70O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | N27 | sing | 1.47Å | 1.47Å | |
| C26 | N27 | sing | 1.47Å | 1.49Å | |
| C26 | C25 | sing | 1.53Å | 1.54Å | |
| N27 | C28 | sing | 1.47Å | 1.48Å | |
| N21 | N20 | sing | 1.40Å | 1.40Å | Aromatic |
| N21 | C17 | doub | 1.32Å | 1.37Å | Aromatic |
| N20 | C19 | sing | 1.34Å | 1.31Å | Aromatic |
| C28 | C29 | sing | 1.53Å | 1.53Å | |
| C25 | C7 | sing | 1.53Å | 1.54Å | |
| C17 | C14 | sing | 1.41Å | 1.40Å | Aromatic |
| C17 | C18 | sing | 1.47Å | 1.42Å | Aromatic |
| C19 | C22 | sing | 1.51Å | 1.51Å | |
| C19 | C18 | doub | 1.39Å | 1.46Å | Aromatic |
| C7 | C29 | sing | 1.53Å | 1.54Å | |
| C7 | C5 | sing | 1.51Å | 1.52Å | |
| C22 | C23 | sing | 1.53Å | 1.55Å | |
| C14 | C15 | doub | 1.36Å | 1.38Å | Aromatic |
| C31 | C24 | sing | 1.53Å | 1.54Å | |
| C18 | C13 | sing | 1.41Å | 1.40Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | C24 | sing | 1.53Å | 1.56Å | |
| C15 | O16 | sing | 1.36Å | 1.35Å | |
| C15 | C12 | sing | 1.41Å | 1.42Å | Aromatic |
| C24 | C32 | sing | 1.53Å | 1.54Å | |
| C24 | C33 | sing | 1.53Å | 1.54Å | |
| C3 | C2 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | C1 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C10 | sing | 1.47Å | 1.49Å | |
| C2 | C1 | sing | 1.39Å | 1.41Å | Aromatic |
| C2 | N8 | sing | 1.40Å | 1.42Å | |
| C10 | N8 | sing | 1.35Å | 1.37Å | |
| C10 | O11 | doub | 1.22Å | 1.22Å | |
| N8 | C9 | sing | 1.47Å | 1.47Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | H2 | sing | 1.08Å | 1.08Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C9 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.08Å | 1.08Å | |
| C14 | H8 | sing | 1.08Å | 1.08Å | |
| C22 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C30 | H11 | sing | 1.09Å | 1.10Å | |
| C30 | H12 | sing | 1.09Å | 1.10Å | |
| C30 | H13 | sing | 1.09Å | 1.10Å | |
| C31 | H14 | sing | 1.09Å | 1.10Å | |
| C31 | H15 | sing | 1.09Å | 1.10Å | |
| C31 | H16 | sing | 1.09Å | 1.10Å | |
| C32 | H17 | sing | 1.09Å | 1.10Å | |
| C32 | H18 | sing | 1.09Å | 1.10Å | |
| C32 | H19 | sing | 1.09Å | 1.10Å | |
| C33 | H20 | sing | 1.09Å | 1.10Å | |
| C33 | H21 | sing | 1.09Å | 1.10Å | |
| C33 | H22 | sing | 1.09Å | 1.10Å | |
| C4 | H23 | sing | 1.08Å | 1.08Å | |
| C6 | H24 | sing | 1.08Å | 1.08Å | |
| O16 | H25 | sing | 0.97Å | 0.95Å | |
