7YB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.41Å | Aromatic |
| C30 | C10 | sing | 1.53Å | 1.53Å | |
| C30 | C11 | sing | 1.53Å | 1.50Å | |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.41Å | Aromatic |
| C18 | C16 | sing | 1.53Å | 1.52Å | |
| C18 | C23 | sing | 1.53Å | 1.50Å | |
| C16 | C13 | sing | 1.53Å | 1.51Å | |
| C10 | C11 | sing | 1.53Å | 1.48Å | |
| C6 | C1 | doub | 1.38Å | 1.40Å | Aromatic |
| O38 | C15 | doub | 1.21Å | 1.16Å | |
| C34 | C13 | sing | 1.53Å | 1.52Å | |
| C34 | C14 | sing | 1.53Å | 1.52Å | |
| C13 | C26 | sing | 1.53Å | 1.50Å | |
| N13 | C14 | sing | 1.47Å | 1.43Å | |
| N13 | C12 | sing | 1.35Å | 1.31Å | |
| C11 | N10 | sing | 1.47Å | 1.47Å | |
| C11 | C12 | sing | 1.51Å | 1.50Å | |
| C2 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C1 | C7 | sing | 1.51Å | 1.52Å | |
| C23 | C25 | sing | 1.53Å | 1.49Å | |
| C14 | C15 | sing | 1.51Å | 1.49Å | |
| N10 | C9 | sing | 1.35Å | 1.36Å | |
| C12 | O33 | doub | 1.21Å | 1.17Å | |
| C15 | N16 | sing | 1.35Å | 1.31Å | |
| O29 | C9 | doub | 1.22Å | 1.20Å | |
| C21 | C22 | sing | 1.54Å | 1.52Å | |
| C21 | C20 | sing | 1.55Å | 1.52Å | |
| C9 | O8 | sing | 1.35Å | 1.46Å | |
| C22 | N23 | sing | 1.47Å | 1.43Å | |
| C25 | C26 | sing | 1.53Å | 1.52Å | |
| C7 | O8 | sing | 1.45Å | 1.44Å | |
| N16 | C17 | sing | 1.46Å | 1.44Å | |
| C17 | C8 | sing | 1.53Å | 1.51Å | |
| C17 | C19 | sing | 1.53Å | 1.52Å | |
| C8 | O9 | sing | 1.43Å | 1.40Å | |
| C20 | C19 | sing | 1.53Å | 1.50Å | |
| C20 | C24 | sing | 1.51Å | 1.53Å | |
| N23 | C24 | sing | 1.34Å | 1.31Å | |
| C24 | O26 | doub | 1.21Å | 1.18Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C16 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C18 | H8 | sing | 1.09Å | 1.10Å | |
| C18 | H9 | sing | 1.09Å | 1.10Å | |
| C19 | H10 | sing | 1.09Å | 1.10Å | |
| C19 | H11 | sing | 1.09Å | 1.10Å | |
| C2 | H12 | sing | 1.08Å | 1.08Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C3 | H24 | sing | 1.08Å | 1.08Å | |
| C30 | H25 | sing | 1.09Å | 1.10Å | |
| C30 | H26 | sing | 1.09Å | 1.10Å | |
| C34 | H27 | sing | 1.09Å | 1.10Å | |
| C34 | H28 | sing | 1.09Å | 1.10Å | |
| C4 | H29 | sing | 1.08Å | 1.08Å | |
| C5 | H30 | sing | 1.08Å | 1.08Å | |
| C6 | H31 | sing | 1.08Å | 1.08Å | |
| C7 | H32 | sing | 1.09Å | 1.10Å | |
| C7 | H33 | sing | 1.09Å | 1.10Å | |
| C8 | H34 | sing | 1.09Å | 1.10Å | |
| C8 | H35 | sing | 1.09Å | 1.10Å | |
| N10 | H36 | sing | 0.97Å | 1.00Å | |
| N13 | H37 | sing | 0.97Å | 1.00Å | |
| N16 | H38 | sing | 0.97Å | 1.00Å | |
| N23 | H39 | sing | 0.97Å | 1.00Å | |
| O9 | H40 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C4 | C3 | 119.1° | 120.0° |
| C4 | C5 | C6 | 119.5° | 120.0° |
