V9R
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C34 | C30 | sing | 1.53Å | 1.53Å | |
| C34 | C29 | sing | 1.53Å | 1.53Å | |
| C30 | C29 | sing | 1.53Å | 1.53Å | |
| C25 | C26 | doub | 1.38Å | 1.41Å | Aromatic |
| C25 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C28 | sing | 1.38Å | 1.40Å | Aromatic |
| C33 | C27 | sing | 1.53Å | 1.52Å | |
| C17 | C18 | sing | 1.40Å | 1.39Å | |
| C17 | C16 | doub | 1.35Å | 1.38Å | |
| C18 | C19 | doub | 1.37Å | 1.40Å | |
| O26 | C24 | doub | 1.22Å | 1.23Å | |
| C29 | C22 | sing | 1.53Å | 1.54Å | |
| C23 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | N15 | sing | 1.36Å | 1.35Å | |
| C28 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C24 | O25 | sing | 1.35Å | 1.45Å | |
| C24 | N23 | sing | 1.35Å | 1.33Å | |
| C27 | O25 | sing | 1.45Å | 1.44Å | |
| C27 | C32 | sing | 1.53Å | 1.52Å | |
| C27 | C31 | sing | 1.53Å | 1.53Å | |
| C19 | N23 | sing | 1.40Å | 1.34Å | |
| C19 | C21 | sing | 1.41Å | 1.47Å | |
| C22 | C20 | sing | 1.53Å | 1.53Å | |
| N15 | C21 | sing | 1.35Å | 1.42Å | |
| N15 | C20 | sing | 1.47Å | 1.47Å | |
| C15 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.51Å | 1.51Å | |
| C21 | O22 | doub | 1.22Å | 1.26Å | |
| C20 | C36 | sing | 1.51Å | 1.51Å | |
| C13 | N36 | sing | 1.46Å | 1.47Å | |
| C36 | O37 | doub | 1.21Å | 1.23Å | |
| C36 | N38 | sing | 1.35Å | 1.34Å | |
| N36 | C35 | sing | 1.35Å | 1.34Å | |
| N38 | C40 | sing | 1.46Å | 1.44Å | |
| O41 | C35 | doub | 1.21Å | 1.23Å | |
| C35 | C57 | sing | 1.51Å | 1.53Å | |
| C54 | C51 | sing | 1.54Å | 1.54Å | |
| C54 | C45 | sing | 1.55Å | 1.54Å | |
| C40 | C57 | sing | 1.53Å | 1.54Å | |
| C40 | C42 | sing | 1.53Å | 1.54Å | |
| C57 | O40 | sing | 1.43Å | 1.44Å | |
| C51 | N49 | sing | 1.47Å | 1.46Å | |
| C45 | C42 | sing | 1.53Å | 1.54Å | |
| C45 | C47 | sing | 1.51Å | 1.51Å | |
| N49 | C47 | sing | 1.34Å | 1.34Å | |
| C47 | O48 | doub | 1.21Å | 1.22Å | |
| C31 | H1 | sing | 1.09Å | 1.10Å | |
| C31 | H2 | sing | 1.09Å | 1.10Å | |
| C31 | H3 | sing | 1.09Å | 1.10Å | |
| C32 | H4 | sing | 1.09Å | 1.10Å | |
| C32 | H5 | sing | 1.09Å | 1.10Å | |
| C32 | H6 | sing | 1.09Å | 1.10Å | |
| C33 | H7 | sing | 1.09Å | 1.10Å | |
| C33 | H8 | sing | 1.09Å | 1.10Å | |
| C33 | H9 | sing | 1.09Å | 1.10Å | |
| C18 | H10 | sing | 1.08Å | 1.08Å | |
| C17 | H12 | sing | 1.08Å | 1.08Å | |
| C16 | H13 | sing | 1.08Å | 1.08Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C29 | H17 | sing | 1.09Å | 1.10Å | |
| C34 | H18 | sing | 1.09Å | 1.10Å | |