| N20 | H26 | sing | 0.97Å | 1.00Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C25 | H29 | sing | 1.09Å | 1.10Å | |
| C25 | H30 | sing | 1.09Å | 1.10Å | |
| C26 | H31 | sing | 1.09Å | 1.10Å | |
| C26 | H32 | sing | 1.09Å | 1.10Å | |
| C28 | H34 | sing | 1.09Å | 1.10Å | |
| C28 | H35 | sing | 1.09Å | 1.10Å | |
| C29 | H36 | sing | 1.09Å | 1.10Å | |
| C29 | H37 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C30 | N27 | C26 | 109.2° | 111.0° |
| C30 | N27 | C28 | 108.3° | 111.0° |
| N27 | C30 | H11 | 109.5° | 109.5° |
| N27 | C30 | H12 | 109.5° | 109.5° |
| N27 | C30 | H13 | 109.5° | 109.5° |
| N27 | C26 | C25 | 114.4° | 109.5° |
| C26 | N27 | C28 | 117.8° | 111.2° |
| N27 | C26 | H31 | 108.2° | 109.5° |
| N27 | C26 | H32 | 108.2° | 109.5° |
| C26 | C25 | C7 | 107.9° | 109.3° |
| C26 | C25 | H29 | 109.9° | 109.5° |
| C26 | C25 | H30 | 109.9° | 109.5° |
| C25 | C26 | H31 | 108.2° | 109.5° |
| C25 | C26 | H32 | 108.2° | 109.4° |
| N27 | C28 | C29 | 112.5° | 109.5° |
| N27 | C28 | H34 | 108.7° | 109.5° |
| N27 | C28 | H35 | 108.7° | 109.4° |
| N20 | N21 | C17 | 107.2° | 109.1° |
| N21 | N20 | C19 | 112.3° | 110.0° |
| N21 | N20 | H26 | 123.8° | 125.0° |
| N21 | C17 | C14 | 132.9° | 134.3° |
| N21 | C17 | C18 | 107.7° | 106.7° |
| N20 | C19 | C22 | 127.3° | 126.1° |
| N20 | C19 | C18 | 106.7° | 107.8° |
| C19 | N20 | H26 | 123.9° | 124.9° |
| C28 | C29 | C7 | 109.0° | 109.3° |
| C29 | C28 | H34 | 108.7° | 109.5° |
| C29 | C28 | H35 | 108.7° | 109.5° |
| C28 | C29 | H36 | 109.6° | 109.5° |
| C28 | C29 | H37 | 109.6° | 109.5° |
| C25 | C7 | C29 | 108.5° | 109.2° |
| C25 | C7 | C5 | 116.9° | 109.5° |
| C25 | C7 | H3 | 106.8° | 109.5° |
| C7 | C25 | H29 | 109.9° | 109.5° |
| C7 | C25 | H30 | 109.9° | 109.5° |
| C14 | C17 | C18 | 119.4° | 119.0° |
| C17 | C14 | C15 | 119.8° | 119.9° |
| C17 | C14 | H8 | 120.1° | 120.0° |
| C17 | C18 | C19 | 106.0° | 106.3° |
| C17 | C18 | C13 | 120.9° | 119.0° |
| C22 | C19 | C18 | 126.0° | 126.0° |
| C19 | C22 | C23 | 110.5° | 109.5° |
| C19 | C22 | H9 | 109.2° | 109.5° |
| C19 | C22 | H10 | 109.2° | 109.5° |
| C19 | C18 | C13 | 133.1° | 134.6° |
| C29 | C7 | C5 | 110.4° | 109.5° |
| C29 | C7 | H3 | 106.7° | 109.5° |
| C7 | C29 | H36 | 109.6° | 109.5° |
| C7 | C29 | H37 | 109.6° | 109.5° |
| C7 | C5 | C4 | 116.3° | 119.9° |
