57L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N2 | N1 | sing | 1.40Å | 1.37Å | Aromatic |
| N2 | C8 | doub | 1.30Å | 1.35Å | Aromatic |
| N1 | C7 | sing | 1.37Å | 1.39Å | Aromatic |
| C8 | C6 | sing | 1.46Å | 1.44Å | Aromatic |
| C7 | C6 | doub | 1.41Å | 1.42Å | Aromatic |
| C7 | C2 | sing | 1.40Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.40Å | 1.39Å | Aromatic |
| C1 | C2 | sing | 1.51Å | 1.48Å | |
| C2 | C3 | doub | 1.36Å | 1.38Å | Aromatic |
| C5 | C4 | doub | 1.39Å | 1.38Å | Aromatic |
| C3 | C4 | sing | 1.40Å | 1.41Å | Aromatic |
| C4 | C9 | sing | 1.48Å | 1.48Å | |
| C9 | O1 | doub | 1.22Å | 1.23Å | |
| C9 | N3 | sing | 1.35Å | 1.39Å | |
| C10 | N3 | sing | 1.47Å | 1.47Å | |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| N3 | C14 | sing | 1.47Å | 1.46Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| C11 | C12 | sing | 1.52Å | 1.53Å | |
| C15 | C12 | sing | 1.55Å | 1.54Å | |
| C15 | C16 | sing | 1.55Å | 1.54Å | |
| C13 | C12 | sing | 1.52Å | 1.52Å | |
| C12 | C17 | sing | 1.54Å | 1.55Å | |
| C16 | N4 | sing | 1.47Å | 1.47Å | |
| C24 | C21 | sing | 1.53Å | 1.53Å | |
| N4 | C17 | sing | 1.47Å | 1.48Å | |
| N4 | C19 | sing | 1.35Å | 1.38Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| O3 | C19 | sing | 1.35Å | 1.37Å | |
| O3 | C20 | sing | 1.45Å | 1.42Å | |
| C19 | O2 | doub | 1.22Å | 1.23Å | |
| C21 | C20 | sing | 1.53Å | 1.54Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C21 | C23 | sing | 1.53Å | 1.53Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.08Å | 1.08Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| C5 | H6 | sing | 1.08Å | 1.08Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H28 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C23 | H30 | sing | 1.09Å | 1.10Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| C24 | H32 | sing | 1.09Å | 1.10Å | |
| C24 | H34 | sing | 1.09Å | 1.10Å | |
| C24 | H33 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | N2 | C8 | 107.2° | 110.1° |
| N2 | N1 | C7 | 111.4° | 109.2° |
| N2 | N1 | H1 | 124.3° | 125.4° |
| N2 | C8 | C6 | 109.9° | 107.7° |
| N2 | C8 | H7 | 125.0° | 126.2° |
| N1 | C7 | C6 | 106.1° | 106.7° |
| N1 | C7 | C2 | 131.7° | 133.5° |
| C7 | N1 | H1 | 124.4° | 125.5° |
| C8 | C6 | C7 | 105.5° | 106.3° |
| C8 | C6 | C5 | 134.4° | 133.8° |
| C6 | C8 | H7 | 125.0° | 126.1° |
| C6 | C7 | C2 | 122.2° | 119.7° |
| C7 | C6 | C5 | 120.1° | 119.9° |
| C7 | C2 | C1 | 119.8° | 119.9° |
| C7 | C2 | C3 | 116.7° | 120.2° |
| C6 | C5 | C4 | 117.3° | 119.4° |
