A1BZS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C9 | C8 | sing | 1.53Å | 1.52Å | |
| C9 | N3 | sing | 1.47Å | 1.47Å | |
| C8 | N2 | sing | 1.46Å | 1.45Å | |
| N3 | C10 | sing | 1.47Å | 1.47Å | |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| N | C | sing | 1.35Å | 1.32Å | |
| N2 | C7 | sing | 1.38Å | 1.43Å | |
| C12 | C13 | sing | 1.53Å | 1.51Å | |
| N1 | C7 | doub | 1.31Å | 1.33Å | Aromatic |
| N1 | C5 | sing | 1.35Å | 1.38Å | Aromatic |
| C13 | N4 | sing | 1.47Å | 1.47Å | |
| C6 | C5 | doub | 1.40Å | 1.41Å | Aromatic |
| C6 | C1 | sing | 1.39Å | 1.37Å | Aromatic |
| C7 | C27 | sing | 1.46Å | 1.44Å | Aromatic |
| N4 | C14 | sing | 1.47Å | 1.47Å | |
| C | C1 | sing | 1.48Å | 1.50Å | |
| C | O | doub | 1.22Å | 1.25Å | |
| C5 | C4 | sing | 1.41Å | 1.41Å | Aromatic |
| C1 | C2 | doub | 1.40Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.51Å | 1.51Å | |
| C16 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C21 | sing | 1.39Å | 1.40Å | Aromatic |
| C17 | C18 | doub | 1.39Å | 1.40Å | Aromatic |
| C27 | C28 | doub | 1.40Å | 1.42Å | Aromatic |
| C27 | C31 | sing | 1.42Å | 1.42Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C31 | sing | 1.47Å | 1.43Å | Aromatic |
| C4 | C3 | doub | 1.40Å | 1.41Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.39Å | Aromatic |
| C18 | C21 | sing | 1.48Å | 1.49Å | |
| C28 | C29 | sing | 1.37Å | 1.36Å | Aromatic |
| C19 | CL | sing | 1.74Å | 1.73Å | |
| C2 | C3 | sing | 1.36Å | 1.36Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
| C31 | C30 | doub | 1.39Å | 1.41Å | Aromatic |
| C24 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | N5 | doub | 1.32Å | 1.34Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C30 | N5 | sing | 1.32Å | 1.34Å | Aromatic |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C14 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C26 | H9 | sing | 1.08Å | 1.08Å | |
| C25 | H10 | sing | 1.08Å | 1.08Å | |
| C24 | H11 | sing | 1.08Å | 1.08Å | |
| C23 | H12 | sing | 1.08Å | 1.08Å | |
| C22 | H13 | sing | 1.08Å | 1.08Å | |
| C17 | H14 | sing | 1.08Å | 1.08Å | |
| C20 | H15 | sing | 1.08Å | 1.08Å | |
| N4 | H16 | sing | 1.01Å | 1.00Å | |
| C13 | H18 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H20 | sing | 1.09Å | 1.10Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C11 | H23 | sing | 1.09Å | 1.10Å | |
| C10 | H24 | sing | 1.09Å | 1.10Å | |
| C10 | H25 | sing | 1.09Å | 1.10Å | |
| N3 | H26 | sing | 1.01Å | 1.00Å | |
| C9 | H28 | sing | 1.09Å | 1.10Å | |
| C9 | H29 | sing | 1.09Å | 1.10Å | |
