SMU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C29 | doub | 1.38Å | 1.37Å | Aromatic |
| C30 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.42Å | Aromatic |
| C31 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C27 | doub | 1.40Å | 1.40Å | Aromatic |
| C32 | C27 | sing | 1.40Å | 1.38Å | Aromatic |
| C27 | C15 | sing | 1.47Å | 1.49Å | |
| C13 | C12 | doub | 1.36Å | 1.36Å | |
| C13 | C14 | sing | 1.41Å | 1.46Å | |
| C15 | C14 | doub | 1.41Å | 1.44Å | |
| C15 | C16 | sing | 1.41Å | 1.41Å | |
| C12 | C11 | sing | 1.41Å | 1.44Å | |
| C14 | N3 | sing | 1.35Å | 1.37Å | |
| C17 | C16 | sing | 1.41Å | 1.47Å | |
| C17 | C18 | doub | 1.35Å | 1.37Å | |
| C16 | N4 | doub | 1.35Å | 1.36Å | |
| C11 | N3 | sing | 1.36Å | 1.36Å | |
| C11 | C10 | doub | 1.39Å | 1.41Å | |
| N3 | MN1 | sing | 1.90Å | 2.04Å | |
| C18 | C19 | sing | 1.41Å | 1.43Å | |
| N4 | C19 | sing | 1.37Å | 1.37Å | |
| N4 | MN1 | sing | 1.88Å | 2.11Å | |
| C10 | C9 | sing | 1.39Å | 1.41Å | |
| C19 | C20 | doub | 1.39Å | 1.41Å | |
| MN1 | N2 | sing | 1.88Å | 2.04Å | |
| MN1 | N1 | sing | 1.90Å | 2.11Å | |
| C9 | N2 | doub | 1.36Å | 1.37Å | |
| C9 | C8 | sing | 1.41Å | 1.45Å | |
| C20 | C1 | sing | 1.39Å | 1.41Å | |
| N2 | C6 | sing | 1.36Å | 1.37Å | |
| C8 | C7 | doub | 1.35Å | 1.33Å | |
| N1 | C1 | sing | 1.36Å | 1.37Å | Aromatic |
| N1 | C4 | sing | 1.35Å | 1.38Å | Aromatic |
| C1 | C2 | doub | 1.41Å | 1.45Å | Aromatic |
| C6 | C7 | sing | 1.40Å | 1.46Å | |
| C6 | C5 | doub | 1.41Å | 1.40Å | |
| C4 | C5 | sing | 1.40Å | 1.42Å | |
| C4 | C3 | doub | 1.41Å | 1.46Å | Aromatic |
| C2 | C3 | sing | 1.35Å | 1.35Å | Aromatic |
| C5 | C21 | sing | 1.47Å | 1.51Å | |
| C21 | C22 | doub | 1.40Å | 1.38Å | Aromatic |
| C21 | C26 | sing | 1.40Å | 1.40Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.36Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C12 | H2 | sing | 1.08Å | 1.08Å | |
| C13 | H3 | sing | 1.08Å | 1.08Å | |
| C17 | H4 | sing | 1.08Å | 1.08Å | |
| C18 | H5 | sing | 1.08Å | 1.08Å | |
| C2 | H6 | sing | 1.08Å | 1.08Å | |
| C20 | H7 | sing | 1.08Å | 1.08Å | |
| C22 | H8 | sing | 1.08Å | 1.08Å | |
| C23 | H9 | sing | 1.08Å | 1.08Å | |
| C24 | H10 | sing | 1.08Å | 1.08Å | |
| C25 | H11 | sing | 1.08Å | 1.08Å | |
| C26 | H12 | sing | 1.08Å | 1.08Å | |
| C28 | H13 | sing | 1.08Å | 1.08Å | |
| C29 | H14 | sing | 1.08Å | 1.08Å | |