| C6 | C5 | H6 | 121.3° | 120.3° |
| C1 | C2 | C3 | 123.4° | 119.9° |
| C2 | C1 | H3 | 109.5° | 109.4° |
| C2 | C1 | H4 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.5° |
| C2 | C3 | C4 | 121.1° | 120.7° |
| C2 | C3 | H5 | 119.5° | 119.7° |
| C5 | C4 | C3 | 122.6° | 120.2° |
| C5 | C4 | C9 | 118.8° | 119.9° |
| C4 | C5 | H6 | 121.3° | 120.3° |
| C3 | C4 | C9 | 118.3° | 119.9° |
| C4 | C3 | H5 | 119.4° | 119.6° |
| C4 | C9 | O1 | 121.8° | 120.0° |
| C4 | C9 | N3 | 117.4° | 120.0° |
| O1 | C9 | N3 | 120.9° | 120.0° |
| C9 | N3 | C10 | 123.1° | 120.6° |
| C9 | N3 | C14 | 121.7° | 120.6° |
| N3 | C10 | C11 | 110.4° | 108.7° |
| C10 | N3 | C14 | 114.5° | 118.8° |
| N3 | C10 | H8 | 109.2° | 109.6° |
| N3 | C10 | H9 | 109.3° | 109.6° |
| C10 | C11 | C12 | 112.6° | 109.4° |
| C11 | C10 | H8 | 109.3° | 109.6° |
| C11 | C10 | H9 | 109.2° | 109.6° |
| C10 | C11 | H11 | 108.7° | 109.5° |
| C10 | C11 | H10 | 108.7° | 109.5° |
| N3 | C14 | C13 | 111.0° | 108.7° |
| N3 | C14 | H14 | 109.1° | 109.7° |
| N3 | C14 | H15 | 109.1° | 109.6° |
| C14 | C13 | C12 | 112.6° | 109.4° |
| C14 | C13 | H12 | 108.7° | 109.4° |
| C14 | C13 | H13 | 108.7° | 109.4° |
| C13 | C14 | H14 | 109.1° | 109.4° |
| C13 | C14 | H15 | 109.1° | 109.8° |
| C11 | C12 | C15 | 110.5° | 110.2° |
| C11 | C12 | C13 | 109.1° | 111.3° |
| C11 | C12 | C17 | 107.7° | 110.6° |
| C12 | C11 | H11 | 108.7° | 109.5° |
| C12 | C11 | H10 | 108.7° | 109.4° |
| C12 | C15 | C16 | 105.1° | 101.5° |
| C15 | C12 | C13 | 114.7° | 110.2° |
| C15 | C12 | C17 | 103.1° | 103.7° |
| C12 | C15 | H16 | 110.5° | 111.0° |
| C12 | C15 | H17 | 110.6° | 111.0° |
| C15 | C16 | N4 | 104.3° | 104.9° |
| C15 | C16 | H18 | 110.7° | 110.3° |
| C15 | C16 | H19 | 110.7° | 110.4° |
| C16 | C15 | H16 | 110.6° | 111.0° |
| C16 | C15 | H17 | 110.6° | 111.0° |
| C13 | C12 | C17 | 111.4° | 110.6° |
| C12 | C13 | H12 | 108.7° | 109.5° |
| C12 | C13 | H13 | 108.7° | 109.5° |
| C12 | C17 | N4 | 101.9° | 107.1° |
| C12 | C17 | C18 | 114.0° | 109.9° |
| C12 | C17 | H20 | 109.6° | 109.9° |
| C16 | N4 | C17 | 112.5° | 108.7° |
| C16 | N4 | C19 | 126.8° | 125.7° |
| N4 | C16 | H18 | 110.7° | 110.3° |
| N4 | C16 | H19 | 110.7° | 110.4° |
| C24 | C21 | C20 | 111.0° | 109.5° |
| C24 | C21 | C22 | 109.7° | 109.5° |
| C24 | C21 | C23 | 109.2° | 109.5° |
| C21 | C24 | H32 | 109.5° | 109.5° |
| C21 | C24 | H34 | 109.5° | 109.5° |
| C21 | C24 | H33 | 109.5° | 109.5° |
| C17 | N4 | C19 | 120.6° | 125.6° |
| N4 | C17 | C18 | 110.3° | 109.9° |
| N4 | C17 | H20 | 110.7° | 109.9° |
