6H5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | C | doub | 1.21Å | 1.22Å | |
| C | O | sing | 1.34Å | 1.34Å | |
| C | C1 | sing | 1.51Å | 1.50Å | |
| N | C1 | sing | 1.47Å | 1.45Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | doub | 1.38Å | 1.41Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.51Å | 1.51Å | |
| C5 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| C3 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C28 | doub | 1.40Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.48Å | 1.52Å | |
| N2 | C8 | doub | 1.30Å | 1.33Å | |
| N1 | C8 | sing | 1.38Å | 1.27Å | |
| N1 | C7 | sing | 1.35Å | 1.35Å | |
| C8 | N3 | sing | 1.37Å | 1.34Å | |
| C7 | O3 | doub | 1.22Å | 1.22Å | |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| C26 | C27 | sing | 1.53Å | 1.53Å | |
| C25 | C24 | sing | 1.53Å | 1.51Å | |
| N3 | C9 | sing | 1.46Å | 1.45Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C27 | N4 | sing | 1.47Å | 1.46Å | |
| C9 | C10 | sing | 1.51Å | 1.53Å | |
| N4 | C23 | sing | 1.47Å | 1.46Å | |
| N4 | C22 | sing | 1.40Å | 1.40Å | |
| C10 | C22 | doub | 1.39Å | 1.48Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.48Å | Aromatic |
| C22 | C21 | sing | 1.39Å | 1.42Å | Aromatic |
| O1 | C11 | sing | 1.36Å | 1.36Å | |
| O1 | C12 | sing | 1.36Å | 1.37Å | |
| C11 | C19 | doub | 1.39Å | 1.39Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C18 | doub | 1.39Å | 1.38Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
| C14 | C16 | sing | 1.39Å | 1.38Å | Aromatic |
| C14 | O2 | sing | 1.36Å | 1.37Å | |
| C15 | O2 | sing | 1.43Å | 1.42Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N2 | H2 | sing | 0.97Å | 1.00Å | |
| C4 | H3 | sing | 1.08Å | 1.08Å | |
| C9 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.08Å | 1.08Å | |
| C13 | H7 | sing | 1.08Å | 1.08Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.08Å | 1.08Å | |
| C17 | H12 | sing | 1.08Å | 1.08Å | |
| C20 | H13 | sing | 1.08Å | 1.08Å | |
| C23 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C28 | H18 | sing | 1.08Å | 1.08Å | |
| C26 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.08Å | 1.08Å | |
| O | H24 | sing | 0.97Å | 0.95Å | |
| C1 | H25 | sing | 1.09Å | 1.10Å | |
| N | H26 | sing | 1.01Å | 1.00Å | |
| N | H27 | sing | 1.01Å | 1.00Å | |
| C2 | H29 | sing | 1.09Å | 1.10Å | |
| C2 | H30 | sing | 1.09Å | 1.10Å | |
| C29 | H31 | sing | 1.08Å | 1.08Å | |
| N3 | H32 | sing | 0.97Å | 1.00Å | |
| C27 | H33 | sing | 1.09Å | 1.10Å | |
| C27 | H34 | sing | 1.09Å | 1.10Å | |
| C21 | H35 | sing | 1.08Å | 1.08Å | |