| N2 | H30 | sing | 0.97Å | 1.00Å | |
| C30 | H31 | sing | 1.08Å | 1.08Å | |
| C29 | H32 | sing | 1.08Å | 1.08Å | |
| C28 | H33 | sing | 1.08Å | 1.08Å | |
| N | H34 | sing | 0.97Å | 1.00Å | |
| N | H35 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C8 | C9 | N3 | 112.0° | 109.5° |
| C9 | C8 | N2 | 110.8° | 109.5° |
| C9 | C8 | H7 | 109.1° | 109.5° |
| C9 | C8 | H8 | 109.2° | 109.5° |
| C8 | C9 | H28 | 108.8° | 109.5° |
| C8 | C9 | H29 | 108.8° | 109.5° |
| C9 | N3 | C10 | 112.4° | 111.0° |
| C9 | N3 | H26 | 108.7° | 111.0° |
| N3 | C9 | H28 | 108.8° | 109.5° |
| N3 | C9 | H29 | 108.8° | 109.4° |
| C8 | N2 | C7 | 123.8° | 120.0° |
| N2 | C8 | H7 | 109.2° | 109.4° |
| N2 | C8 | H8 | 109.1° | 109.5° |
| C8 | N2 | H30 | 105.8° | 120.0° |
| N3 | C10 | C11 | 113.1° | 109.4° |
| N3 | C10 | H24 | 108.6° | 109.5° |
| N3 | C10 | H25 | 108.5° | 109.5° |
| C10 | N3 | H26 | 108.8° | 111.0° |
| C10 | C11 | C12 | 110.6° | 109.5° |
| C10 | C11 | H22 | 109.2° | 109.5° |
| C10 | C11 | H23 | 109.2° | 109.5° |
| C11 | C10 | H24 | 108.6° | 109.5° |
| C11 | C10 | H25 | 108.6° | 109.5° |
| C11 | C12 | C13 | 111.9° | 109.5° |
| C11 | C12 | H20 | 108.8° | 109.4° |
| C11 | C12 | H21 | 108.9° | 109.5° |
| C12 | C11 | H22 | 109.2° | 109.4° |
| C12 | C11 | H23 | 109.2° | 109.5° |
| N | C | C1 | 118.3° | 120.0° |
| N | C | O | 122.4° | 120.0° |
| C | N | H34 | 120.0° | 120.0° |
| C | N | H35 | 120.0° | 120.0° |
| N2 | C7 | N1 | 118.8° | 119.7° |
| N2 | C7 | C27 | 118.5° | 119.7° |
| C7 | N2 | H30 | 105.8° | 120.0° |
| C12 | C13 | N4 | 113.1° | 109.5° |
| C12 | C13 | H18 | 108.6° | 109.5° |
| C12 | C13 | H19 | 108.5° | 109.5° |
| C13 | C12 | H20 | 108.8° | 109.5° |
| C13 | C12 | H21 | 108.8° | 109.5° |
| C7 | N1 | C5 | 119.2° | 123.4° |
| N1 | C7 | C27 | 122.8° | 120.6° |
| N1 | C5 | C6 | 117.5° | 120.0° |
| N1 | C5 | C4 | 123.0° | 121.1° |
| C13 | N4 | C14 | 112.2° | 111.0° |
| C13 | N4 | H16 | 108.8° | 111.0° |
| N4 | C13 | H18 | 108.6° | 109.5° |
| N4 | C13 | H19 | 108.6° | 109.4° |
| C5 | C6 | C1 | 120.8° | 119.8° |
| C6 | C5 | C4 | 119.6° | 118.9° |
| C5 | C6 | H3 | 119.6° | 120.0° |
| C6 | C1 | C | 121.5° | 119.8° |
| C6 | C1 | C2 | 119.5° | 120.5° |
| C1 | C6 | H3 | 119.6° | 120.2° |
| C7 | C27 | C28 | 124.5° | 122.9° |
| C7 | C27 | C31 | 117.5° | 118.7° |
| N4 | C14 | C15 | 114.2° | 109.5° |
| N4 | C14 | H4 | 108.3° | 109.5° |
| N4 | C14 | H5 | 108.3° | 109.6° |
| C14 | N4 | H16 | 108.8° | 111.0° |
| C1 | C | O | 119.2° | 120.0° |
| C | C1 | C2 | 118.9° | 119.8° |
| C5 | C4 | C31 | 117.8° | 118.5° |
| C5 | C4 | C3 | 117.9° | 120.3° |