| C5 | C4 | H29 | 120.4° | 120.0° |
| C4 | C5 | H30 | 120.3° | 120.0° |
| C4 | C3 | C2 | 120.1° | 120.0° |
| C4 | C3 | H24 | 119.9° | 120.0° |
| C3 | C4 | H29 | 120.4° | 120.0° |
| C10 | C30 | C11 | 58.6° | 60.0° |
| C30 | C10 | C11 | 59.6° | 60.0° |
| C30 | C10 | H1 | 120.1° | 117.5° |
| C30 | C10 | H2 | 120.1° | 117.5° |
| C10 | C30 | H25 | 120.2° | 117.5° |
| C10 | C30 | H26 | 120.3° | 117.5° |
| C30 | C11 | C10 | 61.8° | 60.0° |
| C30 | C11 | N10 | 110.4° | 117.4° |
| C30 | C11 | C12 | 108.6° | 117.5° |
| C11 | C30 | H25 | 120.2° | 117.5° |
| C11 | C30 | H26 | 120.2° | 117.5° |
| C5 | C6 | C1 | 123.0° | 119.9° |
| C6 | C5 | H30 | 120.2° | 119.9° |
| C5 | C6 | H31 | 118.5° | 120.1° |
| C3 | C2 | C1 | 121.1° | 120.0° |
| C3 | C2 | H12 | 119.5° | 120.0° |
| C2 | C3 | H24 | 119.9° | 120.0° |
| C16 | C18 | C23 | 109.9° | 109.5° |
| C18 | C16 | C13 | 109.7° | 109.5° |
| C18 | C16 | H5 | 109.4° | 109.5° |
| C18 | C16 | H6 | 109.4° | 109.5° |
| C16 | C18 | H8 | 109.4° | 109.4° |
| C16 | C18 | H9 | 109.4° | 109.5° |
| C18 | C23 | C25 | 107.8° | 109.5° |
| C23 | C18 | H8 | 109.4° | 109.4° |
| C23 | C18 | H9 | 109.4° | 109.5° |
| C18 | C23 | H18 | 109.9° | 109.5° |
| C18 | C23 | H19 | 109.9° | 109.4° |
| C16 | C13 | C34 | 109.4° | 109.5° |
| C16 | C13 | C26 | 105.2° | 109.4° |
| C16 | C13 | H3 | 108.9° | 109.5° |
| C13 | C16 | H5 | 109.4° | 109.4° |
| C13 | C16 | H6 | 109.4° | 109.5° |
| C10 | C11 | N10 | 116.9° | 117.5° |
| C10 | C11 | C12 | 110.6° | 117.5° |
| C11 | C10 | H1 | 120.0° | 117.6° |
| C11 | C10 | H2 | 120.0° | 117.5° |
| C6 | C1 | C2 | 117.1° | 120.0° |
| C6 | C1 | C7 | 122.1° | 120.0° |
| C1 | C6 | H31 | 118.5° | 120.0° |
| O38 | C15 | C14 | 115.8° | 120.0° |
| O38 | C15 | N16 | 121.3° | 119.9° |
| C13 | C34 | C14 | 115.7° | 109.5° |
| C34 | C13 | C26 | 115.2° | 109.5° |
| C34 | C13 | H3 | 108.8° | 109.4° |
| C13 | C34 | H27 | 107.9° | 109.5° |
| C13 | C34 | H28 | 107.9° | 109.5° |
| C34 | C14 | N13 | 110.6° | 109.5° |
| C34 | C14 | C15 | 110.3° | 109.5° |
| C34 | C14 | H4 | 107.8° | 109.5° |
| C14 | C34 | H27 | 107.9° | 109.5° |
| C14 | C34 | H28 | 107.9° | 109.4° |
| C13 | C26 | C25 | 111.8° | 109.5° |
| C26 | C13 | H3 | 109.1° | 109.5° |
| C13 | C26 | H22 | 108.9° | 109.5° |
| C13 | C26 | H23 | 108.9° | 109.4° |
| C14 | N13 | C12 | 119.1° | 120.0° |
| N13 | C14 | C15 | 110.8° | 109.5° |
| N13 | C14 | H4 | 109.0° | 109.5° |
| C14 | N13 | H37 | 120.5° | 120.0° |
| N13 | C12 | C11 | 117.4° | 120.0° |
| N13 | C12 | O33 | 124.1° | 120.0° |
| C12 | N13 | H37 | 120.5° | 120.0° |
| N10 | C11 | C12 | 128.5° | 115.6° |
| C11 | N10 | C9 | 139.2° | 120.0° |
| C11 | N10 | H36 | 110.4° | 120.0° |
| C11 | C12 | O33 | 118.4° | 120.0° |