| C7 | C5 | C6 | 123.8° | 119.9° |
| C5 | C7 | H3 | 107.0° | 109.6° |
| C22 | C23 | C24 | 116.6° | 109.5° |
| C23 | C22 | H9 | 109.2° | 109.5° |
| C23 | C22 | H10 | 109.2° | 109.5° |
| C22 | C23 | H27 | 107.7° | 109.5° |
| C22 | C23 | H28 | 107.7° | 109.5° |
| C14 | C15 | O16 | 118.1° | 119.2° |
| C14 | C15 | C12 | 121.4° | 121.5° |
| C15 | C14 | H8 | 120.1° | 120.1° |
| C31 | C24 | C23 | 113.3° | 109.5° |
| C31 | C24 | C32 | 105.1° | 109.5° |
| C31 | C24 | C33 | 109.4° | 109.5° |
| C24 | C31 | H14 | 109.5° | 109.5° |
| C24 | C31 | H15 | 109.5° | 109.5° |
| C24 | C31 | H16 | 109.5° | 109.4° |
| C18 | C13 | C12 | 119.1° | 119.4° |
| C18 | C13 | H7 | 120.4° | 120.3° |
| C5 | C4 | C3 | 120.5° | 120.1° |
| C4 | C5 | C6 | 119.8° | 120.2° |
| C5 | C4 | H23 | 119.8° | 120.0° |
| C4 | C3 | C2 | 120.5° | 119.9° |
| C4 | C3 | H2 | 119.8° | 120.1° |
| C3 | C4 | H23 | 119.7° | 119.9° |
| C5 | C6 | C1 | 120.1° | 120.0° |
| C5 | C6 | H24 | 119.9° | 120.0° |
| C23 | C24 | C32 | 110.8° | 109.4° |
| C23 | C24 | C33 | 110.3° | 109.5° |
| C24 | C23 | H27 | 107.6° | 109.5° |
| C24 | C23 | H28 | 107.7° | 109.4° |
| O16 | C15 | C12 | 120.4° | 119.3° |
| C15 | O16 | H25 | 109.5° | 114.0° |
| C15 | C12 | C13 | 119.3° | 121.2° |
| C15 | C12 | C10 | 120.3° | 119.4° |
| C32 | C24 | C33 | 107.7° | 109.5° |
| C24 | C32 | H17 | 109.5° | 109.5° |
| C24 | C32 | H18 | 109.4° | 109.5° |
| C24 | C32 | H19 | 109.4° | 109.4° |
| C24 | C33 | H20 | 109.5° | 109.5° |
| C24 | C33 | H21 | 109.5° | 109.5° |
| C24 | C33 | H22 | 109.5° | 109.5° |
| C3 | C2 | C1 | 119.3° | 119.9° |
| C3 | C2 | N8 | 119.0° | 120.1° |
| C2 | C3 | H2 | 119.7° | 120.0° |
| C13 | C12 | C10 | 120.2° | 119.4° |
| C12 | C13 | H7 | 120.4° | 120.3° |
| C6 | C1 | C2 | 119.8° | 119.9° |
| C6 | C1 | H1 | 120.1° | 120.0° |
| C1 | C6 | H24 | 120.0° | 120.0° |
| C12 | C10 | N8 | 121.9° | 120.0° |
| C12 | C10 | O11 | 119.1° | 120.0° |
| C1 | C2 | N8 | 121.7° | 120.1° |
| C2 | C1 | H1 | 120.1° | 120.0° |
| C2 | N8 | C10 | 124.0° | 120.0° |
| C2 | N8 | C9 | 116.5° | 120.0° |
| N8 | C10 | O11 | 119.0° | 120.0° |
| C10 | N8 | C9 | 119.5° | 120.0° |
| N8 | C9 | H4 | 109.5° | 109.5° |
| N8 | C9 | H5 | 109.5° | 109.5° |
| N8 | C9 | H6 | 109.5° | 109.5° |
| H4 | C9 | H5 | 109.5° | 109.5° |
| H4 | C9 | H6 | 109.4° | 109.4° |
| H5 | C9 | H6 | 109.5° | 109.5° |