| C19 | H36 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | C | O | 119.6° | 120.0° |
| O4 | C | C1 | 120.2° | 120.0° |
| O | C | C1 | 120.2° | 120.0° |
| C | O | H24 | 109.5° | 117.0° |
| C | C1 | N | 112.2° | 109.5° |
| C | C1 | C2 | 106.3° | 109.5° |
| C | C1 | H25 | 109.4° | 109.5° |
| N | C1 | C2 | 109.4° | 109.5° |
| N | C1 | H25 | 110.2° | 109.5° |
| C1 | N | H26 | 109.5° | 110.9° |
| C1 | N | H27 | 109.4° | 111.0° |
| C1 | C2 | C3 | 113.1° | 109.5° |
| C2 | C1 | H25 | 109.1° | 109.4° |
| C1 | C2 | H29 | 108.6° | 109.4° |
| C1 | C2 | H30 | 108.6° | 109.4° |
| C5 | C4 | C3 | 120.0° | 120.1° |
| C4 | C5 | C6 | 120.6° | 119.9° |
| C5 | C4 | H3 | 120.0° | 119.9° |
| C4 | C5 | H6 | 119.7° | 120.1° |
| C4 | C3 | C2 | 122.0° | 119.8° |
| C4 | C3 | C29 | 119.6° | 120.3° |
| C3 | C4 | H3 | 120.0° | 120.0° |
| C2 | C3 | C29 | 118.4° | 119.8° |
| C3 | C2 | H29 | 108.6° | 109.5° |
| C3 | C2 | H30 | 108.6° | 109.5° |
| C5 | C6 | C28 | 118.3° | 119.7° |
| C5 | C6 | C7 | 123.1° | 120.1° |
| C6 | C5 | H6 | 119.7° | 120.1° |
| C3 | C29 | C28 | 120.5° | 120.2° |
| C3 | C29 | H31 | 119.8° | 119.9° |
| C29 | C28 | C6 | 121.1° | 119.8° |
| C29 | C28 | H18 | 119.5° | 120.1° |
| C28 | C29 | H31 | 119.8° | 119.9° |
| C28 | C6 | C7 | 118.5° | 120.2° |
| C6 | C28 | H18 | 119.5° | 120.1° |
| C6 | C7 | N1 | 121.4° | 120.0° |
| C6 | C7 | O3 | 116.7° | 119.9° |
| N2 | C8 | N1 | 116.7° | 120.0° |
| N2 | C8 | N3 | 121.4° | 120.0° |
| C8 | N2 | H2 | 112.0° | 120.0° |
| C8 | N1 | C7 | 128.0° | 120.0° |
| N1 | C8 | N3 | 121.9° | 120.0° |
| C8 | N1 | H1 | 116.0° | 119.9° |
| N1 | C7 | O3 | 121.8° | 120.0° |
| C7 | N1 | H1 | 116.0° | 120.0° |
| C8 | N3 | C9 | 124.7° | 120.0° |
| C8 | N3 | H32 | 117.7° | 120.0° |
| C25 | C26 | C27 | 117.3° | 109.3° |
| C26 | C25 | C24 | 114.2° | 109.1° |
| C25 | C26 | H19 | 107.5° | 109.5° |
| C25 | C26 | H20 | 107.5° | 109.5° |
| C26 | C25 | H21 | 108.3° | 109.5° |
| C26 | C25 | H22 | 108.3° | 109.5° |
| C26 | C27 | N4 | 114.0° | 109.5° |
| C27 | C26 | H19 | 107.5° | 109.5° |
| C27 | C26 | H20 | 107.5° | 109.5° |
| C26 | C27 | H33 | 108.3° | 109.5° |
| C26 | C27 | H34 | 108.3° | 109.5° |
| C25 | C24 | C23 | 114.1° | 109.3° |
| C25 | C24 | H16 | 108.3° | 109.5° |
| C25 | C24 | H17 | 108.3° | 109.5° |
| C24 | C25 | H21 | 108.3° | 109.5° |
| C24 | C25 | H22 | 108.3° | 109.6° |
| N3 | C9 | C10 | 110.6° | 109.5° |
| N3 | C9 | H4 | 109.2° | 109.5° |
| N3 | C9 | H5 | 109.2° | 109.5° |
| C9 | N3 | H32 | 117.6° | 120.0° |
| C24 | C23 | N4 | 109.6° | 109.5° |
| C24 | C23 | H14 | 109.5° | 109.5° |