| C2 | C1 | C7 | 120.9° | 120.0° |
| C1 | C2 | H12 | 119.4° | 120.0° |
| C1 | C7 | O8 | 119.9° | 109.4° |
| C1 | C7 | H32 | 106.8° | 109.5° |
| C1 | C7 | H33 | 106.8° | 109.5° |
| C23 | C25 | C26 | 110.3° | 109.5° |
| C25 | C23 | H18 | 109.9° | 109.5° |
| C25 | C23 | H19 | 109.9° | 109.4° |
| C23 | C25 | H20 | 109.3° | 109.4° |
| C23 | C25 | H21 | 109.3° | 109.4° |
| C14 | C15 | N16 | 122.9° | 120.0° |
| C15 | C14 | H4 | 108.2° | 109.5° |
| N10 | C9 | O29 | 124.6° | 120.0° |
| N10 | C9 | O8 | 117.2° | 120.0° |
| C9 | N10 | H36 | 110.4° | 120.0° |
| C15 | N16 | C17 | 121.1° | 120.0° |
| C15 | N16 | H38 | 119.5° | 120.0° |
| O29 | C9 | O8 | 118.2° | 120.0° |
| C22 | C21 | C20 | 105.2° | 101.8° |
| C21 | C22 | N23 | 103.8° | 105.5° |
| C22 | C21 | H14 | 110.5° | 111.0° |
| C22 | C21 | H15 | 110.5° | 111.0° |
| C21 | C22 | H16 | 110.9° | 110.3° |
| C21 | C22 | H17 | 110.9° | 110.3° |
| C21 | C20 | C19 | 111.8° | 110.5° |
| C21 | C20 | C24 | 101.5° | 104.2° |
| C21 | C20 | H13 | 109.1° | 110.6° |
| C20 | C21 | H14 | 110.5° | 110.9° |
| C20 | C21 | H15 | 110.5° | 111.0° |
| C9 | O8 | C7 | 131.6° | 117.0° |
| C22 | N23 | C24 | 113.1° | 111.3° |
| N23 | C22 | H16 | 110.8° | 110.2° |
| N23 | C22 | H17 | 110.9° | 110.2° |
| C22 | N23 | H39 | 123.5° | 124.4° |
| C26 | C25 | H20 | 109.3° | 109.5° |
| C26 | C25 | H21 | 109.2° | 109.5° |
| C25 | C26 | H22 | 108.9° | 109.5° |
| C25 | C26 | H23 | 108.9° | 109.5° |
| O8 | C7 | H32 | 106.8° | 109.4° |
| O8 | C7 | H33 | 106.8° | 109.5° |
| N16 | C17 | C8 | 110.8° | 109.4° |
| N16 | C17 | C19 | 112.6° | 109.5° |
| N16 | C17 | H7 | 106.7° | 109.5° |
| C17 | N16 | H38 | 119.4° | 120.0° |
| C8 | C17 | C19 | 114.6° | 109.4° |
| C17 | C8 | O9 | 117.0° | 109.5° |
| C8 | C17 | H7 | 105.8° | 109.5° |
| C17 | C8 | H34 | 107.5° | 109.5° |
| C17 | C8 | H35 | 107.6° | 109.5° |
| C17 | C19 | C20 | 114.2° | 109.4° |
| C19 | C17 | H7 | 105.7° | 109.5° |
| C17 | C19 | H10 | 108.3° | 109.5° |
| C17 | C19 | H11 | 108.2° | 109.4° |
| O9 | C8 | H34 | 107.5° | 109.5° |
| O9 | C8 | H35 | 107.5° | 109.5° |
| C8 | O9 | H40 | 109.5° | 114.1° |
| C19 | C20 | C24 | 115.8° | 110.5° |
| C20 | C19 | H10 | 108.3° | 109.5° |
| C20 | C19 | H11 | 108.3° | 109.5° |
| C19 | C20 | H13 | 109.3° | 110.5° |
| C20 | C24 | N23 | 110.5° | 110.1° |
| C20 | C24 | O26 | 123.6° | 124.9° |
| C24 | C20 | H13 | 109.0° | 110.5° |
| N23 | C24 | O26 | 125.9° | 124.9° |
| C24 | N23 | H39 | 123.4° | 124.3° |
| H1 | C10 | H2 | 109.5° | 115.5° |
| H5 | C16 | H6 | 109.5° | 109.5° |
| H8 | C18 | H9 | 109.5° | 109.4° |
| H10 | C19 | H11 | 109.5° | 109.5° |
| H14 | C21 | H15 | 109.5° | 110.9° |
| H16 | C22 | H17 | 109.5° | 110.3° |