| N4 | C19 | O3 | 113.4° | 120.0° |
| N4 | C19 | O2 | 124.6° | 120.0° |
| C17 | C18 | H21 | 109.5° | 109.5° |
| C17 | C18 | H22 | 109.5° | 109.5° |
| C17 | C18 | H23 | 109.5° | 109.5° |
| C18 | C17 | H20 | 110.0° | 110.1° |
| C19 | O3 | C20 | 114.7° | 117.0° |
| O3 | C19 | O2 | 122.1° | 120.0° |
| O3 | C20 | C21 | 106.8° | 109.5° |
| O3 | C20 | H25 | 110.1° | 109.5° |
| O3 | C20 | H24 | 110.1° | 109.4° |
| C20 | C21 | C22 | 110.5° | 109.5° |
| C20 | C21 | C23 | 107.0° | 109.5° |
| C21 | C20 | H25 | 110.1° | 109.5° |
| C21 | C20 | H24 | 110.1° | 109.5° |
| C22 | C21 | C23 | 109.5° | 109.4° |
| C21 | C22 | H28 | 109.5° | 109.5° |
| C21 | C22 | H27 | 109.5° | 109.5° |
| C21 | C22 | H26 | 109.5° | 109.5° |
| C21 | C23 | H29 | 109.5° | 109.5° |
| C21 | C23 | H30 | 109.5° | 109.5° |
| C21 | C23 | H31 | 109.5° | 109.5° |
| H12 | C13 | H13 | 109.5° | 109.5° |
| H25 | C20 | H24 | 109.5° | 109.5° |
| H21 | C18 | H22 | 109.5° | 109.5° |
| H21 | C18 | H23 | 109.4° | 109.4° |
| H22 | C18 | H23 | 109.5° | 109.5° |
| H18 | C16 | H19 | 109.5° | 110.3° |
| H3 | C1 | H4 | 109.5° | 109.5° |
| H3 | C1 | H2 | 109.5° | 109.5° |
| H4 | C1 | H2 | 109.4° | 109.5° |
| H8 | C10 | H9 | 109.5° | 109.7° |
| H11 | C11 | H10 | 109.5° | 109.4° |
| H14 | C14 | H15 | 109.5° | 109.7° |
| H16 | C15 | H17 | 109.5° | 111.0° |
| H28 | C22 | H27 | 109.5° | 109.5° |
| H28 | C22 | H26 | 109.5° | 109.5° |
| H27 | C22 | H26 | 109.4° | 109.5° |
| H29 | C23 | H30 | 109.4° | 109.5° |
| H29 | C23 | H31 | 109.5° | 109.4° |
| H30 | C23 | H31 | 109.5° | 109.5° |
| H32 | C24 | H34 | 109.5° | 109.4° |
| H32 | C24 | H33 | 109.4° | 109.5° |
| H34 | C24 | H33 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | N1 | C7 | H1 | 180.0° | 179.9° |
| N1 | N2 | C8 | C6 | 0.2° | 0.1° |
| N2 | N1 | C7 | C6 | 0.5° | 0.0° |
| N2 | N1 | C7 | C2 | 176.9° | 180.0° |
| N1 | N2 | C8 | H7 | 179.8° | 180.0° |
| C8 | N2 | N1 | C7 | 0.4° | 0.1° |
| N2 | C8 | C6 | H7 | 180.0° | 179.9° |
| N2 | C8 | C6 | C7 | 0.1° | 0.0° |
| N2 | C8 | C6 | C5 | 177.3° | 179.8° |
| C8 | N2 | N1 | H1 | 179.6° | 180.0° |
| N1 | C7 | C6 | C8 | 0.4° | 0.0° |
| N1 | C7 | C6 | C2 | 177.7° | 180.0° |
| N1 | C7 | C6 | C5 | 178.0° | 179.8° |
| N1 | C7 | C2 | C1 | 1.3° | 0.0° |
| N1 | C7 | C2 | C3 | 176.3° | 179.8° |
| C8 | C6 | C7 | C5 | 177.7° | 179.8° |
| C8 | C6 | C7 | C2 | 177.4° | 180.0° |
| C8 | C6 | C5 | C4 | 175.7° | 179.7° |
| C8 | C6 | C5 | H6 | 4.3° | 0.3° |
| C6 | C7 | C2 | C1 | 178.4° | 180.0° |
| C6 | C7 | C2 | C3 | 0.8° | 0.2° |
| C7 | C6 | C5 | C4 | 1.1° | 0.0° |