| C1 | C2 | C3 | 120.8° | 120.4° |
| C1 | C2 | H1 | 119.6° | 119.8° |
| C14 | C15 | C16 | 120.9° | 119.8° |
| C14 | C15 | C20 | 120.9° | 119.9° |
| C15 | C14 | H4 | 108.3° | 109.4° |
| C15 | C14 | H5 | 108.3° | 109.4° |
| C15 | C16 | C17 | 121.2° | 120.1° |
| C16 | C15 | C20 | 118.1° | 120.3° |
| C15 | C16 | H6 | 119.4° | 120.0° |
| C16 | C17 | C18 | 120.7° | 119.9° |
| C17 | C16 | H6 | 119.4° | 119.9° |
| C16 | C17 | H14 | 119.6° | 120.1° |
| C15 | C20 | C19 | 120.3° | 120.1° |
| C15 | C20 | H15 | 119.8° | 119.9° |
| C25 | C26 | C21 | 120.7° | 119.9° |
| C26 | C25 | C24 | 120.2° | 120.1° |
| C25 | C26 | H9 | 119.7° | 120.0° |
| C26 | C25 | H10 | 119.9° | 120.0° |
| C26 | C21 | C18 | 120.9° | 120.1° |
| C26 | C21 | C22 | 118.4° | 119.8° |
| C21 | C26 | H9 | 119.7° | 120.1° |
| C17 | C18 | C19 | 117.5° | 119.8° |
| C17 | C18 | C21 | 120.7° | 120.1° |
| C18 | C17 | H14 | 119.6° | 120.0° |
| C28 | C27 | C31 | 118.1° | 118.3° |
| C27 | C28 | C29 | 119.2° | 118.5° |
| C27 | C28 | H33 | 120.4° | 120.7° |
| C27 | C31 | C4 | 119.7° | 117.7° |
| C27 | C31 | C30 | 116.8° | 119.0° |
| C25 | C24 | C23 | 119.8° | 120.2° |
| C24 | C25 | H10 | 119.9° | 120.0° |
| C25 | C24 | H11 | 120.1° | 119.9° |
| C20 | C19 | C18 | 121.9° | 119.8° |
| C20 | C19 | CL | 118.8° | 120.1° |
| C19 | C20 | H15 | 119.8° | 120.0° |
| C31 | C4 | C3 | 124.3° | 121.2° |
| C4 | C31 | C30 | 123.5° | 123.3° |
| C4 | C3 | C2 | 121.4° | 120.2° |
| C4 | C3 | H2 | 119.3° | 119.9° |
| C19 | C18 | C21 | 121.7° | 120.1° |
| C18 | C19 | CL | 118.9° | 120.1° |
| C18 | C21 | C22 | 120.7° | 120.1° |
| C28 | C29 | N5 | 124.1° | 121.8° |
| C28 | C29 | H32 | 117.9° | 119.1° |
| C29 | C28 | H33 | 120.4° | 120.7° |
| C3 | C2 | H1 | 119.6° | 119.7° |
| C2 | C3 | H2 | 119.3° | 119.9° |
| C21 | C22 | C23 | 120.7° | 119.9° |
| C21 | C22 | H13 | 119.6° | 120.1° |
| C31 | C30 | N5 | 124.2° | 119.7° |
| C31 | C30 | H31 | 117.9° | 120.2° |
| C24 | C23 | C22 | 120.2° | 120.1° |
| C23 | C24 | H11 | 120.1° | 119.9° |
| C24 | C23 | H12 | 119.9° | 119.9° |
| C29 | N5 | C30 | 117.6° | 122.6° |
| N5 | C29 | H32 | 117.9° | 119.1° |
| C22 | C23 | H12 | 119.9° | 120.0° |
| C23 | C22 | H13 | 119.7° | 120.1° |
| N5 | C30 | H31 | 117.9° | 120.1° |
| H4 | C14 | H5 | 109.4° | 109.4° |
| H7 | C8 | H8 | 109.5° | 109.5° |
| H18 | C13 | H19 | 109.5° | 109.5° |
| H20 | C12 | H21 | 109.5° | 109.4° |
| H22 | C11 | H23 | 109.4° | 109.5° |
| H24 | C10 | H25 | 109.5° | 109.5° |
| H28 | C9 | H29 | 109.5° | 109.5° |
| H34 | N | H35 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C8 | C9 | N3 | H28 | 120.4° | 120.0° |