| C34 | H19 | sing | 1.09Å | 1.10Å | |
| C30 | H20 | sing | 1.09Å | 1.10Å | |
| C30 | H21 | sing | 1.09Å | 1.10Å | |
| N38 | H22 | sing | 0.97Å | 1.00Å | |
| C40 | H23 | sing | 1.09Å | 1.10Å | |
| C42 | H24 | sing | 1.09Å | 1.10Å | |
| C42 | H25 | sing | 1.09Å | 1.10Å | |
| C45 | H26 | sing | 1.09Å | 1.10Å | |
| N49 | H27 | sing | 0.97Å | 1.00Å | |
| C51 | H28 | sing | 1.09Å | 1.10Å | |
| C51 | H29 | sing | 1.09Å | 1.10Å | |
| C54 | H30 | sing | 1.09Å | 1.10Å | |
| C54 | H31 | sing | 1.09Å | 1.10Å | |
| C57 | H32 | sing | 1.09Å | 1.10Å | |
| O40 | H33 | sing | 0.97Å | 0.95Å | |
| N36 | H34 | sing | 0.97Å | 1.00Å | |
| C13 | H35 | sing | 1.09Å | 1.10Å | |
| C13 | H36 | sing | 1.09Å | 1.10Å | |
| C28 | H37 | sing | 1.08Å | 1.08Å | |
| C26 | H38 | sing | 1.08Å | 1.08Å | |
| C25 | H39 | sing | 1.08Å | 1.08Å | |
| C23 | H40 | sing | 1.08Å | 1.08Å | |
| C15 | H41 | sing | 1.08Å | 1.08Å | |
| N23 | H42 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C30 | C34 | C29 | 60.1° | 60.0° |
| C34 | C30 | C29 | 59.9° | 60.0° |
| C30 | C34 | H18 | 120.0° | 117.5° |
| C30 | C34 | H19 | 120.0° | 117.4° |
| C34 | C30 | H20 | 120.0° | 117.5° |
| C34 | C30 | H21 | 120.0° | 117.5° |
| C34 | C29 | C30 | 60.0° | 60.1° |
| C34 | C29 | C22 | 115.3° | 117.5° |
| C34 | C29 | H17 | 117.1° | 117.5° |
| C29 | C34 | H18 | 120.0° | 117.5° |
| C29 | C34 | H19 | 120.0° | 117.5° |
| C30 | C29 | C22 | 118.3° | 117.5° |
| C30 | C29 | H17 | 117.0° | 117.5° |
| C29 | C30 | H20 | 120.0° | 117.5° |
| C29 | C30 | H21 | 120.0° | 117.5° |
| C26 | C25 | C23 | 120.4° | 120.0° |
| C25 | C26 | C28 | 120.9° | 120.0° |
| C25 | C26 | H38 | 119.5° | 120.0° |
| C26 | C25 | H39 | 119.8° | 120.0° |
| C25 | C23 | C15 | 119.1° | 120.0° |
| C23 | C25 | H39 | 119.8° | 120.0° |
| C25 | C23 | H40 | 120.5° | 120.0° |
| C26 | C28 | C14 | 118.3° | 120.0° |
| C26 | C28 | H37 | 120.9° | 120.0° |
| C28 | C26 | H38 | 119.6° | 120.0° |
| C33 | C27 | O25 | 108.3° | 109.4° |
| C33 | C27 | C32 | 111.4° | 109.4° |
| C33 | C27 | C31 | 112.9° | 109.5° |
| C27 | C33 | H7 | 109.5° | 109.5° |
| C27 | C33 | H8 | 109.4° | 109.5° |
| C27 | C33 | H9 | 109.5° | 109.5° |
| C18 | C17 | C16 | 120.5° | 120.0° |
| C17 | C18 | C19 | 121.3° | 119.2° |
| C17 | C18 | H10 | 119.3° | 120.3° |
| C18 | C17 | H12 | 119.7° | 120.0° |
| C17 | C16 | N15 | 120.7° | 120.8° |
| C16 | C17 | H12 | 119.8° | 120.0° |
| C17 | C16 | H13 | 119.7° | 119.6° |
| C18 | C19 | N23 | 128.0° | 120.4° |
| C18 | C19 | C21 | 117.9° | 119.2° |