| C3 | H15 | sing | 1.08Å | 1.08Å | |
| C30 | H16 | sing | 1.08Å | 1.08Å | |
| C31 | H17 | sing | 1.08Å | 1.08Å | |
| C32 | H18 | sing | 1.08Å | 1.08Å | |
| C7 | H19 | sing | 1.08Å | 1.08Å | |
| C8 | H20 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C29 | C30 | C31 | 120.5° | 120.3° |
| C30 | C29 | C28 | 118.5° | 120.2° |
| C30 | C29 | H14 | 120.8° | 119.9° |
| C29 | C30 | H16 | 119.8° | 119.8° |
| C30 | C31 | C32 | 120.2° | 120.1° |
| C31 | C30 | H16 | 119.8° | 119.8° |
| C30 | C31 | H17 | 119.9° | 119.9° |
| C29 | C28 | C27 | 122.3° | 119.8° |
| C29 | C28 | H13 | 118.8° | 120.1° |
| C28 | C29 | H14 | 120.8° | 119.9° |
| C31 | C32 | C27 | 121.8° | 119.9° |
| C32 | C31 | H17 | 119.9° | 119.9° |
| C31 | C32 | H18 | 119.1° | 120.1° |
| C28 | C27 | C32 | 116.9° | 119.7° |
| C28 | C27 | C15 | 122.0° | 120.1° |
| C27 | C28 | H13 | 118.9° | 120.1° |
| C32 | C27 | C15 | 121.2° | 120.2° |
| C27 | C32 | H18 | 119.1° | 120.0° |
| C27 | C15 | C14 | 117.1° | 120.8° |
| C27 | C15 | C16 | 118.8° | 120.9° |
| C12 | C13 | C14 | 107.2° | 106.3° |
| C13 | C12 | C11 | 106.6° | 106.0° |
| C13 | C12 | H2 | 126.7° | 127.3° |
| C12 | C13 | H3 | 126.4° | 127.2° |
| C13 | C14 | C15 | 125.8° | 124.7° |
| C13 | C14 | N3 | 109.1° | 109.9° |
| C14 | C13 | H3 | 126.4° | 126.5° |
| C14 | C15 | C16 | 124.1° | 118.3° |
| C15 | C14 | N3 | 125.1° | 125.3° |
| C15 | C16 | C17 | 125.2° | 122.8° |
| C15 | C16 | N4 | 126.2° | 126.9° |
| C12 | C11 | N3 | 110.4° | 109.2° |
| C12 | C11 | C10 | 123.0° | 124.7° |
| C11 | C12 | H2 | 126.7° | 126.7° |
| C14 | N3 | C11 | 106.8° | 104.8° |
| C14 | N3 | MN1 | 129.0° | 127.6° |
| C16 | C17 | C18 | 106.8° | 106.5° |
| C17 | C16 | N4 | 108.6° | 110.3° |
| C16 | C17 | H4 | 126.6° | 126.3° |
| C17 | C18 | C19 | 106.9° | 106.7° |
| C18 | C17 | H4 | 126.6° | 127.2° |
| C17 | C18 | H5 | 126.6° | 126.9° |
| C16 | N4 | C19 | 108.0° | 104.8° |
| C16 | N4 | MN1 | 126.6° | 127.5° |
| N3 | C11 | C10 | 126.6° | 126.1° |
| C11 | N3 | MN1 | 124.2° | 127.6° |
| C11 | C10 | C9 | 125.6° | 118.0° |
| C11 | C10 | H1 | 117.2° | 120.7° |
| N3 | MN1 | N4 | 88.0° | 91.3° |
| N3 | MN1 | N2 | 92.7° | 90.5° |
| N3 | MN1 | N1 | 173.3° | 172.1° |
| C18 | C19 | N4 | 109.8° | 110.0° |
| C18 | C19 | C20 | 123.3° | 123.8° |
| C19 | C18 | H5 | 126.5° | 126.4° |
| C19 | N4 | MN1 | 124.9° | 127.8° |