| H18 | C23 | H19 | 109.5° | 109.5° |
| H20 | C25 | H21 | 109.5° | 109.5° |
| H22 | C26 | H23 | 109.4° | 109.5° |
| H25 | C30 | H26 | 109.5° | 115.5° |
| H27 | C34 | H28 | 109.4° | 109.5° |
| H32 | C7 | H33 | 109.5° | 109.5° |
| H34 | C8 | H35 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C4 | C3 | H29 | 180.0° | 179.7° |
| C4 | C5 | C6 | H30 | 180.0° | 179.8° |
| C5 | C4 | C3 | C2 | 1.3° | 0.1° |
| C4 | C5 | C6 | C1 | 0.7° | 0.5° |
| C5 | C4 | C3 | H24 | 178.7° | 180.0° |
| C4 | C5 | C6 | H31 | 179.3° | 180.0° |
| C3 | C4 | C5 | C6 | 0.5° | 0.3° |
| C4 | C3 | C2 | H24 | 180.0° | 179.9° |
| C4 | C3 | C2 | C1 | 0.8° | 0.1° |
| C4 | C3 | C2 | H12 | 179.2° | 180.0° |
| C3 | C4 | C5 | H30 | 179.5° | 179.9° |
| C10 | C30 | C11 | H25 | 109.1° | 107.5° |
| C10 | C30 | C11 | H26 | 109.1° | 107.5° |
| C30 | C10 | C11 | H1 | 109.4° | 107.5° |
| C30 | C10 | C11 | H2 | 109.4° | 107.5° |
| C10 | C30 | C11 | N10 | 110.4° | 107.5° |
| C10 | C30 | C11 | C12 | 103.9° | 107.5° |
| C30 | C10 | H1 | H2 | 145.0° | 145.6° |
| C10 | C30 | H25 | H26 | 145.6° | 145.7° |
| C30 | C11 | C12 | N13 | 39.9° | 135.0° |
| C30 | C11 | N10 | C12 | 137.0° | 145.7° |
| C30 | C11 | N10 | C9 | 93.1° | 133.9° |
| C30 | C11 | C12 | O33 | 137.5° | 44.9° |
| C11 | C30 | H25 | H26 | 145.5° | 145.7° |
| C30 | C11 | N10 | H36 | 86.9° | 46.2° |
| C5 | C6 | C1 | H31 | 180.0° | 179.5° |
| C5 | C6 | C1 | C2 | 1.2° | 0.6° |
| C5 | C6 | C1 | C7 | 178.0° | 179.7° |
| C6 | C5 | C4 | H29 | 179.4° | 180.0° |
| C3 | C2 | C1 | C6 | 0.4° | 0.4° |
| C3 | C2 | C1 | H12 | 180.0° | 179.9° |
| C3 | C2 | C1 | C7 | 178.8° | 180.0° |
| C2 | C3 | C4 | H29 | 178.7° | 179.8° |
| C16 | C18 | C23 | H8 | 120.1° | 120.0° |
| C16 | C18 | C23 | H9 | 120.1° | 120.1° |
| C18 | C16 | C13 | H5 | 120.0° | 120.0° |
| C18 | C16 | C13 | H6 | 120.0° | 120.1° |
| C18 | C16 | C13 | C34 | 174.1° | 180.0° |
| C18 | C16 | C13 | C26 | 61.6° | 60.0° |
| C16 | C18 | C23 | C25 | 60.2° | 59.9° |
| C18 | C16 | C13 | H3 | 55.2° | 60.0° |
| C18 | C16 | H5 | H6 | 119.9° | 120.1° |
| C16 | C18 | H8 | H9 | 119.8° | 120.0° |
| C16 | C18 | C23 | H18 | 180.0° | 180.0° |
| C16 | C18 | C23 | H19 | 59.5° | 60.0° |
| C23 | C18 | C16 | C13 | 64.0° | 60.0° |
| C18 | C23 | C25 | H18 | 119.8° | 120.0° |
| C18 | C23 | C25 | H19 | 119.7° | 119.9° |
| C18 | C23 | C25 | C26 | 58.0° | 59.9° |
| C23 | C18 | C16 | H5 | 56.0° | 179.9° |
| C23 | C18 | C16 | H6 | 176.0° | 60.0° |
| C23 | C18 | H8 | H9 | 119.8° | 120.0° |
| C18 | C23 | H18 | H19 | 120.8° | 120.0° |
| C18 | C23 | C25 | H20 | 62.2° | 60.1° |
| C18 | C23 | C25 | H21 | 178.1° | 180.0° |
| C16 | C13 | C34 | C26 | 118.2° | 120.0° |
| C16 | C13 | C34 | H3 | 118.9° | 120.0° |