| H9 | C22 | H10 | 109.5° | 109.5° |
| H11 | C30 | H12 | 109.5° | 109.4° |
| H11 | C30 | H13 | 109.5° | 109.5° |
| H12 | C30 | H13 | 109.5° | 109.4° |
| H14 | C31 | H15 | 109.5° | 109.5° |
| H14 | C31 | H16 | 109.5° | 109.5° |
| H15 | C31 | H16 | 109.5° | 109.5° |
| H17 | C32 | H18 | 109.5° | 109.5° |
| H17 | C32 | H19 | 109.4° | 109.5° |
| H18 | C32 | H19 | 109.5° | 109.5° |
| H20 | C33 | H21 | 109.4° | 109.5° |
| H20 | C33 | H22 | 109.5° | 109.5° |
| H21 | C33 | H22 | 109.5° | 109.5° |
| H27 | C23 | H28 | 109.5° | 109.4° |
| H29 | C25 | H30 | 109.5° | 109.5° |
| H31 | C26 | H32 | 109.4° | 109.4° |
| H34 | C28 | H35 | 109.5° | 109.5° |
| H36 | C29 | H37 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C30 | N27 | C26 | C28 | 124.1° | 124.1° |
| C30 | N27 | C26 | C25 | 165.0° | 174.2° |
| C30 | N27 | C28 | C29 | 165.9° | 174.2° |
| N27 | C30 | H11 | H12 | 120.0° | 120.0° |
| N27 | C30 | H11 | H13 | 120.0° | 120.1° |
| N27 | C30 | H12 | H13 | 120.0° | 120.0° |
| C30 | N27 | C26 | H31 | 74.2° | 65.8° |
| C30 | N27 | C26 | H32 | 44.3° | 54.2° |
| C30 | N27 | C28 | H34 | 45.5° | 65.8° |
| C30 | N27 | C28 | H35 | 73.6° | 54.2° |
| N27 | C26 | C25 | H31 | 120.8° | 120.0° |
| N27 | C26 | C25 | H32 | 120.7° | 120.0° |
| C26 | N27 | C28 | C29 | 41.4° | 61.8° |
| N27 | C26 | C25 | C7 | 50.6° | 59.2° |
| C26 | N27 | C30 | H11 | 180.0° | 60.1° |
| C26 | N27 | C30 | H12 | 60.0° | 180.0° |
| C26 | N27 | C30 | H13 | 60.0° | 60.0° |
| N27 | C26 | C25 | H29 | 69.2° | 179.1° |
| N27 | C26 | C25 | H30 | 170.3° | 60.8° |
| N27 | C26 | H31 | H32 | 117.7° | 120.0° |
| C26 | N27 | C28 | H34 | 79.1° | 58.3° |
| C26 | N27 | C28 | H35 | 161.9° | 178.2° |
| C25 | C26 | N27 | C28 | 40.9° | 61.8° |
| C26 | C25 | C7 | H29 | 119.8° | 120.0° |
| C26 | C25 | C7 | H30 | 119.8° | 119.9° |
| C26 | C25 | C7 | C29 | 63.2° | 57.6° |
| C26 | C25 | C7 | C5 | 171.2° | 177.5° |
| C26 | C25 | C7 | H3 | 51.5° | 62.3° |
| C26 | C25 | H29 | H30 | 120.7° | 120.1° |
| C25 | C26 | H31 | H32 | 117.7° | 119.9° |
| N27 | C28 | C29 | H34 | 120.4° | 120.0° |
| N27 | C28 | C29 | H35 | 120.4° | 120.0° |
| N27 | C28 | C29 | C7 | 52.8° | 59.2° |
| C28 | N27 | C30 | H11 | 50.5° | 175.8° |
| C28 | N27 | C30 | H12 | 69.5° | 55.8° |
| C28 | N27 | C30 | H13 | 170.6° | 64.2° |
| C28 | N27 | C26 | H31 | 161.7° | 58.3° |
| C28 | N27 | C26 | H32 | 79.8° | 178.2° |