| C8 | C9 | N3 | H29 | 120.4° | 120.0° |
| C9 | C8 | N2 | H7 | 120.2° | 120.0° |
| C9 | C8 | N2 | H8 | 120.2° | 120.0° |
| C8 | C9 | N3 | C10 | 167.3° | 180.0° |
| C9 | C8 | N2 | C7 | 77.3° | 180.0° |
| C9 | C8 | H7 | H8 | 119.4° | 120.0° |
| C8 | C9 | N3 | H26 | 72.3° | 56.0° |
| C8 | C9 | H28 | H29 | 118.8° | 120.0° |
| C9 | C8 | N2 | H30 | 44.7° | 0.0° |
| N3 | C9 | C8 | N2 | 63.5° | 180.0° |
| C9 | N3 | C10 | H26 | 120.4° | 123.9° |
| C9 | N3 | C10 | C11 | 175.1° | 180.0° |
| N3 | C9 | C8 | H7 | 56.7° | 60.0° |
| N3 | C9 | C8 | H8 | 176.3° | 60.0° |
| C9 | N3 | C10 | H24 | 64.4° | 60.0° |
| C9 | N3 | C10 | H25 | 54.5° | 60.0° |
| N3 | C9 | H28 | H29 | 118.8° | 120.0° |
| C8 | N2 | C7 | H30 | 121.9° | 180.0° |
| C8 | N2 | C7 | N1 | 3.4° | 0.0° |
| C8 | N2 | C7 | C27 | 175.4° | 180.0° |
| N2 | C8 | H7 | H8 | 119.4° | 120.0° |
| N2 | C8 | C9 | H28 | 56.8° | 60.0° |
| N2 | C8 | C9 | H29 | 176.1° | 60.0° |
| N3 | C10 | C11 | H24 | 120.6° | 120.0° |
| N3 | C10 | C11 | H25 | 120.5° | 120.0° |
| N3 | C10 | C11 | C12 | 173.4° | 180.0° |
| N3 | C10 | C11 | H22 | 66.4° | 60.0° |
| N3 | C10 | C11 | H23 | 53.3° | 60.0° |
| N3 | C10 | H24 | H25 | 118.3° | 120.0° |
| C10 | N3 | C9 | H28 | 46.9° | 60.0° |
| C10 | N3 | C9 | H29 | 72.3° | 60.0° |
| C10 | C11 | C12 | H22 | 120.2° | 120.0° |
| C10 | C11 | C12 | H23 | 120.2° | 120.0° |
| C10 | C11 | C12 | C13 | 165.2° | 180.0° |
| C10 | C11 | C12 | H20 | 44.9° | 59.9° |
| C10 | C11 | C12 | H21 | 74.4° | 60.0° |
| C10 | C11 | H22 | H23 | 119.5° | 120.0° |
| C11 | C10 | H24 | H25 | 118.3° | 120.0° |
| C11 | C10 | N3 | H26 | 54.6° | 56.1° |
| C11 | C12 | C13 | H20 | 120.3° | 120.0° |
| C11 | C12 | C13 | H21 | 120.4° | 120.0° |
| C11 | C12 | C13 | N4 | 171.0° | 180.0° |
| C11 | C12 | C13 | H18 | 50.5° | 60.0° |
| C11 | C12 | C13 | H19 | 68.4° | 60.0° |
| C11 | C12 | H20 | H21 | 118.9° | 119.9° |
| C12 | C11 | H22 | H23 | 119.4° | 120.0° |
| C12 | C11 | C10 | H24 | 52.9° | 60.0° |
| C12 | C11 | C10 | H25 | 66.0° | 60.0° |
| N | C | C1 | C6 | 31.1° | 179.7° |
| N | C | C1 | O | 176.3° | 180.0° |
| N | C | C1 | C2 | 152.9° | 0.0° |
| C | N | H34 | H35 | 180.0° | 180.0° |
| N2 | C7 | N1 | C27 | 178.7° | 180.0° |
| N2 | C7 | N1 | C5 | 176.0° | 179.9° |
| N2 | C7 | C27 | C28 | 6.7° | 0.0° |
| N2 | C7 | C27 | C31 | 173.7° | 180.0° |
| C7 | N2 | C8 | H7 | 162.5° | 60.0° |
| C7 | N2 | C8 | H8 | 42.9° | 60.0° |
| C12 | C13 | N4 | H18 | 120.6° | 120.0° |
| C12 | C13 | N4 | H19 | 120.5° | 120.0° |
| C12 | C13 | N4 | C14 | 167.8° | 180.0° |
| C12 | C13 | N4 | H16 | 47.4° | 56.1° |