| C19 | C18 | H10 | 119.3° | 120.4° |
| O26 | C24 | O25 | 123.7° | 120.0° |
| O26 | C24 | N23 | 124.7° | 120.0° |
| C29 | C22 | C20 | 107.5° | 109.5° |
| C29 | C22 | H15 | 109.9° | 109.5° |
| C29 | C22 | H16 | 109.9° | 109.5° |
| C22 | C29 | H17 | 116.9° | 115.6° |
| C23 | C15 | C14 | 120.2° | 120.0° |
| C15 | C23 | H40 | 120.4° | 120.0° |
| C23 | C15 | H41 | 119.9° | 120.0° |
| C16 | N15 | C21 | 122.0° | 120.8° |
| C16 | N15 | C20 | 121.1° | 119.6° |
| N15 | C16 | H13 | 119.6° | 119.6° |
| C28 | C14 | C15 | 121.1° | 120.0° |
| C28 | C14 | C13 | 120.3° | 120.0° |
| C14 | C28 | H37 | 120.8° | 120.0° |
| O25 | C24 | N23 | 111.5° | 120.0° |
| C24 | O25 | C27 | 129.8° | 117.0° |
| C24 | N23 | C19 | 125.2° | 120.0° |
| C24 | N23 | H42 | 117.4° | 120.0° |
| O25 | C27 | C32 | 109.0° | 109.5° |
| O25 | C27 | C31 | 106.7° | 109.5° |
| C32 | C27 | C31 | 108.4° | 109.5° |
| C27 | C32 | H4 | 109.5° | 109.5° |
| C27 | C32 | H5 | 109.5° | 109.5° |
| C27 | C32 | H6 | 109.5° | 109.4° |
| C27 | C31 | H1 | 109.5° | 109.5° |
| C27 | C31 | H2 | 109.5° | 109.5° |
| C27 | C31 | H3 | 109.5° | 109.5° |
| N23 | C19 | C21 | 114.1° | 120.4° |
| C19 | N23 | H42 | 117.4° | 120.0° |
| C19 | C21 | N15 | 117.5° | 119.9° |
| C19 | C21 | O22 | 117.0° | 120.0° |
| C22 | C20 | N15 | 112.2° | 109.4° |
| C22 | C20 | C36 | 114.5° | 109.5° |
| C22 | C20 | H14 | 105.6° | 109.5° |
| C20 | C22 | H15 | 110.0° | 109.5° |
| C20 | C22 | H16 | 110.0° | 109.5° |
| C21 | N15 | C20 | 116.8° | 119.6° |
| N15 | C21 | O22 | 125.6° | 120.0° |
| N15 | C20 | C36 | 111.8° | 109.5° |
| N15 | C20 | H14 | 106.2° | 109.5° |
| C15 | C14 | C13 | 118.6° | 120.0° |
| C14 | C15 | H41 | 119.9° | 120.0° |
| C14 | C13 | N36 | 113.5° | 109.5° |
| C14 | C13 | H35 | 108.5° | 109.5° |
| C14 | C13 | H36 | 108.4° | 109.5° |
| C20 | C36 | O37 | 124.1° | 120.0° |
| C20 | C36 | N38 | 107.7° | 120.0° |
| C36 | C20 | H14 | 105.8° | 109.5° |
| C13 | N36 | C35 | 123.0° | 120.0° |
| C13 | N36 | H34 | 118.5° | 120.0° |
| N36 | C13 | H35 | 108.5° | 109.5° |
| N36 | C13 | H36 | 108.5° | 109.5° |
| O37 | C36 | N38 | 128.1° | 120.0° |
| C36 | N38 | C40 | 132.0° | 120.0° |
| C36 | N38 | H22 | 114.0° | 120.0° |
| N36 | C35 | O41 | 123.1° | 120.0° |
| N36 | C35 | C57 | 117.4° | 120.0° |
| C35 | N36 | H34 | 118.5° | 120.0° |
| N38 | C40 | C57 | 109.6° | 109.5° |
| N38 | C40 | C42 | 123.3° | 109.4° |
| C40 | N38 | H22 | 114.0° | 120.0° |
| N38 | C40 | H23 | 103.3° | 109.5° |
| O41 | C35 | C57 | 119.4° | 120.0° |
