.5° | 57.6° |
| H32B | C32 | C33 | H33A | 166.8° | 57.6° |
| H32B | C32 | C33 | H33B | 48.2° | 62.6° |
| H32A | C32 | C33 | H33A | 48.1° | 177.7° |
| H32A | C32 | C33 | H33B | 70.6° | 57.5° |