| C24 | C23 | H15 | 109.4° | 109.4° |
| C23 | C24 | H16 | 108.3° | 109.5° |
| C23 | C24 | H17 | 108.3° | 109.5° |
| C27 | N4 | C23 | 125.6° | 111.2° |
| C27 | N4 | C22 | 119.1° | 111.0° |
| N4 | C27 | H33 | 108.3° | 109.4° |
| N4 | C27 | H34 | 108.3° | 109.5° |
| C9 | C10 | C22 | 125.1° | 120.1° |
| C9 | C10 | C11 | 118.8° | 120.0° |
| C10 | C9 | H4 | 109.2° | 109.5° |
| C10 | C9 | H5 | 109.2° | 109.4° |
| C23 | N4 | C22 | 115.2° | 111.0° |
| N4 | C23 | H14 | 109.4° | 109.5° |
| N4 | C23 | H15 | 109.5° | 109.5° |
| N4 | C22 | C10 | 123.1° | 120.0° |
| N4 | C22 | C21 | 117.5° | 120.1° |
| C22 | C10 | C11 | 116.1° | 119.8° |
| C10 | C22 | C21 | 119.4° | 119.9° |
| C10 | C11 | O1 | 117.3° | 120.0° |
| C10 | C11 | C19 | 121.2° | 120.0° |
| C22 | C21 | C20 | 121.3° | 120.0° |
| C22 | C21 | H35 | 119.4° | 120.0° |
| C11 | O1 | C12 | 125.5° | 118.0° |
| O1 | C11 | C19 | 121.5° | 120.0° |
| O1 | C12 | C18 | 118.5° | 120.0° |
| O1 | C12 | C13 | 120.9° | 120.0° |
| C11 | C19 | C20 | 120.6° | 120.1° |
| C11 | C19 | H36 | 119.7° | 119.9° |
| C21 | C20 | C19 | 121.4° | 120.1° |
| C21 | C20 | H13 | 119.2° | 120.0° |
| C20 | C21 | H35 | 119.3° | 120.0° |
| C18 | C12 | C13 | 120.5° | 119.9° |
| C12 | C18 | C17 | 119.7° | 120.0° |
| C12 | C18 | H23 | 120.1° | 120.0° |
| C12 | C13 | C14 | 119.3° | 119.9° |
| C12 | C13 | H7 | 120.3° | 120.0° |
| C18 | C17 | C16 | 120.1° | 120.1° |
| C18 | C17 | H12 | 119.9° | 120.0° |
| C17 | C18 | H23 | 120.1° | 120.0° |
| C13 | C14 | C16 | 119.9° | 120.0° |
| C13 | C14 | O2 | 123.8° | 120.0° |
| C14 | C13 | H7 | 120.3° | 120.1° |
| C19 | C20 | H13 | 119.3° | 119.9° |
| C20 | C19 | H36 | 119.7° | 119.9° |
| C17 | C16 | C14 | 120.4° | 120.1° |
| C17 | C16 | H11 | 119.8° | 120.0° |
| C16 | C17 | H12 | 119.9° | 119.9° |
| C16 | C14 | O2 | 116.2° | 120.0° |
| C14 | C16 | H11 | 119.8° | 120.0° |
| C14 | O2 | C15 | 126.3° | 117.0° |
| O2 | C15 | H8 | 109.5° | 109.5° |
| O2 | C15 | H9 | 109.5° | 109.5° |
| O2 | C15 | H10 | 109.5° | 109.5° |
| H4 | C9 | H5 | 109.5° | 109.5° |
| H8 | C15 | H9 | 109.4° | 109.5° |
| H8 | C15 | H10 | 109.5° | 109.4° |
| H9 | C15 | H10 | 109.5° | 109.5° |
| H14 | C23 | H15 | 109.5° | 109.5° |
| H16 | C24 | H17 | 109.5° | 109.5° |
| H19 | C26 | H20 | 109.5° | 109.5° |
| H21 | C25 | H22 | 109.5° | 109.6° |
| H26 | N | H27 | 109.5° | 111.1° |
| H29 | C2 | H30 | 109.4° | 109.5° |
| H33 | C27 | H34 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | C | O | C1 | 178.1° | 180.0° |
| O4 | C | C1 | N | 4.7° | 20.0° |
| O4 | C | C1 | C2 | 115.0° | 100.0° |
| O4 | C | O | H24 | 0.0° | 0.0° |