| N4 | C19 | C20 | 127.0° | 126.2° |
| N4 | MN1 | N2 | 171.0° | 153.6° |
| N4 | MN1 | N1 | 88.7° | 90.7° |
| C10 | C9 | N2 | 126.0° | 126.8° |
| C10 | C9 | C8 | 125.3° | 123.4° |
| C9 | C10 | H1 | 117.2° | 121.2° |
| C19 | C20 | C1 | 127.2° | 119.0° |
| C19 | C20 | H7 | 116.4° | 120.5° |
| N2 | MN1 | N1 | 89.6° | 91.0° |
| MN1 | N2 | C9 | 123.7° | 127.8° |
| MN1 | N2 | C6 | 126.7° | 127.8° |
| MN1 | N1 | C1 | 128.1° | 127.6° |
| MN1 | N1 | C4 | 124.5° | 127.3° |
| N2 | C9 | C8 | 108.7° | 109.8° |
| C9 | N2 | C6 | 108.1° | 104.4° |
| C9 | C8 | C7 | 107.2° | 106.3° |
| C9 | C8 | H20 | 126.4° | 126.6° |
| C20 | C1 | N1 | 123.7° | 125.1° |
| C20 | C1 | C2 | 127.0° | 125.6° |
| C1 | C20 | H7 | 116.4° | 120.5° |
| N2 | C6 | C7 | 107.9° | 110.2° |
| N2 | C6 | C5 | 126.0° | 125.7° |
| C8 | C7 | C6 | 108.1° | 106.5° |
| C8 | C7 | H19 | 125.9° | 126.8° |
| C7 | C8 | H20 | 126.4° | 127.1° |
| C1 | N1 | C4 | 107.2° | 105.1° |
| N1 | C1 | C2 | 109.3° | 109.2° |
| N1 | C4 | C5 | 125.9° | 125.9° |
| N1 | C4 | C3 | 109.2° | 109.1° |
| C1 | C2 | C3 | 107.9° | 106.4° |
| C1 | C2 | H6 | 126.1° | 126.3° |
| C7 | C6 | C5 | 126.1° | 124.0° |
| C6 | C7 | H19 | 126.0° | 126.7° |
| C6 | C5 | C4 | 125.7° | 118.3° |
| C6 | C5 | C21 | 116.7° | 120.9° |
| C5 | C4 | C3 | 124.9° | 125.0° |
| C4 | C5 | C21 | 117.7° | 120.8° |
| C4 | C3 | C2 | 106.4° | 106.3° |
| C4 | C3 | H15 | 126.8° | 126.4° |
| C3 | C2 | H6 | 126.0° | 127.2° |
| C2 | C3 | H15 | 126.8° | 127.4° |
| C5 | C21 | C22 | 121.9° | 120.2° |
| C5 | C21 | C26 | 119.0° | 120.2° |
| C22 | C21 | C26 | 119.1° | 119.7° |
| C21 | C22 | C23 | 122.3° | 119.9° |
| C21 | C22 | H8 | 118.9° | 120.1° |
| C21 | C26 | C25 | 118.6° | 119.9° |
| C21 | C26 | H12 | 120.7° | 120.1° |
| C22 | C23 | C24 | 118.6° | 120.1° |
| C23 | C22 | H8 | 118.9° | 120.1° |
| C22 | C23 | H9 | 120.7° | 120.0° |
| C26 | C25 | C24 | 120.9° | 120.1° |
| C26 | C25 | H11 | 119.5° | 119.9° |
| C25 | C26 | H12 | 120.7° | 120.1° |
| C23 | C24 | C25 | 120.6° | 120.4° |
| C24 | C23 | H9 | 120.7° | 119.9° |
| C23 | C24 | H10 | 119.7° | 119.8° |
| C25 | C24 | H10 | 119.7° | 119.8° |
| C24 | C25 | H11 | 119.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C29 | C30 | C31 | H16 | 180.0° | 180.0° |
| C30 | C29 | C28 | H14 | 180.0° | 179.9° |
| C29 | C30 | C31 | C32 | 0.1° | 0.2° |
| C30 | C29 | C28 | C27 | 0.8° | 0.1° |