| C35 | C57 | C40 | 122.0° | 109.5° |
| C35 | C57 | O40 | 109.4° | 109.5° |
| C35 | C57 | H32 | 107.5° | 109.5° |
| C51 | C54 | C45 | 103.9° | 101.7° |
| C54 | C51 | N49 | 104.2° | 105.5° |
| C54 | C51 | H28 | 110.8° | 110.2° |
| C54 | C51 | H29 | 110.8° | 110.3° |
| C51 | C54 | H30 | 110.8° | 111.0° |
| C51 | C54 | H31 | 110.8° | 111.0° |
| C54 | C45 | C42 | 121.9° | 110.5° |
| C54 | C45 | C47 | 103.2° | 104.2° |
| C54 | C45 | H26 | 106.1° | 110.6° |
| C45 | C54 | H30 | 110.8° | 110.9° |
| C45 | C54 | H31 | 110.8° | 111.0° |
| C57 | C40 | C42 | 112.9° | 109.5° |
| C40 | C57 | O40 | 101.2° | 109.5° |
| C57 | C40 | H23 | 102.4° | 109.5° |
| C40 | C57 | H32 | 107.3° | 109.4° |
| C40 | C42 | C45 | 123.2° | 109.5° |
| C42 | C40 | H23 | 102.4° | 109.4° |
| C40 | C42 | H24 | 105.9° | 109.5° |
| C40 | C42 | H25 | 106.0° | 109.5° |
| O40 | C57 | H32 | 108.7° | 109.5° |
| C57 | O40 | H33 | 109.5° | 114.0° |
| C51 | N49 | C47 | 112.9° | 111.3° |
| C51 | N49 | H27 | 123.5° | 124.3° |
| N49 | C51 | H28 | 110.8° | 110.3° |
| N49 | C51 | H29 | 110.8° | 110.2° |
| C42 | C45 | C47 | 112.1° | 110.5° |
| C45 | C42 | H24 | 106.0° | 109.5° |
| C45 | C42 | H25 | 105.9° | 109.5° |
| C42 | C45 | H26 | 106.1° | 110.4° |
| C45 | C47 | N49 | 109.7° | 110.2° |
| C45 | C47 | O48 | 124.5° | 124.9° |
| C47 | C45 | H26 | 106.4° | 110.5° |
| N49 | C47 | O48 | 125.7° | 124.9° |
| C47 | N49 | H27 | 123.6° | 124.4° |
| H1 | C31 | H2 | 109.4° | 109.4° |
| H1 | C31 | H3 | 109.5° | 109.5° |
| H2 | C31 | H3 | 109.5° | 109.4° |
| H4 | C32 | H5 | 109.5° | 109.5° |
| H4 | C32 | H6 | 109.5° | 109.4° |
| H5 | C32 | H6 | 109.4° | 109.5° |
| H7 | C33 | H8 | 109.5° | 109.4° |
| H7 | C33 | H9 | 109.4° | 109.4° |
| H8 | C33 | H9 | 109.5° | 109.4° |
| H15 | C22 | H16 | 109.5° | 109.5° |
| H18 | C34 | H19 | 109.5° | 115.6° |
| H20 | C30 | H21 | 109.5° | 115.6° |
| H24 | C42 | H25 | 109.4° | 109.5° |
| H28 | C51 | H29 | 109.5° | 110.2° |
| H30 | C54 | H31 | 109.5° | 110.9° |
| H35 | C13 | H36 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C30 | C34 | C29 | H18 | 109.5° | 107.5° |
| C30 | C34 | C29 | H19 | 109.5° | 107.4° |
| C34 | C30 | C29 | H20 | 109.4° | 107.5° |
| C34 | C30 | C29 | H21 | 109.4° | 107.5° |
| C30 | C34 | C29 | C22 | 109.4° | 107.5° |
| C30 | C34 | C29 | H17 | 107.1° | 107.5° |
| C30 | C34 | H18 | H19 | 144.7° | 145.6° |
| C34 | C30 | H20 | H21 | 144.8° | 145.7° |
| C34 | C29 | C22 | H17 | 143.5° | 145.6° |
| C34 | C29 | C22 | C20 | 98.2° | 175.1° |