| N27 | C28 | H34 | H35 | 118.6° | 120.0° |
| N27 | C28 | C29 | H36 | 172.7° | 60.7° |
| N27 | C28 | C29 | H37 | 67.2° | 179.2° |
| N21 | N20 | C19 | H26 | 180.0° | 179.8° |
| N20 | N21 | C17 | C14 | 179.7° | 179.6° |
| N20 | N21 | C17 | C18 | 0.5° | 0.1° |
| N21 | N20 | C19 | C22 | 179.5° | 180.0° |
| N21 | N20 | C19 | C18 | 0.1° | 0.1° |
| C17 | N21 | N20 | C19 | 0.3° | 0.1° |
| N21 | C17 | C14 | C18 | 179.7° | 179.6° |
| N21 | C17 | C18 | C19 | 0.6° | 0.0° |
| N21 | C17 | C14 | C15 | 178.6° | 180.0° |
| N21 | C17 | C18 | C13 | 180.0° | 180.0° |
| N21 | C17 | C14 | H8 | 1.4° | 0.1° |
| C17 | N21 | N20 | H26 | 179.7° | 179.9° |
| N20 | C19 | C18 | C17 | 0.4° | 0.1° |
| N20 | C19 | C22 | C18 | 179.5° | 179.9° |
| N20 | C19 | C22 | C23 | 94.2° | 95.0° |
| N20 | C19 | C18 | C13 | 179.7° | 180.0° |
| N20 | C19 | C22 | H9 | 145.7° | 25.0° |
| N20 | C19 | C22 | H10 | 26.0° | 145.0° |
| C28 | C29 | C7 | C25 | 65.3° | 57.7° |
| C28 | C29 | C7 | H36 | 119.9° | 120.0° |
| C28 | C29 | C7 | H37 | 120.0° | 119.9° |
| C28 | C29 | C7 | C5 | 165.4° | 177.6° |
| C28 | C29 | C7 | H3 | 49.4° | 62.2° |
| C29 | C28 | H34 | H35 | 118.7° | 120.0° |
| C28 | C29 | H36 | H37 | 120.2° | 120.1° |
| C25 | C7 | C29 | C5 | 129.3° | 119.9° |
| C25 | C7 | C29 | H3 | 114.7° | 119.9° |
| C25 | C7 | C5 | H3 | 119.6° | 120.2° |
| C25 | C7 | C5 | C4 | 140.9° | 120.3° |
| C25 | C7 | C5 | C6 | 43.2° | 59.4° |
| C7 | C25 | H29 | H30 | 120.7° | 120.1° |
| C7 | C25 | C26 | H31 | 171.3° | 60.9° |
| C7 | C25 | C26 | H32 | 70.2° | 179.2° |
| C25 | C7 | C29 | H36 | 174.8° | 62.3° |
| C25 | C7 | C29 | H37 | 54.7° | 177.6° |
| C14 | C17 | C18 | C19 | 179.6° | 179.7° |
| C17 | C14 | C15 | H8 | 180.0° | 179.9° |
| C14 | C17 | C18 | C13 | 0.2° | 0.3° |
| C17 | C14 | C15 | O16 | 177.8° | 179.9° |
| C17 | C14 | C15 | C12 | 0.9° | 0.1° |
| C17 | C18 | C19 | C22 | 179.2° | 180.0° |
| C17 | C18 | C19 | C13 | 179.3° | 179.9° |
| C18 | C17 | C14 | C15 | 1.1° | 0.4° |
| C17 | C18 | C13 | C12 | 1.8° | 0.0° |
| C17 | C18 | C13 | H7 | 178.2° | 179.9° |
| C18 | C17 | C14 | H8 | 178.9° | 179.7° |
| C19 | C22 | C23 | H9 | 120.1° | 120.0° |
| C19 | C22 | C23 | H10 | 120.2° | 120.0° |
| C22 | C19 | C18 | C13 | 0.2° | 0.1° |
| C19 | C22 | C23 | C24 | 177.6° | 180.0° |
| C19 | C22 | H9 | H10 | 119.5° | 120.0° |
| C22 | C19 | N20 | H26 | 0.5° | 0.1° |