| C30 | C29 | C28 | H13 | 179.1° | 179.9° |
| C29 | C30 | C31 | H17 | 179.9° | 179.9° |
| C31 | C30 | C29 | C28 | 0.4° | 0.1° |
| C30 | C31 | C32 | H17 | 180.0° | 179.7° |
| C30 | C31 | C32 | C27 | 0.2° | 0.6° |
| C31 | C30 | C29 | H14 | 179.6° | 180.0° |
| C30 | C31 | C32 | H18 | 179.8° | 180.0° |
| C29 | C28 | C27 | H13 | 180.0° | 180.0° |
| C29 | C28 | C27 | C32 | 0.7° | 0.2° |
| C29 | C28 | C27 | C15 | 179.5° | 180.0° |
| C28 | C29 | C30 | H16 | 179.6° | 179.9° |
| C31 | C32 | C27 | C28 | 0.2° | 0.6° |
| C31 | C32 | C27 | H18 | 180.0° | 179.4° |
| C31 | C32 | C27 | C15 | 180.0° | 179.7° |
| C32 | C31 | C30 | H16 | 179.9° | 179.7° |
| C28 | C27 | C32 | C15 | 179.8° | 179.7° |
| C28 | C27 | C15 | C14 | 73.3° | 115.0° |
| C28 | C27 | C15 | C16 | 107.7° | 64.9° |
| C27 | C28 | C29 | H14 | 179.1° | 180.0° |
| C28 | C27 | C32 | H18 | 179.8° | 180.0° |
| C32 | C27 | C15 | C14 | 107.0° | 65.3° |
| C32 | C27 | C15 | C16 | 72.1° | 114.8° |
| C32 | C27 | C28 | H13 | 179.2° | 179.7° |
| C27 | C32 | C31 | H17 | 179.8° | 179.7° |
| C27 | C15 | C14 | C13 | 5.2° | 7.3° |
| C27 | C15 | C14 | C16 | 179.0° | 179.9° |
| C27 | C15 | C14 | N3 | 174.3° | 169.3° |
| C27 | C15 | C16 | C17 | 0.5° | 6.9° |
| C27 | C15 | C16 | N4 | 179.8° | 173.5° |
| C15 | C27 | C28 | H13 | 0.6° | 0.0° |
| C15 | C27 | C32 | H18 | 0.0° | 0.3° |
| C12 | C13 | C14 | H3 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 179.8° | 166.6° |
| C13 | C12 | C11 | H2 | 180.0° | 178.7° |
| C12 | C13 | C14 | N3 | 0.3° | 10.5° |
| C13 | C12 | C11 | N3 | 0.5° | 13.3° |
| C13 | C12 | C11 | C10 | 179.4° | 166.1° |
| C13 | C14 | C15 | N3 | 179.5° | 176.6° |
| C13 | C14 | C15 | C16 | 173.8° | 172.6° |
| C14 | C13 | C12 | C11 | 0.4° | 1.7° |
| C13 | C14 | N3 | C11 | 0.0° | 18.4° |
| C13 | C14 | N3 | MN1 | 179.2° | 161.6° |
| C14 | C13 | C12 | H2 | 179.6° | 179.6° |
| C14 | C15 | C16 | C17 | 178.5° | 173.2° |
| C14 | C15 | C16 | N4 | 1.2° | 6.4° |
| C15 | C14 | N3 | C11 | 179.5° | 158.6° |
| C15 | C14 | N3 | MN1 | 1.3° | 21.4° |
| C15 | C14 | C13 | H3 | 0.1° | 13.4° |
| C16 | C15 | C14 | N3 | 6.8° | 10.8° |
| C15 | C16 | C17 | N4 | 179.7° | 179.7° |
| C15 | C16 | C17 | C18 | 179.3° | 171.3° |
| C15 | C16 | N4 | C19 | 179.3° | 167.0° |
| C15 | C16 | N4 | MN1 | 8.9° | 12.4° |
| C15 | C16 | C17 | H4 | 0.8° | 8.6° |
| C12 | C11 | N3 | C14 | 0.3° | 19.4° |