| C16 | C13 | C34 | C14 | 170.3° | 66.6° |
| C16 | C13 | C26 | H3 | 116.7° | 120.0° |
| C16 | C13 | C26 | C25 | 60.4° | 60.0° |
| C13 | C16 | H5 | H6 | 119.9° | 120.0° |
| C13 | C16 | C18 | H8 | 56.1° | 60.0° |
| C13 | C16 | C18 | H9 | 175.9° | 180.0° |
| C16 | C13 | C26 | H22 | 59.9° | 60.0° |
| C16 | C13 | C26 | H23 | 179.2° | 180.0° |
| C16 | C13 | C34 | H27 | 49.4° | 173.4° |
| C16 | C13 | C34 | H28 | 68.8° | 53.4° |
| C10 | C11 | C12 | N13 | 106.0° | 156.3° |
| C10 | C11 | N10 | C12 | 155.1° | 145.7° |
| C10 | C11 | N10 | C9 | 161.0° | 65.3° |
| C10 | C11 | C12 | O33 | 71.4° | 23.7° |
| C11 | C10 | H1 | H2 | 144.9° | 145.7° |
| C10 | C11 | N10 | H36 | 19.0° | 114.8° |
| C6 | C1 | C2 | C7 | 179.2° | 179.7° |
| C6 | C1 | C7 | O8 | 4.3° | 90.2° |
| C6 | C1 | C2 | H12 | 179.6° | 179.8° |
| C1 | C6 | C5 | H30 | 179.3° | 179.7° |
| C6 | C1 | C7 | H32 | 125.8° | 29.7° |
| C6 | C1 | C7 | H33 | 117.1° | 149.7° |
| O38 | C15 | C14 | C34 | 78.2° | 102.6° |
| O38 | C15 | C14 | N13 | 44.7° | 17.5° |
| O38 | C15 | C14 | N16 | 179.4° | 180.0° |
| O38 | C15 | N16 | C17 | 2.8° | 5.7° |
| O38 | C15 | C14 | H4 | 164.1° | 137.4° |
| O38 | C15 | N16 | H38 | 177.2° | 174.4° |
| C13 | C34 | C14 | H27 | 120.9° | 120.0° |
| C13 | C34 | C14 | H28 | 120.9° | 120.0° |
| C34 | C13 | C26 | H3 | 122.8° | 120.0° |
| C13 | C34 | C14 | N13 | 66.3° | 178.6° |
| C13 | C34 | C14 | C15 | 170.7° | 61.4° |
| C34 | C13 | C26 | C25 | 179.0° | 180.0° |
| C13 | C34 | C14 | H4 | 52.8° | 58.6° |
| C34 | C13 | C16 | H5 | 65.9° | 60.0° |
| C34 | C13 | C16 | H6 | 54.0° | 59.9° |
| C34 | C13 | C26 | H22 | 60.6° | 60.0° |
| C34 | C13 | C26 | H23 | 58.6° | 60.0° |
| C13 | C34 | H27 | H28 | 117.2° | 120.0° |
| C14 | C34 | C13 | C26 | 52.0° | 173.4° |
| C34 | C14 | N13 | C15 | 122.6° | 120.0° |
| C34 | C14 | N13 | H4 | 118.4° | 120.0° |
| C34 | C14 | N13 | C12 | 163.7° | 88.7° |
| C34 | C14 | C15 | H4 | 117.7° | 120.0° |
| C34 | C14 | C15 | N16 | 102.4° | 77.4° |
| C14 | C34 | C13 | H3 | 70.9° | 53.4° |
| C14 | C34 | H27 | H28 | 117.2° | 120.0° |
| C34 | C14 | N13 | H37 | 16.3° | 91.2° |
| C13 | C26 | C25 | C23 | 60.9° | 60.0° |
| C13 | C26 | C25 | H22 | 120.4° | 120.0° |
| C13 | C26 | C25 | H23 | 120.4° | 120.0° |
| C26 | C13 | C16 | H5 | 58.4° | 180.0° |
| C26 | C13 | C16 | H6 | 178.3° | 60.1° |
| C13 | C26 | C25 | H20 | 59.2° | 60.0° |
| C13 | C26 | C25 | H21 | 179.0° | 180.0° |
| C13 | C26 | H22 | H23 | 118.9° | 120.0° |
| C26 | C13 | C34 | H27 | 68.9° | 53.4° |
| C26 | C13 | C34 | H28 | 173.0° | 66.6° |
| C14 | N13 | C12 | H37 | 180.0° | 180.0° |
| C14 | N13 | C12 | C11 | 161.0° | 175.0° |
| N13 | C14 | C15 | H4 | 119.5° | 120.0° |
| C14 | N13 | C12 | O33 | 21.8° | 5.0° |