| C12 | C13 | H18 | H19 | 118.3° | 120.0° |
| C13 | C12 | H20 | H21 | 118.9° | 120.0° |
| C13 | C12 | C11 | H22 | 74.6° | 60.0° |
| C13 | C12 | C11 | H23 | 45.0° | 60.0° |
| C7 | N1 | C5 | C6 | 179.6° | 179.9° |
| C7 | N1 | C5 | C4 | 1.0° | 0.0° |
| N1 | C7 | C27 | C28 | 174.6° | 180.0° |
| N1 | C7 | C27 | C31 | 5.1° | 0.0° |
| N1 | C7 | N2 | H30 | 125.3° | 180.0° |
| N1 | C5 | C6 | C4 | 179.4° | 180.0° |
| N1 | C5 | C6 | C1 | 176.9° | 180.0° |
| C5 | N1 | C7 | C27 | 2.7° | 0.1° |
| N1 | C5 | C4 | C31 | 2.1° | 0.0° |
| N1 | C5 | C4 | C3 | 177.9° | 180.0° |
| N1 | C5 | C6 | H3 | 3.1° | 0.0° |
| C13 | N4 | C14 | H16 | 120.4° | 124.0° |
| C13 | N4 | C14 | C15 | 179.9° | 180.0° |
| C13 | N4 | C14 | H4 | 59.4° | 60.0° |
| C13 | N4 | C14 | H5 | 59.2° | 60.0° |
| N4 | C13 | H18 | H19 | 118.3° | 120.0° |
| N4 | C13 | C12 | H20 | 68.6° | 60.0° |
| N4 | C13 | C12 | H21 | 50.7° | 60.0° |
| C5 | C6 | C1 | H3 | 180.0° | 179.9° |
| C5 | C6 | C1 | C | 174.3° | 179.7° |
| C5 | C6 | C1 | C2 | 1.7° | 0.1° |
| C6 | C5 | C4 | C31 | 178.5° | 180.0° |
| C6 | C5 | C4 | C3 | 1.5° | 0.0° |
| C6 | C1 | C | C2 | 176.0° | 179.7° |
| C6 | C1 | C | O | 145.2° | 0.3° |
| C1 | C6 | C5 | C4 | 2.6° | 0.0° |
| C6 | C1 | C2 | C3 | 0.2° | 0.0° |
| C6 | C1 | C2 | H1 | 179.8° | 180.0° |
| C7 | C27 | C28 | C31 | 179.7° | 180.0° |
| C7 | C27 | C31 | C4 | 3.7° | 0.0° |
| C7 | C27 | C28 | C29 | 177.7° | 180.0° |
| C7 | C27 | C31 | C30 | 177.0° | 180.0° |
| C27 | C7 | N2 | H30 | 53.5° | 0.0° |
| C7 | C27 | C28 | H33 | 2.3° | 0.0° |
| N4 | C14 | C15 | H4 | 120.7° | 120.0° |
| N4 | C14 | C15 | H5 | 120.7° | 120.1° |
| N4 | C14 | C15 | C16 | 124.7° | 89.7° |
| N4 | C14 | C15 | C20 | 58.6° | 90.0° |
| N4 | C14 | H4 | H5 | 117.8° | 120.1° |
| C14 | N4 | C13 | H18 | 71.6° | 60.0° |
| C14 | N4 | C13 | H19 | 47.3° | 60.0° |
| C | C1 | C2 | C3 | 176.3° | 179.7° |
| C | C1 | C2 | H1 | 3.7° | 0.3° |
| C | C1 | C6 | H3 | 5.7° | 0.3° |
| C1 | C | N | H34 | 176.2° | 0.0° |
| C1 | C | N | H35 | 3.8° | 180.0° |
| O | C | C1 | C2 | 30.8° | 180.0° |
| O | C | N | H34 | 0.0° | 180.0° |
| O | C | N | H35 | 180.0° | 0.0° |
| C5 | C4 | C31 | C27 | 0.4° | 0.0° |
| C5 | C4 | C31 | C3 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.4° | 0.1° |
| C5 | C4 | C31 | C30 | 179.6° | 180.0° |
| C5 | C4 | C3 | H2 | 179.6° | 180.0° |
| C4 | C5 | C6 | H3 | 177.5° | 180.0° |
| C1 | C2 | C3 | C4 | 1.3° | 0.1° |
| C1 | C2 | C3 | H1 | 180.0° | 180.0° |
| C1 | C2 | C3 | H2 | 178.7° | 180.0° |
| C2 | C1 | C6 | H3 | 178.3° | 180.0° |
| C14 | C15 | C16 | C20 | 176.8° | 179.7° |