| C12 | C11 | N3 | C10 | 179.8° | 179.4° |
| C12 | C11 | N3 | MN1 | 178.9° | 160.6° |
| C12 | C11 | C10 | C9 | 179.3° | 174.2° |
| C12 | C11 | C10 | H1 | 0.7° | 8.9° |
| C11 | C12 | C13 | H3 | 179.5° | 178.3° |
| C14 | N3 | C11 | MN1 | 179.2° | 180.0° |
| C14 | N3 | C11 | C10 | 179.6° | 159.9° |
| C14 | N3 | MN1 | N4 | 5.5° | 12.7° |
| C14 | N3 | MN1 | N2 | 176.5° | 166.4° |
| C14 | N3 | MN1 | N1 | 66.3° | 92.2° |
| N3 | C14 | C13 | H3 | 179.7° | 169.5° |
| C16 | C17 | C18 | H4 | 180.0° | 179.9° |
| C16 | C17 | C18 | C19 | 0.4° | 0.8° |
| C17 | C16 | N4 | C19 | 0.4° | 13.3° |
| C17 | C16 | N4 | MN1 | 171.4° | 167.3° |
| C16 | C17 | C18 | H5 | 179.7° | 179.2° |
| C18 | C17 | C16 | N4 | 0.5° | 9.0° |
| C17 | C18 | C19 | H5 | 180.0° | 179.9° |
| C17 | C18 | C19 | N4 | 0.1° | 7.5° |
| C17 | C18 | C19 | C20 | 179.5° | 169.5° |
| C16 | N4 | MN1 | N3 | 10.2° | 3.1° |
| C16 | N4 | C19 | C18 | 0.2° | 12.7° |
| C16 | N4 | C19 | MN1 | 172.0° | 179.4° |
| C16 | N4 | C19 | C20 | 179.8° | 164.1° |
| C16 | N4 | MN1 | N2 | 104.7° | 90.8° |
| C16 | N4 | MN1 | N1 | 175.7° | 175.4° |
| N4 | C16 | C17 | H4 | 179.5° | 171.1° |
| C11 | N3 | MN1 | N4 | 173.6° | 167.3° |
| N3 | C11 | C10 | C9 | 0.5° | 6.5° |
| C11 | N3 | MN1 | N2 | 2.5° | 13.6° |
| C11 | N3 | MN1 | N1 | 112.8° | 87.8° |
| N3 | C11 | C10 | H1 | 179.5° | 170.3° |
| N3 | C11 | C12 | H2 | 179.5° | 168.0° |
| C10 | C11 | N3 | MN1 | 1.2° | 20.1° |
| C11 | C10 | C9 | H1 | 180.0° | 176.8° |
| C11 | C10 | C9 | N2 | 9.1° | 11.1° |
| C11 | C10 | C9 | C8 | 171.7° | 168.0° |
| C10 | C11 | C12 | H2 | 0.6° | 12.6° |
| N3 | MN1 | N4 | C19 | 179.3° | 176.3° |
| N3 | MN1 | N4 | N2 | 94.5° | 93.8° |
| N3 | MN1 | N4 | N1 | 174.1° | 172.4° |
| N3 | MN1 | N2 | N1 | 173.7° | 172.3° |
| N3 | MN1 | N2 | C9 | 9.6° | 2.3° |
| N3 | MN1 | N2 | C6 | 173.5° | 177.0° |
| N3 | MN1 | N1 | C1 | 60.2° | 91.4° |
| N3 | MN1 | N1 | C4 | 114.7° | 88.0° |
| C18 | C19 | N4 | C20 | 179.6° | 176.9° |
| C18 | C19 | N4 | MN1 | 171.8° | 167.8° |
| C18 | C19 | C20 | C1 | 176.3° | 174.2° |
| C19 | C18 | C17 | H4 | 179.6° | 179.2° |
| C18 | C19 | C20 | H7 | 3.7° | 5.8° |
| C19 | N4 | MN1 | N2 | 84.8° | 89.9° |
| C19 | N4 | MN1 | N1 | 5.2° | 3.9° |
| N4 | C19 | C20 | C1 | 3.3° | 9.3° |
| N4 | C19 | C18 | H5 | 179.9° | 172.4° |
| N4 | C19 | C20 | H7 | 176.7° | 170.7° |
| MN1 | N4 | C19 | C20 | 7.9° | 15.3° |