| N13 | C14 | C15 | N16 | 134.8° | 162.5° |
| N13 | C14 | C34 | H27 | 172.8° | 61.3° |
| N13 | C14 | C34 | H28 | 54.6° | 58.6° |
| N13 | C12 | C11 | N10 | 97.6° | 10.6° |
| N13 | C12 | C11 | O33 | 177.4° | 180.0° |
| C12 | N13 | C14 | C15 | 73.7° | 151.3° |
| C12 | N13 | C14 | H4 | 45.3° | 31.3° |
| C11 | N10 | C9 | H36 | 180.0° | 179.9° |
| N10 | C11 | C12 | O33 | 84.9° | 169.4° |
| C11 | N10 | C9 | O29 | 18.6° | 5.1° |
| C11 | N10 | C9 | O8 | 160.1° | 175.0° |
| N10 | C11 | C10 | H1 | 150.7° | 0.0° |
| N10 | C11 | C10 | H2 | 9.5° | 145.1° |
| N10 | C11 | C30 | H25 | 1.3° | 0.0° |
| N10 | C11 | C30 | H26 | 140.5° | 145.0° |
| C12 | C11 | N10 | C9 | 43.9° | 80.4° |
| C12 | C11 | C10 | H1 | 8.7° | 145.0° |
| C12 | C11 | C10 | H2 | 149.9° | 0.0° |
| C12 | C11 | C30 | H25 | 147.0° | 145.0° |
| C12 | C11 | C30 | H26 | 5.2° | 0.0° |
| C12 | C11 | N10 | H36 | 136.1° | 99.5° |
| C11 | C12 | N13 | H37 | 19.0° | 5.0° |
| C2 | C1 | C7 | O8 | 176.5° | 90.1° |
| C1 | C2 | C3 | H24 | 179.2° | 180.0° |
| C2 | C1 | C6 | H31 | 178.8° | 179.9° |
| C2 | C1 | C7 | H32 | 55.0° | 150.0° |
| C2 | C1 | C7 | H33 | 62.1° | 30.0° |
| C1 | C7 | O8 | C9 | 55.2° | 180.0° |
| C1 | C7 | O8 | H32 | 121.5° | 120.0° |
| C1 | C7 | O8 | H33 | 121.4° | 120.0° |
| C7 | C1 | C2 | H12 | 1.2° | 0.1° |
| C7 | C1 | C6 | H31 | 2.0° | 0.2° |
| C1 | C7 | H32 | H33 | 115.3° | 120.0° |
| C23 | C25 | C26 | H20 | 120.1° | 120.0° |
| C23 | C25 | C26 | H21 | 120.1° | 120.0° |
| C25 | C23 | C18 | H8 | 59.9° | 60.0° |
| C25 | C23 | C18 | H9 | 179.7° | 180.0° |
| C25 | C23 | H18 | H19 | 120.7° | 120.0° |
| C23 | C25 | H20 | H21 | 119.6° | 119.9° |
| C23 | C25 | C26 | H22 | 59.4° | 60.0° |
| C23 | C25 | C26 | H23 | 178.7° | 180.0° |
| C14 | C15 | N16 | C17 | 177.8° | 174.3° |
| C15 | C14 | C34 | H27 | 49.8° | 58.7° |
| C15 | C14 | C34 | H28 | 68.3° | 178.6° |
| C15 | C14 | N13 | H37 | 106.3° | 28.8° |
| C14 | C15 | N16 | H38 | 2.2° | 5.6° |
| N10 | C9 | O29 | O8 | 178.6° | 179.9° |
| N10 | C9 | O8 | C7 | 100.4° | 180.0° |
| O33 | C12 | N13 | H37 | 158.2° | 175.0° |
| C15 | N16 | C17 | H38 | 180.0° | 179.9° |
| C15 | N16 | C17 | C8 | 119.7° | 85.1° |
| C15 | N16 | C17 | C19 | 110.6° | 155.0° |
| N16 | C15 | C14 | H4 | 15.3° | 42.6° |
| C15 | N16 | C17 | H7 | 5.0° | 35.0° |
| O29 | C9 | O8 | C7 | 80.9° | 0.1° |
| O29 | C9 | N10 | H36 | 161.4° | 175.0° |
| C22 | C21 | C20 | H14 | 119.3° | 118.1° |
| C22 | C21 | C20 | H15 | 119.3° | 118.1° |
| C21 | C22 | N23 | H16 | 119.1° | 119.0° |
| C21 | C22 | N23 | H17 | 119.1° | 119.0° |
| C22 | C21 | C20 | C19 | 145.7° | 93.9° |
| C22 | C21 | C20 | C24 | 21.6° | 24.8° |
| C21 | C22 | N23 | C24 | 17.5° | 17.0° |
| C22 | C21 | C20 | H13 | 93.3° | 143.5° |