| C19 | C22 | C23 | H27 | 61.4° | 60.0° |
| C19 | C22 | C23 | H28 | 56.6° | 60.0° |
| C18 | C19 | C22 | C23 | 85.3° | 85.0° |
| C19 | C18 | C13 | C12 | 179.0° | 180.0° |
| C19 | C18 | C13 | H7 | 1.0° | 0.0° |
| C18 | C19 | C22 | H9 | 34.8° | 155.1° |
| C18 | C19 | C22 | H10 | 154.5° | 35.0° |
| C18 | C19 | N20 | H26 | 179.9° | 179.9° |
| C29 | C7 | C5 | H3 | 115.8° | 120.1° |
| C29 | C7 | C5 | C4 | 94.5° | 120.0° |
| C29 | C7 | C5 | C6 | 81.4° | 60.2° |
| C29 | C7 | C25 | H29 | 56.6° | 177.6° |
| C29 | C7 | C25 | H30 | 177.1° | 62.3° |
| C7 | C29 | C28 | H34 | 67.7° | 60.8° |
| C7 | C29 | C28 | H35 | 173.2° | 179.2° |
| C7 | C29 | H36 | H37 | 120.2° | 120.1° |
| C7 | C5 | C4 | C6 | 176.0° | 179.8° |
| C7 | C5 | C4 | C3 | 176.7° | 180.0° |
| C7 | C5 | C6 | C1 | 177.1° | 179.7° |
| C7 | C5 | C4 | H23 | 3.3° | 0.2° |
| C7 | C5 | C6 | H24 | 2.9° | 0.0° |
| C5 | C7 | C25 | H29 | 69.0° | 62.5° |
| C5 | C7 | C25 | H30 | 51.5° | 57.6° |
| C5 | C7 | C29 | H36 | 45.5° | 57.6° |
| C5 | C7 | C29 | H37 | 74.6° | 62.5° |
| C22 | C23 | C24 | C31 | 51.5° | 180.0° |
| C22 | C23 | C24 | H27 | 121.0° | 120.1° |
| C22 | C23 | C24 | H28 | 121.0° | 120.0° |
| C22 | C23 | C24 | C32 | 169.4° | 60.0° |
| C22 | C23 | C24 | C33 | 71.5° | 60.0° |
| C23 | C22 | H9 | H10 | 119.5° | 120.0° |
| C22 | C23 | H27 | H28 | 116.8° | 120.0° |
| C14 | C15 | O16 | C12 | 177.0° | 179.9° |
| C14 | C15 | C12 | C13 | 0.7° | 0.2° |
| C14 | C15 | C12 | C10 | 175.7° | 179.9° |
| C14 | C15 | O16 | H25 | 163.7° | 90.0° |
| C31 | C24 | C23 | C32 | 117.9° | 120.0° |
| C31 | C24 | C23 | C33 | 123.0° | 120.0° |
| C31 | C24 | C32 | C33 | 116.5° | 120.1° |
| C24 | C31 | H14 | H15 | 120.0° | 120.0° |
| C24 | C31 | H14 | H16 | 120.0° | 120.0° |
| C24 | C31 | H15 | H16 | 120.0° | 119.9° |
| C31 | C24 | C32 | H17 | 180.0° | 180.0° |
| C31 | C24 | C32 | H18 | 60.0° | 59.9° |
| C31 | C24 | C32 | H19 | 60.0° | 60.1° |
| C31 | C24 | C33 | H20 | 180.0° | 60.0° |
| C31 | C24 | C33 | H21 | 60.0° | 60.0° |
| C31 | C24 | C33 | H22 | 60.0° | 180.0° |
| C31 | C24 | C23 | H27 | 69.5° | 59.9° |
| C31 | C24 | C23 | H28 | 172.6° | 60.0° |
| C18 | C13 | C12 | C15 | 2.0° | 0.2° |
| C18 | C13 | C12 | H7 | 180.0° | 180.0° |
| C18 | C13 | C12 | C10 | 174.4° | 180.0° |
| C5 | C4 | C3 | H23 | 180.0° | 179.7° |
| C5 | C4 | C3 | C2 | 0.3° | 0.0° |