| C7 | C6 | C8 | H7 | 179.9° | 180.0° |
| C7 | C6 | C5 | H6 | 178.9° | 180.0° |
| C6 | C7 | N1 | H1 | 179.5° | 180.0° |
| C2 | C7 | C6 | C5 | 0.3° | 0.2° |
| C7 | C2 | C1 | C3 | 177.4° | 179.8° |
| C7 | C2 | C3 | C4 | 1.0° | 0.1° |
| C7 | C2 | C1 | H3 | 91.2° | 90.0° |
| C7 | C2 | C1 | H4 | 148.8° | 150.0° |
| C7 | C2 | C1 | H2 | 28.8° | 30.0° |
| C7 | C2 | C3 | H5 | 179.0° | 180.0° |
| C2 | C7 | N1 | H1 | 3.1° | 0.0° |
| C6 | C5 | C4 | H6 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 0.9° | 0.3° |
| C6 | C5 | C4 | C9 | 173.9° | 180.0° |
| C5 | C6 | C8 | H7 | 2.7° | 0.3° |
| C1 | C2 | C3 | C4 | 178.5° | 179.7° |
| C2 | C1 | H3 | H4 | 120.0° | 120.0° |
| C2 | C1 | H3 | H2 | 120.0° | 120.0° |
| C2 | C1 | H4 | H2 | 120.0° | 120.0° |
| C1 | C2 | C3 | H5 | 1.5° | 0.2° |
| C2 | C3 | C4 | C5 | 0.2° | 0.4° |
| C2 | C3 | C4 | H5 | 180.0° | 179.9° |
| C2 | C3 | C4 | C9 | 175.1° | 180.0° |
| C3 | C2 | C1 | H3 | 91.4° | 89.8° |
| C3 | C2 | C1 | H4 | 28.6° | 30.2° |
| C3 | C2 | C1 | H2 | 148.6° | 150.2° |
| C5 | C4 | C3 | C9 | 174.9° | 179.7° |
| C5 | C4 | C9 | O1 | 116.9° | 137.8° |
| C5 | C4 | C9 | N3 | 62.0° | 42.3° |
| C5 | C4 | C3 | H5 | 179.8° | 179.8° |
| C3 | C4 | C9 | O1 | 58.2° | 41.9° |
| C3 | C4 | C9 | N3 | 123.0° | 138.0° |
| C3 | C4 | C5 | H6 | 179.1° | 179.7° |
| C4 | C9 | O1 | N3 | 178.8° | 179.9° |
| C4 | C9 | N3 | C10 | 3.2° | 5.5° |
| C4 | C9 | N3 | C14 | 166.2° | 174.1° |
| C9 | C4 | C3 | H5 | 4.9° | 0.1° |
| C9 | C4 | C5 | H6 | 6.0° | 0.0° |
| O1 | C9 | N3 | C10 | 177.9° | 174.4° |
| O1 | C9 | N3 | C14 | 12.7° | 5.9° |
| C9 | N3 | C10 | C14 | 170.0° | 179.7° |
| C9 | N3 | C10 | C11 | 134.8° | 126.0° |
| C9 | N3 | C14 | C13 | 135.0° | 126.0° |
| C9 | N3 | C10 | H8 | 14.7° | 6.3° |
| C9 | N3 | C10 | H9 | 105.1° | 114.2° |
| C9 | N3 | C14 | H14 | 104.8° | 114.5° |
| C9 | N3 | C14 | H15 | 14.8° | 6.0° |
| N3 | C10 | C11 | H8 | 120.1° | 119.7° |
| N3 | C10 | C11 | H9 | 120.1° | 119.8° |
| C10 | N3 | C14 | C13 | 54.8° | 54.3° |
| N3 | C10 | C11 | C12 | 54.5° | 53.6° |
| N3 | C10 | H8 | H9 | 119.6° | 120.4° |
| N3 | C10 | C11 | H11 | 66.0° | 66.4° |
| N3 | C10 | C11 | H10 | 175.0° | 173.5° |
| C10 | N3 | C14 | H14 | 65.4° | 65.2° |
| C10 | N3 | C14 | H15 | 175.0° | 174.3° |
| C11 | C10 | N3 | C14 | 55.1° | 54.4° |
| C10 | C11 | C12 | H11 | 120.5° | 120.0° |
| C10 | C11 | C12 | H10 | 120.5° | 120.0° |
| C10 | C11 | C12 | C15 | 73.3° | 63.0° |
| C10 | C11 | C12 | C13 | 53.7° | 59.5° |
| C10 | C11 | C12 | C17 | 174.7° | 177.1° |
| C11 | C10 | H8 | H9 | 119.6° | 120.4° |