| N4 | MN1 | N2 | N1 | 79.6° | 93.7° |
| N4 | MN1 | N2 | C9 | 103.7° | 91.7° |
| N4 | MN1 | N2 | C6 | 92.4° | 88.9° |
| N4 | MN1 | N1 | C1 | 0.6° | 13.6° |
| N4 | MN1 | N1 | C4 | 175.5° | 167.1° |
| C10 | C9 | N2 | MN1 | 14.1° | 14.5° |
| C10 | C9 | N2 | C8 | 179.4° | 179.1° |
| C10 | C9 | N2 | C6 | 179.4° | 165.0° |
| C10 | C9 | C8 | C7 | 179.8° | 171.1° |
| C10 | C9 | C8 | H20 | 0.2° | 9.1° |
| C19 | C20 | C1 | H7 | 180.0° | 180.0° |
| C19 | C20 | C1 | N1 | 3.4° | 9.8° |
| C19 | C20 | C1 | C2 | 176.9° | 174.0° |
| C20 | C19 | C18 | H5 | 0.4° | 10.6° |
| MN1 | N2 | C9 | C6 | 166.5° | 179.4° |
| MN1 | N2 | C9 | C8 | 166.5° | 164.7° |
| N2 | MN1 | N1 | C1 | 170.6° | 167.2° |
| N2 | MN1 | N1 | C4 | 4.3° | 13.5° |
| MN1 | N2 | C6 | C7 | 165.6° | 164.2° |
| MN1 | N2 | C6 | C5 | 13.8° | 18.8° |
| N1 | MN1 | N2 | C9 | 176.8° | 174.5° |
| MN1 | N1 | C1 | C20 | 4.5° | 22.3° |
| N1 | MN1 | N2 | C6 | 12.8° | 4.8° |
| MN1 | N1 | C1 | C4 | 175.6° | 179.4° |
| MN1 | N1 | C1 | C2 | 175.8° | 161.0° |
| MN1 | N1 | C4 | C5 | 4.2° | 20.4° |
| MN1 | N1 | C4 | C3 | 175.9° | 159.3° |
| N2 | C9 | C8 | C7 | 0.4° | 9.7° |
| C9 | N2 | C6 | C7 | 0.4° | 16.3° |
| C9 | N2 | C6 | C5 | 179.8° | 160.6° |
| N2 | C9 | C10 | H1 | 170.9° | 172.1° |
| N2 | C9 | C8 | H20 | 179.6° | 170.1° |
| C8 | C9 | N2 | C6 | 0.0° | 15.9° |
| C9 | C8 | C7 | H20 | 180.0° | 179.7° |
| C9 | C8 | C7 | C6 | 0.6° | 0.6° |
| C8 | C9 | C10 | H1 | 8.4° | 8.9° |
| C9 | C8 | C7 | H19 | 179.3° | 179.3° |
| C20 | C1 | N1 | C2 | 179.7° | 176.7° |
| C20 | C1 | N1 | C4 | 179.9° | 158.3° |
| C20 | C1 | C2 | C3 | 179.9° | 166.9° |
| C20 | C1 | C2 | H6 | 0.1° | 13.2° |
| N2 | C6 | C7 | C8 | 0.6° | 10.8° |
| N2 | C6 | C7 | C5 | 179.5° | 177.0° |
| N2 | C6 | C5 | C4 | 1.8° | 14.4° |
| N2 | C6 | C5 | C21 | 176.9° | 164.9° |
| N2 | C6 | C7 | H19 | 179.3° | 170.5° |
| C8 | C7 | C6 | H19 | 180.0° | 178.7° |
| C8 | C7 | C6 | C5 | 179.9° | 166.3° |
| C1 | N1 | C4 | C5 | 180.0° | 160.2° |
| C1 | N1 | C4 | C3 | 0.0° | 20.1° |
| N1 | C1 | C2 | C3 | 0.2° | 9.9° |
| N1 | C1 | C2 | H6 | 179.8° | 170.0° |
| N1 | C1 | C20 | H7 | 176.6° | 170.3° |
| C4 | N1 | C1 | C2 | 0.1° | 18.5° |
| N1 | C4 | C5 | C6 | 7.8° | 5.6° |
| N1 | C4 | C5 | C3 | 179.9° | 179.7° |
| N1 | C4 | C3 | C2 | 0.1° | 14.3° |
| N1 | C4 | C5 | C21 | 173.5° | 175.1° |
| N1 | C4 | C3 | H15 | 179.9° | 166.4° |