| O4 | C | C1 | H25 | 127.3° | 140.0° |
| O | C | C1 | N | 177.2° | 160.0° |
| O | C | C1 | C2 | 63.1° | 80.0° |
| O | C | C1 | H25 | 54.6° | 40.0° |
| C | C1 | N | C2 | 117.8° | 120.0° |
| C | C1 | N | H25 | 122.2° | 120.0° |
| C | C1 | C2 | H25 | 117.9° | 120.0° |
| C | C1 | C2 | C3 | 176.8° | 175.0° |
| C1 | C | O | H24 | 178.1° | 180.0° |
| C | C1 | N | H26 | 180.0° | 64.0° |
| C | C1 | N | H27 | 60.0° | 60.0° |
| C | C1 | C2 | H29 | 62.6° | 55.0° |
| C | C1 | C2 | H30 | 56.2° | 65.0° |
| N | C1 | C2 | H25 | 120.6° | 120.0° |
| N | C1 | C2 | C3 | 61.8° | 65.0° |
| C1 | N | H26 | H27 | 120.0° | 123.9° |
| N | C1 | C2 | H29 | 58.8° | 175.0° |
| N | C1 | C2 | H30 | 177.7° | 55.0° |
| C1 | C2 | C3 | C4 | 71.3° | 90.3° |
| C1 | C2 | C3 | H29 | 120.6° | 120.0° |
| C1 | C2 | C3 | H30 | 120.6° | 120.0° |
| C1 | C2 | C3 | C29 | 110.3° | 90.0° |
| C2 | C1 | N | H26 | 62.2° | 176.0° |
| C2 | C1 | N | H27 | 177.8° | 60.0° |
| C1 | C2 | H29 | H30 | 118.3° | 120.0° |
| C5 | C4 | C3 | H3 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 179.0° | 179.7° |
| C4 | C5 | C6 | H6 | 180.0° | 179.9° |
| C5 | C4 | C3 | C29 | 0.6° | 0.0° |
| C4 | C5 | C6 | C28 | 0.1° | 0.0° |
| C4 | C5 | C6 | C7 | 178.6° | 180.0° |
| C4 | C3 | C2 | C29 | 178.4° | 179.7° |
| C3 | C4 | C5 | C6 | 0.4° | 0.0° |
| C4 | C3 | C29 | C28 | 0.5° | 0.0° |
| C3 | C4 | C5 | H6 | 179.6° | 180.0° |
| C4 | C3 | C2 | H29 | 168.2° | 29.7° |
| C4 | C3 | C2 | H30 | 49.3° | 149.7° |
| C4 | C3 | C29 | H31 | 179.5° | 180.0° |
| C2 | C3 | C29 | C28 | 178.9° | 179.7° |
| C2 | C3 | C4 | H3 | 1.0° | 0.3° |
| C3 | C2 | C1 | H25 | 58.9° | 55.0° |
| C3 | C2 | H29 | H30 | 118.3° | 120.1° |
| C2 | C3 | C29 | H31 | 1.1° | 0.3° |
| C5 | C6 | C28 | C29 | 0.0° | 0.0° |
| C5 | C6 | C28 | C7 | 178.7° | 180.0° |
| C5 | C6 | C7 | N1 | 4.1° | 0.0° |
| C5 | C6 | C7 | O3 | 179.8° | 180.0° |
| C6 | C5 | C4 | H3 | 179.6° | 180.0° |
| C5 | C6 | C28 | H18 | 180.0° | 180.0° |
| C3 | C29 | C28 | H31 | 180.0° | 180.0° |
| C3 | C29 | C28 | C6 | 0.2° | 0.0° |
| C29 | C3 | C4 | H3 | 179.4° | 180.0° |
| C3 | C29 | C28 | H18 | 179.8° | 180.0° |
| C29 | C3 | C2 | H29 | 10.2° | 150.1° |
| C29 | C3 | C2 | H30 | 129.1° | 30.0° |
| C29 | C28 | C6 | H18 | 180.0° | 180.0° |
| C29 | C28 | C6 | C7 | 178.7° | 180.0° |
| C28 | C6 | C7 | N1 | 174.6° | 180.0° |
| C28 | C6 | C7 | O3 | 1.1° | 0.0° |
| C28 | C6 | C5 | H6 | 179.9° | 180.0° |
| C6 | C28 | C29 | H31 | 179.8° | 180.0° |
| C6 | C7 | N1 | C8 | 170.5° | 180.0° |
| C6 | C7 | N1 | O3 | 175.5° | 180.0° |
| C6 | C7 | N1 | H1 | 9.5° | 0.3° |
| C7 | C6 | C5 | H6 | 1.4° | 0.0° |