| C10 | C11 | H11 | H10 | 118.6° | 120.1° |
| N3 | C14 | C13 | H14 | 120.2° | 119.7° |
| N3 | C14 | C13 | H15 | 120.2° | 119.9° |
| N3 | C14 | C13 | C12 | 53.6° | 53.6° |
| N3 | C14 | C13 | H12 | 174.1° | 66.5° |
| N3 | C14 | C13 | H13 | 66.9° | 173.5° |
| C14 | N3 | C10 | H8 | 175.3° | 174.1° |
| C14 | N3 | C10 | H9 | 65.0° | 65.4° |
| N3 | C14 | H14 | H15 | 119.3° | 120.4° |
| C14 | C13 | C12 | C11 | 53.0° | 59.5° |
| C14 | C13 | C12 | C15 | 71.6° | 63.0° |
| C14 | C13 | C12 | H12 | 120.5° | 120.0° |
| C14 | C13 | C12 | H13 | 120.5° | 119.9° |
| C14 | C13 | C12 | C17 | 171.7° | 177.1° |
| C14 | C13 | H12 | H13 | 118.5° | 119.9° |
| C13 | C14 | H14 | H15 | 119.3° | 120.5° |
| C11 | C12 | C15 | C13 | 123.8° | 123.2° |
| C11 | C12 | C15 | C17 | 114.9° | 118.4° |
| C11 | C12 | C15 | C16 | 81.5° | 83.6° |
| C11 | C12 | C13 | C17 | 118.8° | 123.4° |
| C11 | C12 | C17 | N4 | 82.0° | 96.6° |
| C11 | C12 | C17 | C18 | 159.2° | 144.1° |
| C11 | C12 | C13 | H12 | 173.4° | 60.4° |
| C11 | C12 | C13 | H13 | 67.5° | 179.5° |
| C12 | C11 | C10 | H8 | 174.6° | 173.3° |
| C12 | C11 | C10 | H9 | 65.6° | 66.3° |
| C12 | C11 | H11 | H10 | 118.5° | 119.9° |
| C11 | C12 | C15 | H16 | 37.8° | 158.4° |
| C11 | C12 | C15 | H17 | 159.2° | 34.4° |
| C11 | C12 | C17 | H20 | 35.4° | 22.8° |
| C12 | C15 | C16 | H16 | 119.3° | 118.0° |
| C12 | C15 | C16 | H17 | 119.3° | 118.0° |
| C15 | C12 | C13 | C17 | 116.6° | 114.1° |
| C12 | C15 | C16 | N4 | 18.6° | 36.4° |
| C15 | C12 | C17 | N4 | 34.9° | 21.5° |
| C15 | C12 | C17 | C18 | 83.9° | 97.8° |
| C15 | C12 | C13 | H12 | 48.9° | 177.0° |
| C15 | C12 | C13 | H13 | 167.9° | 56.9° |
| C12 | C15 | C16 | H18 | 100.5° | 82.5° |
| C12 | C15 | C16 | H19 | 137.8° | 155.3° |
| C15 | C12 | C11 | H11 | 166.3° | 177.0° |
| C15 | C12 | C11 | H10 | 47.2° | 57.0° |
| C12 | C15 | H16 | H17 | 122.0° | 124.0° |
| C15 | C12 | C17 | H20 | 152.3° | 140.9° |
| C16 | C15 | C12 | C13 | 154.7° | 153.2° |
| C16 | C15 | C12 | C17 | 33.4° | 34.8° |
| C15 | C16 | N4 | H18 | 119.2° | 118.8° |
| C15 | C16 | N4 | H19 | 119.2° | 119.0° |
| C15 | C16 | N4 | C17 | 4.3° | 24.0° |
| C15 | C16 | N4 | C19 | 173.3° | 156.0° |
| C15 | C16 | H18 | H19 | 122.4° | 122.3° |
| C16 | C15 | H16 | H17 | 122.1° | 123.9° |
| C13 | C12 | C17 | N4 | 158.4° | 139.7° |
| C13 | C12 | C17 | C18 | 39.6° | 20.3° |
| C12 | C13 | H12 | H13 | 118.6° | 120.1° |
| C13 | C12 | C11 | H11 | 66.7° | 60.5° |
| C13 | C12 | C11 | H10 | 174.2° | 179.6° |
| C12 | C13 | C14 | H14 | 66.6° | 66.2° |
| C12 | C13 | C14 | H15 | 173.8° | 173.5° |