| C22 | C21 | H14 | H15 | 122.0° | 123.8° |
| C21 | C22 | H16 | H17 | 122.6° | 122.0° |
| C21 | C22 | N23 | H39 | 162.6° | 162.9° |
| C20 | C21 | C22 | N23 | 24.1° | 25.4° |
| C21 | C20 | C19 | C17 | 70.3° | 178.8° |
| C21 | C20 | C19 | C24 | 115.6° | 114.7° |
| C21 | C20 | C19 | H13 | 120.9° | 122.7° |
| C21 | C20 | C24 | H13 | 115.0° | 118.8° |
| C21 | C20 | C24 | N23 | 12.1° | 16.2° |
| C21 | C20 | C24 | O26 | 168.2° | 163.8° |
| C21 | C20 | C19 | H10 | 169.0° | 61.2° |
| C21 | C20 | C19 | H11 | 50.4° | 58.9° |
| C20 | C21 | H14 | H15 | 122.0° | 123.8° |
| C20 | C21 | C22 | H16 | 143.2° | 93.5° |
| C20 | C21 | C22 | H17 | 95.0° | 144.4° |
| C9 | O8 | C7 | H32 | 176.7° | 60.0° |
| C9 | O8 | C7 | H33 | 66.3° | 60.0° |
| O8 | C9 | N10 | H36 | 19.9° | 4.9° |
| C22 | N23 | C24 | C20 | 3.4° | 0.4° |
| C22 | N23 | C24 | H39 | 180.0° | 180.0° |
| C22 | N23 | C24 | O26 | 176.3° | 179.6° |
| N23 | C22 | C21 | H14 | 143.4° | 143.5° |
| N23 | C22 | C21 | H15 | 95.3° | 92.7° |
| N23 | C22 | H16 | H17 | 122.6° | 122.0° |
| C25 | C26 | C13 | H3 | 56.3° | 60.0° |
| C26 | C25 | C23 | H18 | 177.7° | 180.0° |
| C26 | C25 | C23 | H19 | 61.8° | 60.0° |
| C26 | C25 | H20 | H21 | 119.6° | 120.0° |
| C25 | C26 | H22 | H23 | 119.0° | 120.0° |
| O8 | C7 | H32 | H33 | 115.3° | 120.0° |
| N16 | C17 | C8 | C19 | 128.7° | 120.0° |
| N16 | C17 | C8 | H7 | 115.3° | 120.0° |
| N16 | C17 | C19 | H7 | 116.1° | 120.0° |
| N16 | C17 | C8 | O9 | 177.6° | 65.0° |
| N16 | C17 | C19 | C20 | 55.2° | 65.1° |
| N16 | C17 | C19 | H10 | 65.5° | 55.0° |
| N16 | C17 | C19 | H11 | 175.9° | 175.0° |
| N16 | C17 | C8 | H34 | 61.3° | 55.0° |
| N16 | C17 | C8 | H35 | 56.6° | 175.0° |
| C8 | C17 | C19 | H7 | 116.1° | 120.0° |
| C17 | C8 | O9 | H34 | 121.1° | 120.0° |
| C17 | C8 | O9 | H35 | 121.1° | 120.0° |
| C8 | C17 | C19 | C20 | 177.0° | 175.0° |
| C8 | C17 | C19 | H10 | 62.3° | 65.0° |
| C8 | C17 | C19 | H11 | 56.3° | 55.1° |
| C17 | C8 | H34 | H35 | 116.6° | 120.0° |
| C8 | C17 | N16 | H38 | 60.3° | 95.0° |
| C17 | C8 | O9 | H40 | 180.0° | 180.0° |
| C19 | C17 | C8 | O9 | 53.7° | 55.0° |
| C17 | C19 | C20 | H10 | 120.7° | 120.0° |
| C17 | C19 | C20 | H11 | 120.7° | 119.9° |
| C17 | C19 | C20 | C24 | 174.1° | 66.5° |
| C17 | C19 | H10 | H11 | 117.8° | 120.0° |
| C17 | C19 | C20 | H13 | 50.6° | 56.1° |
| C19 | C17 | C8 | H34 | 67.4° | 175.0° |
| C19 | C17 | C8 | H35 | 174.7° | 65.1° |
| C19 | C17 | N16 | H38 | 69.4° | 24.9° |
| O9 | C8 | C17 | H7 | 62.4° | 175.0° |
| O9 | C8 | H34 | H35 | 116.6° | 120.0° |
| C19 | C20 | C24 | H13 | 123.7° | 122.5° |
| C19 | C20 | C24 | N23 | 133.4° | 102.4° |
| C19 | C20 | C24 | O26 | 46.9° | 77.6° |
| C20 | C19 | C17 | H7 | 60.9° | 55.0° |