| C7 | C6 | C28 | H18 | 1.3° | 0.0° |
| N2 | C8 | N1 | N3 | 179.1° | 180.0° |
| N2 | C8 | N1 | C7 | 179.8° | 0.0° |
| N2 | C8 | N3 | C9 | 1.9° | 0.0° |
| N2 | C8 | N1 | H1 | 0.2° | 179.7° |
| N2 | C8 | N3 | H32 | 178.1° | 180.0° |
| C8 | N1 | C7 | H1 | 180.0° | 179.7° |
| C8 | N1 | C7 | O3 | 14.0° | 0.0° |
| N1 | C8 | N3 | C9 | 177.2° | 180.0° |
| N1 | C8 | N2 | H2 | 179.1° | 180.0° |
| N1 | C8 | N3 | H32 | 2.8° | 0.0° |
| C7 | N1 | C8 | N3 | 0.7° | 180.0° |
| C8 | N3 | C9 | H32 | 180.0° | 180.0° |
| C8 | N3 | C9 | C10 | 92.2° | 180.0° |
| N3 | C8 | N1 | H1 | 179.4° | 0.3° |
| N3 | C8 | N2 | H2 | 0.0° | 0.0° |
| C8 | N3 | C9 | H4 | 27.9° | 60.0° |
| C8 | N3 | C9 | H5 | 147.6° | 60.0° |
| O3 | C7 | N1 | H1 | 166.0° | 179.7° |
| C25 | C26 | C27 | H19 | 121.1° | 119.9° |
| C25 | C26 | C27 | H20 | 121.1° | 120.0° |
| C26 | C25 | C24 | H21 | 120.7° | 119.9° |
| C26 | C25 | C24 | H22 | 120.7° | 119.9° |
| C26 | C25 | C24 | C23 | 49.6° | 57.6° |
| C25 | C26 | C27 | N4 | 24.6° | 59.2° |
| C26 | C25 | C24 | H16 | 71.1° | 177.6° |
| C26 | C25 | C24 | H17 | 170.3° | 62.3° |
| C25 | C26 | H19 | H20 | 116.5° | 120.1° |
| C26 | C25 | H21 | H22 | 117.8° | 120.2° |
| C25 | C26 | C27 | H33 | 145.2° | 60.8° |
| C25 | C26 | C27 | H34 | 96.1° | 179.2° |
| C27 | C26 | C25 | C24 | 10.8° | 57.6° |
| C26 | C27 | N4 | H33 | 120.6° | 120.0° |
| C26 | C27 | N4 | H34 | 120.7° | 120.0° |
| C26 | C27 | N4 | C23 | 24.7° | 61.7° |
| C26 | C27 | N4 | C22 | 150.9° | 174.2° |
| C27 | C26 | H19 | H20 | 116.5° | 120.1° |
| C27 | C26 | C25 | H21 | 131.5° | 62.2° |
| C27 | C26 | C25 | H22 | 109.9° | 177.6° |
| C26 | C27 | H33 | H34 | 118.0° | 120.0° |
| C25 | C24 | C23 | H16 | 120.7° | 120.0° |
| C25 | C24 | C23 | H17 | 120.7° | 120.0° |
| C25 | C24 | C23 | N4 | 49.4° | 59.2° |
| C25 | C24 | C23 | H14 | 169.4° | 179.2° |
| C25 | C24 | C23 | H15 | 70.7° | 60.8° |
| C25 | C24 | H16 | H17 | 117.9° | 120.1° |
| C24 | C25 | C26 | H19 | 131.9° | 177.6° |
| C24 | C25 | C26 | H20 | 110.3° | 62.4° |
| C24 | C25 | H21 | H22 | 117.8° | 120.2° |
| N3 | C9 | C10 | H4 | 120.1° | 120.0° |
| N3 | C9 | C10 | H5 | 120.2° | 120.0° |
| N3 | C9 | C10 | C22 | 101.9° | 90.0° |
| N3 | C9 | C10 | C11 | 78.5° | 90.3° |
| N3 | C9 | H4 | H5 | 119.5° | 120.0° |
| C24 | C23 | N4 | C27 | 11.8° | 61.7° |
| C24 | C23 | N4 | H14 | 120.0° | 120.0° |
| C24 | C23 | N4 | H15 | 120.0° | 119.9° |
| C24 | C23 | N4 | C22 | 172.4° | 174.2° |
| C24 | C23 | H14 | H15 | 119.9° | 119.9° |
| C23 | C24 | H16 | H17 | 117.9° | 120.0° |
| C23 | C24 | C25 | H21 | 170.2° | 62.3° |