| C34 | C29 | C22 | H15 | 21.5° | 65.0° |
| C34 | C29 | C22 | H16 | 142.1° | 55.1° |
| C29 | C34 | H18 | H19 | 144.7° | 145.8° |
| C30 | C29 | C22 | H17 | 148.4° | 145.7° |
| C30 | C29 | C22 | C20 | 166.3° | 116.2° |
| C30 | C29 | C22 | H15 | 46.6° | 3.7° |
| C30 | C29 | C22 | H16 | 74.0° | 123.7° |
| C29 | C30 | H20 | H21 | 144.8° | 145.7° |
| C26 | C25 | C23 | H39 | 180.0° | 180.0° |
| C25 | C26 | C28 | H38 | 180.0° | 179.9° |
| C26 | C25 | C23 | C15 | 0.2° | 0.2° |
| C25 | C26 | C28 | C14 | 1.3° | 0.0° |
| C25 | C26 | C28 | H37 | 178.7° | 179.9° |
| C26 | C25 | C23 | H40 | 179.8° | 180.0° |
| C23 | C25 | C26 | C28 | 0.2° | 0.0° |
| C25 | C23 | C15 | H40 | 180.0° | 179.9° |
| C25 | C23 | C15 | C14 | 0.5° | 0.5° |
| C23 | C25 | C26 | H38 | 179.8° | 180.0° |
| C25 | C23 | C15 | H41 | 179.5° | 180.0° |
| C26 | C28 | C14 | H37 | 180.0° | 179.9° |
| C26 | C28 | C14 | C15 | 2.0° | 0.3° |
| C26 | C28 | C14 | C13 | 179.9° | 179.9° |
| C28 | C26 | C25 | H39 | 179.8° | 179.9° |
| C33 | C27 | O25 | C24 | 62.7° | 180.0° |
| C33 | C27 | O25 | C32 | 121.3° | 120.0° |
| C33 | C27 | O25 | C31 | 121.8° | 120.0° |
| C33 | C27 | C32 | C31 | 124.8° | 120.0° |
| C33 | C27 | C31 | H1 | 180.0° | 180.0° |
| C33 | C27 | C31 | H2 | 60.0° | 60.0° |
| C33 | C27 | C31 | H3 | 60.0° | 60.0° |
| C33 | C27 | C32 | H4 | 180.0° | 60.0° |
| C33 | C27 | C32 | H5 | 60.0° | 60.0° |
| C33 | C27 | C32 | H6 | 60.0° | 180.0° |
| C27 | C33 | H7 | H8 | 120.0° | 120.1° |
| C27 | C33 | H7 | H9 | 120.0° | 120.0° |
| C27 | C33 | H8 | H9 | 120.0° | 120.0° |
| C18 | C17 | C16 | H12 | 180.0° | 180.0° |
| C17 | C18 | C19 | H10 | 180.0° | 180.0° |
| C18 | C17 | C16 | N15 | 0.2° | 0.2° |
| C17 | C18 | C19 | N23 | 179.7° | 180.0° |
| C17 | C18 | C19 | C21 | 1.2° | 0.2° |
| C18 | C17 | C16 | H13 | 179.8° | 180.0° |
| C16 | C17 | C18 | C19 | 0.0° | 0.0° |
| C17 | C16 | N15 | H13 | 180.0° | 179.8° |
| C17 | C16 | N15 | C21 | 0.9° | 0.2° |
| C17 | C16 | N15 | C20 | 178.5° | 180.0° |
| C16 | C17 | C18 | H10 | 179.9° | 180.0° |
| C18 | C19 | N23 | C24 | 0.4° | 121.5° |
| C18 | C19 | N23 | C21 | 179.1° | 179.8° |
| C18 | C19 | C21 | N15 | 2.1° | 0.2° |
| C18 | C19 | C21 | O22 | 178.8° | 179.7° |
| C19 | C18 | C17 | H12 | 180.0° | 180.0° |
| C18 | C19 | N23 | H42 | 179.6° | 58.6° |
| O26 | C24 | O25 | N23 | 177.4° | 179.8° |
| O26 | C24 | O25 | C27 | 1.4° | 0.0° |
| O26 | C24 | N23 | C19 | 6.4° | 4.8° |
| O26 | C24 | N23 | H42 | 173.6° | 175.1° |
| C29 | C22 | C20 | H15 | 119.7° | 120.0° |