| C1 | C2 | C3 | C4 | 0.2° | 2.6° |
| C1 | C2 | C3 | H6 | 180.0° | 179.9° |
| C2 | C1 | C20 | H7 | 3.1° | 6.0° |
| C1 | C2 | C3 | H15 | 179.8° | 178.1° |
| C7 | C6 | C5 | C4 | 177.6° | 169.0° |
| C7 | C6 | C5 | C21 | 3.8° | 11.7° |
| C6 | C7 | C8 | H20 | 179.4° | 179.7° |
| C6 | C5 | C4 | C21 | 178.7° | 179.3° |
| C6 | C5 | C4 | C3 | 172.3° | 174.1° |
| C6 | C5 | C21 | C22 | 110.2° | 65.7° |
| C6 | C5 | C21 | C26 | 69.0° | 114.5° |
| C5 | C6 | C7 | H19 | 0.1° | 12.4° |
| C5 | C4 | C3 | C2 | 179.8° | 166.0° |
| C4 | C5 | C21 | C22 | 71.0° | 115.0° |
| C4 | C5 | C21 | C26 | 109.8° | 64.8° |
| C5 | C4 | C3 | H15 | 0.1° | 13.3° |
| C4 | C3 | C2 | H15 | 180.0° | 179.3° |
| C3 | C4 | C5 | C21 | 6.4° | 5.2° |
| C4 | C3 | C2 | H6 | 179.8° | 177.5° |
| C5 | C21 | C22 | C26 | 179.2° | 179.8° |
| C5 | C21 | C22 | C23 | 179.4° | 179.8° |
| C5 | C21 | C26 | C25 | 179.6° | 179.8° |
| C5 | C21 | C22 | H8 | 0.5° | 0.2° |
| C5 | C21 | C26 | H12 | 0.4° | 0.2° |
| C21 | C22 | C23 | H8 | 180.0° | 180.0° |
| C22 | C21 | C26 | C25 | 0.3° | 0.0° |
| C21 | C22 | C23 | C24 | 0.1° | 0.0° |
| C21 | C22 | C23 | H9 | 179.9° | 180.0° |
| C22 | C21 | C26 | H12 | 179.6° | 180.0° |
| C26 | C21 | C22 | C23 | 0.2° | 0.0° |
| C21 | C26 | C25 | H12 | 180.0° | 180.0° |
| C21 | C26 | C25 | C24 | 0.3° | 0.0° |
| C26 | C21 | C22 | H8 | 179.7° | 180.0° |
| C21 | C26 | C25 | H11 | 179.8° | 180.0° |
| C22 | C23 | C24 | H9 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.0° | 0.0° |
| C22 | C23 | C24 | H10 | 180.0° | 179.9° |
| C26 | C25 | C24 | C23 | 0.1° | 0.0° |
| C26 | C25 | C24 | H11 | 180.0° | 180.0° |
| C26 | C25 | C24 | H10 | 179.9° | 180.0° |
| C23 | C24 | C25 | H10 | 180.0° | 179.9° |
| C24 | C23 | C22 | H8 | 179.9° | 180.0° |
| C23 | C24 | C25 | H11 | 179.9° | 180.0° |
| C25 | C24 | C23 | H9 | 180.0° | 180.0° |
| C24 | C25 | C26 | H12 | 179.7° | 180.0° |
| H2 | C12 | C13 | H3 | 0.5° | 0.4° |
| H4 | C17 | C18 | H5 | 0.3° | 0.7° |
| H6 | C2 | C3 | H15 | 0.1° | 1.8° |
| H8 | C22 | C23 | H9 | 0.1° | 0.0° |
| H9 | C23 | C24 | H10 | 0.0° | 0.1° |
| H10 | C24 | C25 | H11 | 0.1° | 0.1° |
| H11 | C25 | C26 | H12 | 0.3° | 0.0° |
| H13 | C28 | C29 | H14 | 0.9° | 0.1° |
| H14 | C29 | C30 | H16 | 0.4° | 0.1° |
| H16 | C30 | C31 | H17 | 0.1° | 0.0° |
| H17 | C31 | C32 | H18 | 0.2° | 0.3° |
| H19 | C7 | C8 | H20 | 0.7° | 1.0° |