| C13 | C12 | C15 | H16 | 86.0° | 35.2° |
| C13 | C12 | C15 | H17 | 35.4° | 88.7° |
| C13 | C12 | C17 | H20 | 84.2° | 101.0° |
| C12 | C17 | N4 | C16 | 24.9° | 1.5° |
| C12 | C17 | N4 | C18 | 121.5° | 119.3° |
| C12 | C17 | N4 | H20 | 116.6° | 119.4° |
| C12 | C17 | N4 | C19 | 152.9° | 178.5° |
| C12 | C17 | C18 | H20 | 123.6° | 121.2° |
| C17 | C12 | C13 | H12 | 67.8° | 62.9° |
| C17 | C12 | C13 | H13 | 51.3° | 57.1° |
| C12 | C17 | C18 | H21 | 180.0° | 60.0° |
| C12 | C17 | C18 | H22 | 60.0° | 179.9° |
| C12 | C17 | C18 | H23 | 60.0° | 59.9° |
| C17 | C12 | C11 | H11 | 54.3° | 62.9° |
| C17 | C12 | C11 | H10 | 64.8° | 57.0° |
| C17 | C12 | C15 | H16 | 152.7° | 83.2° |
| C17 | C12 | C15 | H17 | 85.9° | 152.8° |
| C16 | N4 | C17 | C19 | 177.8° | 180.0° |
| C16 | N4 | C17 | C18 | 96.6° | 120.9° |
| C16 | N4 | C19 | O3 | 6.8° | 0.1° |
| C16 | N4 | C19 | O2 | 173.2° | 179.9° |
| N4 | C16 | H18 | H19 | 122.4° | 122.2° |
| N4 | C16 | C15 | H16 | 137.9° | 81.7° |
| N4 | C16 | C15 | H17 | 100.7° | 154.4° |
| C16 | N4 | C17 | H20 | 141.4° | 117.9° |
| C24 | C21 | C20 | O3 | 58.3° | 60.0° |
| C24 | C21 | C20 | C22 | 121.9° | 120.0° |
| C24 | C21 | C20 | C23 | 119.1° | 120.0° |
| C24 | C21 | C22 | C23 | 119.9° | 120.0° |
| C24 | C21 | C20 | H25 | 177.9° | 60.0° |
| C24 | C21 | C20 | H24 | 61.3° | 180.0° |
| C24 | C21 | C22 | H28 | 180.0° | 180.0° |
| C24 | C21 | C22 | H27 | 60.0° | 60.0° |
| C24 | C21 | C22 | H26 | 60.0° | 60.0° |
| C24 | C21 | C23 | H29 | 180.0° | 60.0° |
| C24 | C21 | C23 | H30 | 60.0° | 60.0° |
| C24 | C21 | C23 | H31 | 60.0° | 180.0° |
| C21 | C24 | H32 | H34 | 120.0° | 120.0° |
| C21 | C24 | H32 | H33 | 120.0° | 120.0° |
| C21 | C24 | H34 | H33 | 120.0° | 120.0° |
| N4 | C17 | C18 | H20 | 122.4° | 121.2° |
| C17 | N4 | C19 | O3 | 175.8° | 179.9° |
| C17 | N4 | C19 | O2 | 4.2° | 0.0° |
| N4 | C17 | C18 | H21 | 66.1° | 177.6° |
| N4 | C17 | C18 | H22 | 54.0° | 62.3° |
| N4 | C17 | C18 | H23 | 174.0° | 57.7° |
| C17 | N4 | C16 | H18 | 123.5° | 94.8° |
| C17 | N4 | C16 | H19 | 114.9° | 143.0° |
| C19 | N4 | C17 | C18 | 85.6° | 59.1° |
| N4 | C19 | O3 | O2 | 180.0° | 180.0° |
| N4 | C19 | O3 | C20 | 174.7° | 179.9° |
| C19 | N4 | C16 | H18 | 54.2° | 85.2° |
| C19 | N4 | C16 | H19 | 67.5° | 37.0° |
| C19 | N4 | C17 | H20 | 36.3° | 62.1° |
| C17 | C18 | H21 | H22 | 120.0° | 120.0° |
| C17 | C18 | H21 | H23 | 120.0° | 120.0° |
| C17 | C18 | H22 | H23 | 120.0° | 120.0° |
| C19 | O3 | C20 | C21 | 179.4° | 180.0° |
| C19 | O3 | C20 | H25 | 61.0° | 60.0° |
| C19 | O3 | C20 | H24 | 59.9° | 60.0° |