| C29 | C22 | C20 | H16 | 119.7° | 120.0° |
| C29 | C22 | C20 | N15 | 62.8° | 65.0° |
| C29 | C22 | C20 | C36 | 168.5° | 175.0° |
| C29 | C22 | C20 | H14 | 52.5° | 55.0° |
| C29 | C22 | H15 | H16 | 120.9° | 120.0° |
| C22 | C29 | C34 | H18 | 141.1° | 0.1° |
| C22 | C29 | C34 | H19 | 0.0° | 145.0° |
| C22 | C29 | C30 | H20 | 5.0° | 145.1° |
| C22 | C29 | C30 | H21 | 146.1° | 0.0° |
| C23 | C15 | C14 | C28 | 1.6° | 0.5° |
| C23 | C15 | C14 | H41 | 180.0° | 179.5° |
| C23 | C15 | C14 | C13 | 179.7° | 179.7° |
| C15 | C23 | C25 | H39 | 179.8° | 179.8° |
| C16 | N15 | C21 | C19 | 2.0° | 0.0° |
| C16 | N15 | C20 | C22 | 48.3° | 53.9° |
| C16 | N15 | C21 | C20 | 177.7° | 179.8° |
| C16 | N15 | C21 | O22 | 179.0° | 179.9° |
| C16 | N15 | C20 | C36 | 81.8° | 66.1° |
| N15 | C16 | C17 | H12 | 179.8° | 179.7° |
| C16 | N15 | C20 | H14 | 163.2° | 173.8° |
| C28 | C14 | C15 | C13 | 178.2° | 179.8° |
| C28 | C14 | C13 | N36 | 129.2° | 90.0° |
| C28 | C14 | C13 | H35 | 110.1° | 30.0° |
| C28 | C14 | C13 | H36 | 8.7° | 149.9° |
| C14 | C28 | C26 | H38 | 178.7° | 179.9° |
| C28 | C14 | C15 | H41 | 178.4° | 179.9° |
| C24 | O25 | C27 | C32 | 58.6° | 60.0° |
| C24 | O25 | C27 | C31 | 175.4° | 60.0° |
| O25 | C24 | N23 | C19 | 170.9° | 175.0° |
| O25 | C24 | N23 | H42 | 9.1° | 5.1° |
| N23 | C24 | O25 | C27 | 178.8° | 179.7° |
| C24 | N23 | C19 | H42 | 180.0° | 179.9° |
| C24 | N23 | C19 | C21 | 178.7° | 58.7° |
| O25 | C27 | C32 | C31 | 115.7° | 120.0° |
| O25 | C27 | C31 | H1 | 61.1° | 60.0° |
| O25 | C27 | C31 | H2 | 58.8° | 180.0° |
| O25 | C27 | C31 | H3 | 178.8° | 60.0° |
| O25 | C27 | C32 | H4 | 60.6° | 59.9° |
| O25 | C27 | C32 | H5 | 179.4° | 180.0° |
| O25 | C27 | C32 | H6 | 59.5° | 60.0° |
| O25 | C27 | C33 | H7 | 180.0° | 60.0° |
| O25 | C27 | C33 | H8 | 60.0° | 180.0° |
| O25 | C27 | C33 | H9 | 60.0° | 60.0° |
| C32 | C27 | C31 | H1 | 56.1° | 60.0° |
| C32 | C27 | C31 | H2 | 176.1° | 60.0° |
| C32 | C27 | C31 | H3 | 63.9° | 179.9° |
| C27 | C32 | H4 | H5 | 120.0° | 120.1° |
| C27 | C32 | H4 | H6 | 120.0° | 119.9° |
| C27 | C32 | H5 | H6 | 120.0° | 120.0° |
| C32 | C27 | C33 | H7 | 60.1° | 180.0° |
| C32 | C27 | C33 | H8 | 179.9° | 60.0° |
| C32 | C27 | C33 | H9 | 59.9° | 60.0° |
| C27 | C31 | H1 | H2 | 120.0° | 120.0° |
| C27 | C31 | H1 | H3 | 120.0° | 120.1° |
| C27 | C31 | H2 | H3 | 120.0° | 120.0° |
| C31 | C27 | C32 | H4 | 55.2° | 180.0° |
| C31 | C27 | C32 | H5 | 64.8° | 60.0° |
| C31 | C27 | C32 | H6 | 175.2° | 60.0° |