| C4 | C5 | C6 | C1 | 1.4° | 0.5° |
| C5 | C4 | C3 | H2 | 179.7° | 180.0° |
| C4 | C5 | C7 | H3 | 21.4° | 0.1° |
| C4 | C5 | C6 | H24 | 178.6° | 179.8° |
| C3 | C4 | C5 | C6 | 0.7° | 0.3° |
| C4 | C3 | C2 | H2 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.5° | 0.0° |
| C4 | C3 | C2 | N8 | 178.9° | 180.0° |
| C5 | C6 | C1 | H24 | 180.0° | 179.7° |
| C5 | C6 | C1 | C2 | 1.2° | 0.5° |
| C5 | C6 | C1 | H1 | 178.8° | 179.7° |
| C6 | C5 | C7 | H3 | 162.8° | 179.6° |
| C6 | C5 | C4 | H23 | 179.3° | 180.0° |
| C23 | C24 | C32 | C33 | 120.7° | 120.0° |
| C24 | C23 | C22 | H9 | 57.4° | 60.0° |
| C24 | C23 | C22 | H10 | 62.3° | 60.1° |
| C23 | C24 | C31 | H14 | 180.0° | 60.0° |
| C23 | C24 | C31 | H15 | 60.0° | 60.1° |
| C23 | C24 | C31 | H16 | 60.0° | 180.0° |
| C23 | C24 | C32 | H17 | 57.2° | 60.0° |
| C23 | C24 | C32 | H18 | 177.2° | 60.0° |
| C23 | C24 | C32 | H19 | 62.8° | 180.0° |
| C23 | C24 | C33 | H20 | 54.7° | 180.0° |
| C23 | C24 | C33 | H21 | 65.3° | 60.0° |
| C23 | C24 | C33 | H22 | 174.7° | 60.0° |
| C24 | C23 | H27 | H28 | 116.8° | 119.9° |
| O16 | C15 | C12 | C13 | 176.2° | 179.8° |
| O16 | C15 | C12 | C10 | 7.4° | 0.0° |
| O16 | C15 | C14 | H8 | 2.2° | 0.0° |
| C15 | C12 | C13 | C10 | 176.4° | 179.8° |
| C15 | C12 | C10 | N8 | 116.4° | 155.5° |
| C15 | C12 | C10 | O11 | 63.2° | 24.5° |
| C15 | C12 | C13 | H7 | 178.0° | 179.8° |
| C12 | C15 | C14 | H8 | 179.1° | 180.0° |
| C12 | C15 | O16 | H25 | 13.3° | 90.0° |
| C32 | C24 | C31 | H14 | 58.9° | 59.9° |
| C32 | C24 | C31 | H15 | 178.9° | 180.0° |
| C32 | C24 | C31 | H16 | 61.1° | 60.1° |
| C24 | C32 | H17 | H18 | 120.0° | 120.0° |
| C24 | C32 | H17 | H19 | 120.0° | 120.0° |
| C24 | C32 | H18 | H19 | 120.0° | 120.0° |
| C32 | C24 | C33 | H20 | 66.3° | 60.0° |
| C32 | C24 | C33 | H21 | 173.7° | 180.0° |
| C32 | C24 | C33 | H22 | 53.7° | 60.0° |
| C32 | C24 | C23 | H27 | 48.3° | 60.1° |
| C32 | C24 | C23 | H28 | 69.6° | 180.0° |
| C33 | C24 | C31 | H14 | 56.5° | 180.0° |
| C33 | C24 | C31 | H15 | 63.5° | 60.0° |
| C33 | C24 | C31 | H16 | 176.5° | 60.0° |
| C33 | C24 | C32 | H17 | 63.5° | 60.0° |
| C33 | C24 | C32 | H18 | 56.5° | 180.0° |
| C33 | C24 | C32 | H19 | 176.6° | 60.0° |
| C24 | C33 | H20 | H21 | 120.0° | 120.0° |
| C24 | C33 | H20 | H22 | 120.0° | 120.0° |
| C24 | C33 | H21 | H22 | 120.0° | 120.0° |