| C20 | O3 | C19 | O2 | 5.3° | 0.0° |
| O3 | C20 | C21 | H25 | 119.6° | 120.0° |
| O3 | C20 | C21 | H24 | 119.6° | 120.0° |
| O3 | C20 | C21 | C22 | 63.6° | 60.0° |
| O3 | C20 | C21 | C23 | 177.4° | 180.0° |
| O3 | C20 | H25 | H24 | 121.2° | 119.9° |
| C20 | C21 | C22 | C23 | 117.5° | 120.0° |
| C21 | C20 | H25 | H24 | 121.2° | 120.1° |
| C20 | C21 | C22 | H28 | 57.4° | 60.0° |
| C20 | C21 | C22 | H27 | 177.4° | 180.0° |
| C20 | C21 | C22 | H26 | 62.7° | 60.0° |
| C20 | C21 | C23 | H29 | 59.8° | 60.0° |
| C20 | C21 | C23 | H30 | 60.2° | 180.0° |
| C20 | C21 | C23 | H31 | 179.8° | 60.0° |
| C20 | C21 | C24 | H32 | 180.0° | 60.0° |
| C20 | C21 | C24 | H34 | 60.0° | 180.0° |
| C20 | C21 | C24 | H33 | 60.0° | 60.0° |
| C22 | C21 | C20 | H25 | 56.0° | 180.0° |
| C22 | C21 | C20 | H24 | 176.8° | 60.0° |
| C21 | C22 | H28 | H27 | 120.0° | 120.0° |
| C21 | C22 | H28 | H26 | 120.0° | 120.0° |
| C21 | C22 | H27 | H26 | 120.0° | 120.0° |
| C22 | C21 | C23 | H29 | 59.9° | 180.0° |
| C22 | C21 | C23 | H30 | 179.8° | 60.0° |
| C22 | C21 | C23 | H31 | 60.1° | 60.0° |
| C22 | C21 | C24 | H32 | 57.7° | 60.0° |
| C22 | C21 | C24 | H34 | 177.7° | 60.0° |
| C22 | C21 | C24 | H33 | 62.3° | 180.0° |
| C23 | C21 | C20 | H25 | 63.1° | 60.0° |
| C23 | C21 | C20 | H24 | 57.8° | 60.0° |
| C23 | C21 | C22 | H28 | 60.1° | 60.0° |
| C23 | C21 | C22 | H27 | 59.9° | 60.0° |
| C23 | C21 | C22 | H26 | 179.8° | 180.0° |
| C21 | C23 | H29 | H30 | 120.0° | 120.0° |
| C21 | C23 | H29 | H31 | 120.0° | 120.0° |
| C21 | C23 | H30 | H31 | 120.0° | 120.0° |
| C23 | C21 | C24 | H32 | 62.3° | 180.0° |
| C23 | C21 | C24 | H34 | 57.7° | 60.0° |
| C23 | C21 | C24 | H33 | 177.7° | 60.0° |
| H12 | C13 | C14 | H14 | 53.8° | 173.8° |
| H12 | C13 | C14 | H15 | 65.7° | 53.4° |
| H13 | C13 | C14 | H14 | 172.9° | 53.8° |
| H13 | C13 | C14 | H15 | 53.3° | 66.6° |
| H21 | C18 | H22 | H23 | 120.0° | 120.0° |
| H21 | C18 | C17 | H20 | 56.3° | 61.2° |
| H22 | C18 | C17 | H20 | 176.4° | 58.8° |
| H23 | C18 | C17 | H20 | 63.6° | 178.8° |
| H18 | C16 | C15 | H16 | 18.7° | 159.5° |
| H18 | C16 | C15 | H17 | 140.1° | 35.6° |
| H19 | C16 | C15 | H16 | 102.9° | 37.3° |
| H19 | C16 | C15 | H17 | 18.5° | 86.7° |
| H3 | C1 | H4 | H2 | 120.0° | 120.0° |
| H8 | C10 | C11 | H11 | 54.2° | 53.3° |
| H8 | C10 | C11 | H10 | 64.9° | 66.8° |
| H9 | C10 | C11 | H11 | 173.9° | 173.7° |
| H9 | C10 | C11 | H10 | 54.8° | 53.7° |
| H28 | C22 | H27 | H26 | 120.0° | 120.0° |
| H29 | C23 | H30 | H31 | 120.0° | 120.0° |
| H32 | C24 | H34 | H33 | 120.0° | 119.9° |