| C31 | C27 | C33 | H7 | 62.1° | 60.0° |
| C31 | C27 | C33 | H8 | 57.9° | 60.0° |
| C31 | C27 | C33 | H9 | 177.9° | 180.0° |
| N23 | C19 | C21 | N15 | 178.7° | 180.0° |
| N23 | C19 | C21 | O22 | 0.4° | 0.1° |
| N23 | C19 | C18 | H10 | 0.3° | 0.0° |
| C19 | C21 | N15 | O22 | 179.0° | 179.9° |
| C19 | C21 | N15 | C20 | 179.7° | 179.8° |
| C21 | C19 | C18 | H10 | 178.8° | 179.8° |
| C21 | C19 | N23 | H42 | 1.3° | 121.2° |
| C22 | C20 | N15 | C21 | 129.4° | 125.9° |
| C22 | C20 | N15 | C36 | 130.2° | 120.0° |
| C22 | C20 | N15 | H14 | 114.9° | 120.0° |
| C22 | C20 | C36 | H14 | 115.9° | 120.0° |
| C22 | C20 | C36 | O37 | 95.2° | 104.7° |
| C22 | C20 | C36 | N38 | 88.5° | 75.3° |
| C20 | C22 | H15 | H16 | 120.9° | 120.0° |
| C20 | C22 | C29 | H17 | 45.4° | 29.5° |
| C21 | N15 | C20 | C36 | 100.5° | 114.1° |
| C21 | N15 | C16 | H13 | 179.1° | 180.0° |
| C21 | N15 | C20 | H14 | 14.5° | 6.0° |
| C20 | N15 | C21 | O22 | 1.3° | 0.3° |
| N15 | C20 | C36 | H14 | 115.2° | 120.0° |
| N15 | C20 | C36 | O37 | 33.8° | 15.2° |
| N15 | C20 | C36 | N38 | 142.6° | 164.7° |
| C20 | N15 | C16 | H13 | 1.5° | 0.2° |
| N15 | C20 | C22 | H15 | 56.9° | 175.0° |
| N15 | C20 | C22 | H16 | 177.5° | 55.0° |
| C15 | C14 | C13 | N36 | 52.6° | 90.3° |
| C15 | C14 | C13 | H35 | 68.0° | 149.7° |
| C15 | C14 | C13 | H36 | 173.2° | 29.8° |
| C15 | C14 | C28 | H37 | 178.0° | 179.8° |
| C14 | C15 | C23 | H40 | 179.5° | 179.7° |
| C14 | C13 | N36 | H35 | 120.6° | 120.0° |
| C14 | C13 | N36 | H36 | 120.6° | 120.0° |
| C14 | C13 | N36 | C35 | 111.0° | 180.0° |
| C14 | C13 | N36 | H34 | 69.0° | 0.0° |
| C14 | C13 | H35 | H36 | 118.1° | 119.9° |
| C13 | C14 | C28 | H37 | 0.1° | 0.0° |
| C13 | C14 | C15 | H41 | 0.3° | 0.2° |
| C20 | C36 | O37 | N38 | 175.6° | 180.0° |
| C20 | C36 | N38 | C40 | 169.8° | 175.0° |
| C36 | C20 | C22 | H15 | 71.8° | 55.0° |
| C36 | C20 | C22 | H16 | 48.8° | 65.0° |
| C20 | C36 | N38 | H22 | 10.2° | 5.0° |
| C13 | N36 | C35 | H34 | 180.0° | 179.9° |
| C13 | N36 | C35 | O41 | 2.8° | 0.1° |
| C13 | N36 | C35 | C57 | 173.8° | 180.0° |
| N36 | C13 | H35 | H36 | 118.2° | 120.0° |
| O37 | C36 | N38 | C40 | 6.4° | 5.0° |
| O37 | C36 | C20 | H14 | 148.9° | 135.3° |
| O37 | C36 | N38 | H22 | 173.7° | 174.9° |
| C36 | N38 | C40 | H22 | 180.0° | 180.0° |
| C36 | N38 | C40 | C57 | 108.3° | 155.2° |
| C36 | N38 | C40 | C42 | 28.3° | 84.8° |
| N38 | C36 | C20 | H14 | 27.4° | 44.7° |
| C36 | N38 | C40 | H23 | 143.1° | 35.2° |
| N36 | C35 | O41 | C57 | 176.5° | 180.0° |