| C14 | C15 | C16 | C17 | 173.8° | 179.9° |
| C14 | C15 | C20 | C19 | 176.1° | 180.0° |
| C15 | C14 | H4 | H5 | 117.8° | 119.9° |
| C14 | C15 | C16 | H6 | 6.2° | 0.1° |
| C14 | C15 | C20 | H15 | 3.9° | 0.0° |
| C15 | C14 | N4 | H16 | 59.5° | 56.0° |
| C15 | C16 | C17 | H6 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 1.7° | 0.0° |
| C16 | C15 | C20 | C19 | 0.7° | 0.3° |
| C16 | C15 | C14 | H4 | 4.0° | 30.3° |
| C16 | C15 | C14 | H5 | 114.6° | 150.2° |
| C15 | C16 | C17 | H14 | 178.3° | 180.0° |
| C16 | C15 | C20 | H15 | 179.3° | 179.7° |
| C17 | C16 | C15 | C20 | 3.0° | 0.3° |
| C16 | C17 | C18 | H14 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 1.9° | 0.3° |
| C16 | C17 | C18 | C21 | 177.2° | 179.8° |
| C15 | C20 | C19 | H15 | 180.0° | 180.0° |
| C15 | C20 | C19 | C18 | 3.0° | 0.0° |
| C15 | C20 | C19 | CL | 170.3° | 179.8° |
| C20 | C15 | C14 | H4 | 179.3° | 150.0° |
| C20 | C15 | C14 | H5 | 62.1° | 30.1° |
| C20 | C15 | C16 | H6 | 177.0° | 179.7° |
| C25 | C26 | C21 | H9 | 180.0° | 180.0° |
| C26 | C25 | C24 | H10 | 180.0° | 179.9° |
| C25 | C26 | C21 | C18 | 178.8° | 180.0° |
| C25 | C26 | C21 | C22 | 0.1° | 0.2° |
| C26 | C25 | C24 | C23 | 0.2° | 0.0° |
| C26 | C25 | C24 | H11 | 179.8° | 180.0° |
| C26 | C21 | C18 | C17 | 88.3° | 130.3° |
| C21 | C26 | C25 | C24 | 0.2° | 0.0° |
| C26 | C21 | C18 | C19 | 92.7° | 49.7° |
| C26 | C21 | C18 | C22 | 178.6° | 179.7° |
| C26 | C21 | C22 | C23 | 0.2° | 0.6° |
| C21 | C26 | C25 | H10 | 179.9° | 179.9° |
| C26 | C21 | C22 | H13 | 179.7° | 179.7° |
| C17 | C18 | C19 | C20 | 4.3° | 0.3° |
| C17 | C18 | C19 | C21 | 179.0° | 180.0° |
| C17 | C18 | C19 | CL | 169.1° | 179.9° |
| C17 | C18 | C21 | C22 | 93.1° | 50.0° |
| C18 | C17 | C16 | H6 | 178.3° | 180.0° |
| C28 | C27 | C31 | C4 | 175.9° | 180.0° |
| C27 | C28 | C29 | H33 | 180.0° | 180.0° |
| C28 | C27 | C31 | C30 | 3.3° | 0.0° |
| C27 | C28 | C29 | N5 | 0.1° | 0.0° |
| C27 | C28 | C29 | H32 | 179.9° | 180.0° |
| C27 | C31 | C4 | C30 | 179.2° | 179.9° |
| C27 | C31 | C4 | C3 | 179.6° | 180.0° |
| C31 | C27 | C28 | C29 | 2.7° | 0.0° |
| C27 | C31 | C30 | N5 | 1.5° | 0.0° |
| C27 | C31 | C30 | H31 | 178.5° | 180.0° |
| C31 | C27 | C28 | H33 | 177.3° | 180.0° |
| C25 | C24 | C23 | H11 | 180.0° | 179.9° |
| C25 | C24 | C23 | C22 | 0.6° | 0.3° |
| C24 | C25 | C26 | H9 | 179.8° | 180.0° |
| C25 | C24 | C23 | H12 | 179.4° | 180.0° |
| C20 | C19 | C18 | CL | 173.4° | 179.8° |
| C20 | C19 | C18 | C21 | 174.8° | 179.8° |
| C31 | C4 | C3 | C2 | 179.6° | 180.0° |
| C4 | C31 | C30 | N5 | 177.8° | 180.0° |