| C20 | C19 | H10 | H11 | 117.8° | 120.0° |
| C19 | C20 | C21 | H14 | 95.0° | 24.3° |
| C19 | C20 | C21 | H15 | 26.4° | 148.0° |
| C20 | C24 | N23 | O26 | 179.7° | 180.0° |
| C24 | C20 | C19 | H10 | 53.4° | 53.5° |
| C24 | C20 | C19 | H11 | 65.2° | 173.6° |
| C24 | C20 | C21 | H14 | 140.9° | 142.9° |
| C24 | C20 | C21 | H15 | 97.7° | 93.3° |
| C20 | C24 | N23 | H39 | 176.6° | 179.5° |
| N23 | C24 | C20 | H13 | 103.0° | 135.1° |
| C24 | N23 | C22 | H16 | 136.6° | 102.0° |
| C24 | N23 | C22 | H17 | 101.6° | 136.0° |
| O26 | C24 | C20 | H13 | 76.8° | 45.0° |
| O26 | C24 | N23 | H39 | 3.6° | 0.5° |
| H1 | C10 | C30 | H25 | 141.6° | 0.0° |
| H1 | C10 | C30 | H26 | 0.3° | 145.0° |
| H2 | C10 | C30 | H25 | 0.3° | 145.0° |
| H2 | C10 | C30 | H26 | 141.6° | 0.1° |
| H3 | C13 | C16 | H5 | 175.3° | 59.9° |
| H3 | C13 | C16 | H6 | 64.8° | 179.9° |
| H3 | C13 | C26 | H22 | 176.6° | 180.0° |
| H3 | C13 | C26 | H23 | 64.1° | 60.0° |
| H3 | C13 | C34 | H27 | 168.2° | 66.7° |
| H3 | C13 | C34 | H28 | 50.1° | 173.4° |
| H4 | C14 | C34 | H27 | 68.1° | 178.6° |
| H4 | C14 | C34 | H28 | 173.7° | 61.4° |
| H4 | C14 | N13 | H37 | 134.7° | 148.8° |
| H5 | C16 | C18 | H8 | 176.1° | 60.0° |
| H5 | C16 | C18 | H9 | 64.0° | 60.0° |
| H6 | C16 | C18 | H8 | 64.0° | 180.0° |
| H6 | C16 | C18 | H9 | 55.9° | 60.0° |
| H7 | C17 | C19 | H10 | 178.4° | 175.0° |
| H7 | C17 | C19 | H11 | 59.8° | 65.0° |
| H7 | C17 | C8 | H34 | 176.5° | 65.0° |
| H7 | C17 | C8 | H35 | 58.7° | 55.0° |
| H7 | C17 | N16 | H38 | 175.0° | 145.0° |
| H8 | C18 | C23 | H18 | 59.9° | 60.0° |
| H8 | C18 | C23 | H19 | 179.6° | 179.9° |
| H9 | C18 | C23 | H18 | 60.0° | 59.9° |
| H9 | C18 | C23 | H19 | 60.6° | 60.1° |
| H10 | C19 | C20 | H13 | 70.1° | 176.1° |
| H11 | C19 | C20 | H13 | 171.3° | 63.8° |
| H12 | C2 | C3 | H24 | 0.8° | 0.1° |
| H13 | C20 | C21 | H14 | 26.0° | 98.3° |
| H13 | C20 | C21 | H15 | 147.4° | 25.4° |
| H14 | C21 | C22 | H16 | 97.5° | 24.6° |
| H14 | C21 | C22 | H17 | 24.3° | 97.5° |
| H15 | C21 | C22 | H16 | 23.8° | 148.3° |
| H15 | C21 | C22 | H17 | 145.6° | 26.3° |
| H16 | C22 | N23 | H39 | 43.4° | 78.1° |
| H17 | C22 | N23 | H39 | 78.4° | 43.9° |
| H18 | C23 | C25 | H20 | 57.6° | 60.0° |
| H18 | C23 | C25 | H21 | 62.2° | 60.0° |
| H19 | C23 | C25 | H20 | 178.1° | 180.0° |
| H19 | C23 | C25 | H21 | 58.3° | 60.0° |
| H20 | C25 | C26 | H22 | 179.6° | 180.0° |
| H20 | C25 | C26 | H23 | 61.1° | 60.0° |
| H21 | C25 | C26 | H22 | 60.7° | 60.0° |
| H21 | C25 | C26 | H23 | 58.6° | 60.0° |
| H24 | C3 | C4 | H29 | 1.3° | 0.3° |
| H29 | C4 | C5 | H30 | 0.6° | 0.2° |
| H30 | C5 | C6 | H31 | 0.7° | 0.2° |
| H34 | C8 | O9 | H40 | 58.9° | 60.0° |
| H35 | C8 | O9 | H40 | 58.9° | 60.0° |