| C23 | C24 | C25 | H22 | 71.2° | 177.5° |
| C27 | N4 | C23 | C22 | 175.8° | 124.1° |
| C27 | N4 | C22 | C10 | 63.6° | 115.8° |
| C27 | N4 | C22 | C21 | 115.0° | 64.2° |
| C27 | N4 | C23 | H14 | 131.8° | 178.3° |
| C27 | N4 | C23 | H15 | 108.2° | 58.2° |
| N4 | C27 | C26 | H19 | 96.6° | 179.1° |
| N4 | C27 | C26 | H20 | 145.7° | 60.8° |
| N4 | C27 | H33 | H34 | 117.9° | 120.0° |
| C9 | C10 | C22 | N4 | 0.0° | 0.0° |
| C9 | C10 | C22 | C11 | 179.6° | 179.7° |
| C9 | C10 | C22 | C21 | 178.6° | 180.0° |
| C9 | C10 | C11 | O1 | 1.2° | 0.0° |
| C9 | C10 | C11 | C19 | 178.9° | 179.9° |
| C10 | C9 | H4 | H5 | 119.5° | 119.9° |
| C10 | C9 | N3 | H32 | 87.7° | 0.0° |
| C23 | N4 | C22 | C10 | 120.3° | 120.0° |
| C23 | N4 | C22 | C21 | 61.1° | 60.0° |
| N4 | C23 | H14 | H15 | 119.9° | 120.0° |
| N4 | C23 | C24 | H16 | 71.3° | 179.2° |
| N4 | C23 | C24 | H17 | 170.1° | 60.8° |
| C23 | N4 | C27 | H33 | 145.4° | 58.3° |
| C23 | N4 | C27 | H34 | 96.0° | 178.2° |
| N4 | C22 | C10 | C21 | 178.6° | 179.9° |
| N4 | C22 | C10 | C11 | 179.6° | 179.7° |
| N4 | C22 | C21 | C20 | 180.0° | 180.0° |
| C22 | N4 | C23 | H14 | 52.4° | 54.2° |
| C22 | N4 | C23 | H15 | 67.6° | 65.8° |
| C22 | N4 | C27 | H33 | 30.3° | 65.8° |
| C22 | N4 | C27 | H34 | 88.4° | 54.2° |
| N4 | C22 | C21 | H35 | 0.1° | 0.1° |
| C22 | C10 | C11 | O1 | 179.2° | 179.7° |
| C22 | C10 | C11 | C19 | 0.8° | 0.2° |
| C10 | C22 | C21 | C20 | 1.4° | 0.0° |
| C22 | C10 | C9 | H4 | 18.2° | 150.0° |
| C22 | C10 | C9 | H5 | 137.9° | 30.0° |
| C10 | C22 | C21 | H35 | 178.6° | 180.0° |
| C11 | C10 | C22 | C21 | 1.1° | 0.2° |
| C10 | C11 | O1 | C19 | 179.9° | 179.9° |
| C10 | C11 | O1 | C12 | 170.0° | 173.8° |
| C10 | C11 | C19 | C20 | 0.7° | 0.0° |
| C11 | C10 | C9 | H4 | 161.4° | 29.8° |
| C11 | C10 | C9 | H5 | 41.7° | 149.7° |
| C10 | C11 | C19 | H36 | 179.2° | 180.0° |
| C22 | C21 | C20 | H35 | 180.0° | 180.0° |
| C22 | C21 | C20 | C19 | 1.4° | 0.3° |
| C22 | C21 | C20 | H13 | 178.6° | 180.0° |
| C11 | O1 | C12 | C18 | 89.5° | 112.3° |
| C11 | O1 | C12 | C13 | 91.6° | 67.9° |
| O1 | C11 | C19 | C20 | 179.2° | 180.0° |
| O1 | C11 | C19 | H36 | 0.8° | 0.1° |
| C12 | O1 | C11 | C19 | 10.1° | 6.2° |
| O1 | C12 | C18 | C13 | 178.9° | 179.8° |
| O1 | C12 | C18 | C17 | 179.0° | 179.8° |
| O1 | C12 | C13 | C14 | 178.3° | 179.8° |
| O1 | C12 | C13 | H7 | 1.6° | 0.3° |
| O1 | C12 | C18 | H23 | 0.9° | 0.2° |
| C11 | C19 | C20 | C21 | 1.0° | 0.3° |
| C11 | C19 | C20 | H36 | 180.0° | 179.9° |
| C11 | C19 | C20 | H13 | 179.0° | 180.0° |
| C21 | C20 | C19 | H13 | 180.0° | 179.7° |
| C21 | C20 | C19 | H36 | 179.0° | 179.7° |