| C31 | C4 | C3 | H2 | 0.4° | 0.0° |
| C4 | C31 | C30 | H31 | 2.3° | 0.0° |
| C4 | C3 | C2 | H2 | 180.0° | 179.9° |
| C3 | C4 | C31 | C30 | 0.4° | 0.1° |
| C4 | C3 | C2 | H1 | 178.7° | 179.9° |
| C19 | C18 | C21 | C22 | 85.9° | 130.0° |
| C19 | C18 | C17 | H14 | 178.1° | 179.8° |
| C18 | C19 | C20 | H15 | 177.0° | 180.0° |
| C21 | C18 | C19 | CL | 11.9° | 0.0° |
| C18 | C21 | C22 | C23 | 178.4° | 179.7° |
| C18 | C21 | C26 | H9 | 1.2° | 0.1° |
| C18 | C21 | C22 | H13 | 1.6° | 0.0° |
| C21 | C18 | C17 | H14 | 2.8° | 0.2° |
| C28 | C29 | N5 | H32 | 180.0° | 179.9° |
| C28 | C29 | N5 | C30 | 2.1° | 0.0° |
| CL | C19 | C20 | H15 | 9.6° | 0.2° |
| C21 | C22 | C23 | C24 | 0.6° | 0.6° |
| C21 | C22 | C23 | H13 | 180.0° | 179.8° |
| C22 | C21 | C26 | H9 | 179.9° | 179.8° |
| C21 | C22 | C23 | H12 | 179.4° | 179.7° |
| C31 | C30 | N5 | C29 | 1.2° | 0.0° |
| C31 | C30 | N5 | H31 | 180.0° | 180.0° |
| C24 | C23 | C22 | H12 | 180.0° | 179.7° |
| C23 | C24 | C25 | H10 | 179.8° | 179.9° |
| C24 | C23 | C22 | H13 | 179.4° | 179.6° |
| C29 | N5 | C30 | H31 | 178.8° | 179.9° |
| N5 | C29 | C28 | H33 | 179.9° | 180.0° |
| C22 | C23 | C24 | H11 | 179.4° | 179.7° |
| C30 | N5 | C29 | H32 | 177.9° | 180.0° |
| H1 | C2 | C3 | H2 | 1.3° | 0.0° |
| H4 | C14 | N4 | H16 | 179.8° | 63.9° |
| H5 | C14 | N4 | H16 | 61.2° | 176.0° |
| H6 | C16 | C17 | H14 | 1.7° | 0.0° |
| H7 | C8 | C9 | H28 | 177.1° | 60.0° |
| H7 | C8 | C9 | H29 | 63.7° | 180.0° |
| H7 | C8 | N2 | H30 | 75.5° | 120.0° |
| H8 | C8 | C9 | H28 | 63.4° | 180.0° |
| H8 | C8 | C9 | H29 | 55.9° | 60.0° |
| H8 | C8 | N2 | H30 | 164.9° | 120.0° |
| H9 | C26 | C25 | H10 | 0.2° | 0.0° |
| H10 | C25 | C24 | H11 | 0.2° | 0.0° |
| H11 | C24 | C23 | H12 | 0.6° | 0.1° |
| H12 | C23 | C22 | H13 | 0.6° | 0.0° |
| H16 | N4 | C13 | H18 | 168.0° | 64.0° |
| H16 | N4 | C13 | H19 | 73.1° | 176.0° |
| H18 | C13 | C12 | H20 | 170.8° | 180.0° |
| H18 | C13 | C12 | H21 | 69.9° | 60.0° |
| H19 | C13 | C12 | H20 | 51.9° | 60.0° |
| H19 | C13 | C12 | H21 | 171.2° | 180.0° |
| H20 | C12 | C11 | H22 | 165.1° | 179.9° |
| H20 | C12 | C11 | H23 | 75.3° | 60.1° |
| H21 | C12 | C11 | H22 | 45.8° | 60.0° |
| H21 | C12 | C11 | H23 | 165.4° | 180.0° |
| H22 | C11 | C10 | H24 | 173.1° | 180.0° |
| H22 | C11 | C10 | H25 | 54.2° | 60.0° |
| H23 | C11 | C10 | H24 | 67.3° | 60.0° |
| H23 | C11 | C10 | H25 | 173.8° | 180.0° |
| H24 | C10 | N3 | H26 | 175.2° | 63.9° |
| H25 | C10 | N3 | H26 | 65.9° | 176.0° |
| H26 | N3 | C9 | H28 | 167.3° | 176.0° |
| H26 | N3 | C9 | H29 | 48.1° | 64.0° |
| H32 | C29 | C28 | H33 | 0.1° | 0.0° |