| C33 | C24 | C23 | H27 | 167.5° | 179.9° |
| C33 | C24 | C23 | H28 | 49.6° | 60.0° |
| C3 | C2 | C1 | C6 | 0.2° | 0.3° |
| C3 | C2 | C1 | N8 | 178.3° | 180.0° |
| C3 | C2 | N8 | C10 | 62.8° | 7.8° |
| C3 | C2 | N8 | C9 | 115.4° | 172.2° |
| C3 | C2 | C1 | H1 | 179.8° | 180.0° |
| C2 | C3 | C4 | H23 | 179.7° | 179.7° |
| C13 | C12 | C10 | N8 | 60.0° | 24.8° |
| C13 | C12 | C10 | O11 | 120.4° | 155.3° |
| C6 | C1 | C2 | H1 | 180.0° | 179.7° |
| C6 | C1 | C2 | N8 | 178.1° | 179.8° |
| C12 | C10 | N8 | C2 | 0.6° | 176.0° |
| C12 | C10 | N8 | O11 | 179.6° | 180.0° |
| C12 | C10 | N8 | C9 | 178.8° | 4.0° |
| C10 | C12 | C13 | H7 | 5.6° | 0.1° |
| C1 | C2 | N8 | C10 | 118.9° | 172.2° |
| C1 | C2 | N8 | C9 | 62.9° | 7.8° |
| C1 | C2 | C3 | H2 | 179.5° | 180.0° |
| C2 | C1 | C6 | H24 | 178.8° | 179.8° |
| C2 | N8 | C10 | C9 | 178.1° | 180.0° |
| C2 | N8 | C10 | O11 | 179.0° | 4.1° |
| N8 | C2 | C1 | H1 | 1.9° | 0.0° |
| N8 | C2 | C3 | H2 | 1.1° | 0.0° |
| C2 | N8 | C9 | H4 | 180.0° | 83.3° |
| C2 | N8 | C9 | H5 | 60.0° | 156.6° |
| C2 | N8 | C9 | H6 | 60.0° | 36.6° |
| C10 | N8 | C9 | H4 | 1.7° | 96.7° |
| C10 | N8 | C9 | H5 | 118.3° | 23.4° |
| C10 | N8 | C9 | H6 | 121.7° | 143.4° |
| O11 | C10 | N8 | C9 | 0.8° | 176.0° |
| N8 | C9 | H4 | H5 | 120.0° | 120.1° |
| N8 | C9 | H4 | H6 | 120.0° | 120.0° |
| N8 | C9 | H5 | H6 | 120.0° | 120.0° |
| H1 | C1 | C6 | H24 | 1.2° | 0.1° |
| H2 | C3 | C4 | H23 | 0.3° | 0.3° |
| H3 | C7 | C25 | H29 | 171.3° | 57.7° |
| H3 | C7 | C25 | H30 | 68.2° | 177.8° |
| H3 | C7 | C29 | H36 | 70.5° | 177.8° |
| H3 | C7 | C29 | H37 | 169.4° | 57.7° |
| H4 | C9 | H5 | H6 | 119.9° | 119.9° |
| H9 | C22 | C23 | H27 | 178.5° | 179.9° |
| H9 | C22 | C23 | H28 | 63.6° | 60.0° |
| H10 | C22 | C23 | H27 | 58.8° | 60.0° |
| H10 | C22 | C23 | H28 | 176.7° | 180.0° |
| H11 | C30 | H12 | H13 | 120.0° | 120.0° |
| H14 | C31 | H15 | H16 | 120.0° | 120.0° |
| H17 | C32 | H18 | H19 | 120.0° | 120.0° |
| H20 | C33 | H21 | H22 | 120.0° | 120.0° |
| H29 | C25 | C26 | H31 | 51.6° | 59.1° |
| H29 | C25 | C26 | H32 | 170.1° | 60.8° |
| H30 | C25 | C26 | H31 | 68.9° | 179.2° |
| H30 | C25 | C26 | H32 | 49.6° | 59.3° |
| H34 | C28 | C29 | H36 | 52.3° | 179.2° |
| H34 | C28 | C29 | H37 | 172.4° | 59.1° |
| H35 | C28 | C29 | H36 | 66.9° | 59.2° |
| H35 | C28 | C29 | H37 | 53.2° | 60.9° |