| C12 | C18 | C17 | H23 | 180.0° | 179.9° |
| C18 | C12 | C13 | C14 | 0.5° | 0.0° |
| C12 | C18 | C17 | C16 | 0.8° | 0.0° |
| C18 | C12 | C13 | H7 | 179.5° | 180.0° |
| C12 | C18 | C17 | H12 | 179.2° | 180.0° |
| C13 | C12 | C18 | C17 | 0.1° | 0.0° |
| C12 | C13 | C14 | H7 | 180.0° | 179.9° |
| C12 | C13 | C14 | C16 | 0.6° | 0.0° |
| C12 | C13 | C14 | O2 | 179.4° | 180.0° |
| C13 | C12 | C18 | H23 | 179.8° | 180.0° |
| C18 | C17 | C16 | H12 | 180.0° | 180.0° |
| C18 | C17 | C16 | C14 | 0.8° | 0.1° |
| C18 | C17 | C16 | H11 | 179.2° | 180.0° |
| C13 | C14 | C16 | C17 | 0.1° | 0.0° |
| C13 | C14 | C16 | O2 | 179.0° | 180.0° |
| C13 | C14 | O2 | C15 | 24.2° | 180.0° |
| C13 | C14 | C16 | H11 | 179.9° | 180.0° |
| C19 | C20 | C21 | H35 | 178.6° | 179.7° |
| C17 | C16 | C14 | H11 | 180.0° | 180.0° |
| C17 | C16 | C14 | O2 | 178.9° | 180.0° |
| C16 | C17 | C18 | H23 | 179.2° | 180.0° |
| C16 | C14 | O2 | C15 | 156.9° | 0.0° |
| C16 | C14 | C13 | H7 | 179.5° | 180.0° |
| C14 | C16 | C17 | H12 | 179.2° | 180.0° |
| O2 | C14 | C13 | H7 | 0.6° | 0.1° |
| C14 | O2 | C15 | H8 | 180.0° | 179.9° |
| C14 | O2 | C15 | H9 | 60.0° | 60.0° |
| C14 | O2 | C15 | H10 | 60.0° | 60.0° |
| O2 | C14 | C16 | H11 | 1.1° | 0.0° |
| O2 | C15 | H8 | H9 | 120.0° | 120.0° |
| O2 | C15 | H8 | H10 | 120.0° | 120.0° |
| O2 | C15 | H9 | H10 | 120.0° | 120.0° |
| H3 | C4 | C5 | H6 | 0.4° | 0.0° |
| H4 | C9 | N3 | H32 | 152.1° | 120.0° |
| H5 | C9 | N3 | H32 | 32.4° | 120.0° |
| H8 | C15 | H9 | H10 | 120.0° | 119.9° |
| H11 | C16 | C17 | H12 | 0.8° | 0.0° |
| H12 | C17 | C18 | H23 | 0.8° | 0.0° |
| H13 | C20 | C21 | H35 | 1.4° | 0.0° |
| H13 | C20 | C19 | H36 | 1.0° | 0.0° |
| H14 | C23 | C24 | H16 | 48.7° | 60.8° |
| H14 | C23 | C24 | H17 | 69.9° | 59.2° |
| H15 | C23 | C24 | H16 | 168.7° | 59.2° |
| H15 | C23 | C24 | H17 | 50.0° | 179.2° |
| H16 | C24 | C25 | H21 | 49.6° | 57.7° |
| H16 | C24 | C25 | H22 | 168.2° | 62.4° |
| H17 | C24 | C25 | H21 | 69.1° | 177.8° |
| H17 | C24 | C25 | H22 | 49.5° | 57.6° |
| H18 | C28 | C29 | H31 | 0.2° | 0.0° |
| H19 | C26 | C25 | H21 | 107.4° | 57.7° |
| H19 | C26 | C25 | H22 | 11.2° | 62.5° |
| H19 | C26 | C27 | H33 | 24.1° | 59.1° |
| H19 | C26 | C27 | H34 | 142.8° | 60.8° |
| H20 | C26 | C25 | H21 | 10.4° | 177.8° |
| H20 | C26 | C25 | H22 | 129.0° | 57.6° |
| H20 | C26 | C27 | H33 | 93.7° | 179.2° |
| H20 | C26 | C27 | H34 | 25.0° | 59.2° |
| H25 | C1 | N | H26 | 57.8° | 56.1° |
| H25 | C1 | N | H27 | 62.2° | 179.9° |
| H25 | C1 | C2 | H29 | 179.4° | 65.0° |
| H25 | C1 | C2 | H30 | 61.7° | 175.0° |