| N36 | C35 | C57 | C40 | 64.7° | 65.8° |
| N36 | C35 | C57 | O40 | 177.6° | 174.2° |
| N36 | C35 | C57 | H32 | 59.8° | 54.2° |
| C35 | N36 | C13 | H35 | 128.4° | 60.0° |
| C35 | N36 | C13 | H36 | 9.6° | 59.9° |
| N38 | C40 | C57 | C35 | 19.7° | 173.2° |
| N38 | C40 | C57 | C42 | 141.5° | 120.0° |
| N38 | C40 | C57 | H23 | 109.2° | 120.1° |
| N38 | C40 | C42 | H23 | 115.3° | 120.0° |
| N38 | C40 | C57 | O40 | 102.0° | 66.8° |
| N38 | C40 | C42 | C45 | 36.0° | 164.3° |
| N38 | C40 | C42 | H24 | 85.9° | 44.3° |
| N38 | C40 | C42 | H25 | 157.9° | 75.6° |
| N38 | C40 | C57 | H32 | 144.2° | 53.1° |
| O41 | C35 | C57 | C40 | 118.6° | 114.2° |
| O41 | C35 | C57 | O40 | 0.9° | 5.8° |
| O41 | C35 | C57 | H32 | 116.9° | 125.8° |
| O41 | C35 | N36 | H34 | 177.2° | 180.0° |
| C35 | C57 | C40 | O40 | 121.7° | 120.0° |
| C35 | C57 | C40 | H32 | 124.5° | 120.0° |
| C35 | C57 | C40 | C42 | 121.8° | 66.8° |
| C35 | C57 | O40 | H32 | 117.1° | 120.0° |
| C35 | C57 | C40 | H23 | 128.8° | 53.1° |
| C35 | C57 | O40 | H33 | 0.4° | 60.0° |
| C57 | C35 | N36 | H34 | 6.2° | 0.1° |
| C51 | C54 | C45 | H30 | 119.1° | 118.1° |
| C51 | C54 | C45 | H31 | 119.1° | 118.1° |
| C54 | C51 | N49 | H28 | 119.2° | 119.0° |
| C54 | C51 | N49 | H29 | 119.2° | 119.1° |
| C51 | C54 | C45 | C42 | 151.0° | 93.9° |
| C51 | C54 | C45 | C47 | 24.1° | 24.8° |
| C54 | C51 | N49 | C47 | 11.0° | 17.0° |
| C51 | C54 | C45 | H26 | 87.7° | 143.5° |
| C54 | C51 | N49 | H27 | 169.0° | 162.9° |
| C54 | C51 | H28 | H29 | 122.4° | 122.0° |
| C51 | C54 | H30 | H31 | 122.6° | 123.8° |
| C54 | C45 | C42 | C40 | 14.2° | 179.9° |
| C45 | C54 | C51 | N49 | 21.6° | 25.4° |
| C54 | C45 | C42 | C47 | 122.8° | 114.8° |
| C54 | C45 | C42 | H26 | 121.4° | 122.7° |
| C54 | C45 | C47 | H26 | 111.5° | 118.8° |
| C54 | C45 | C47 | N49 | 18.6° | 16.3° |
| C54 | C45 | C47 | O48 | 164.0° | 163.8° |
| C54 | C45 | C42 | H24 | 136.1° | 59.9° |
| C54 | C45 | C42 | H25 | 107.6° | 60.1° |
| C45 | C54 | C51 | H28 | 140.8° | 144.5° |
| C45 | C54 | C51 | H29 | 97.5° | 93.6° |
| C45 | C54 | H30 | H31 | 122.6° | 123.8° |
| C57 | C40 | C42 | H23 | 109.3° | 120.0° |
| C40 | C57 | O40 | H32 | 112.8° | 119.9° |
| C57 | C40 | C42 | C45 | 171.4° | 75.6° |
| C57 | C40 | N38 | H22 | 71.7° | 24.8° |
| C57 | C40 | C42 | H24 | 49.5° | 164.4° |
| C57 | C40 | C42 | H25 | 66.7° | 44.4° |
| C40 | C57 | O40 | H33 | 130.5° | 60.1° |
| C42 | C40 | C57 | O40 | 116.5° | 53.2° |
| C40 | C42 | C45 | H24 | 121.9° | 120.0° |
| C40 | C42 | C45 | H25 | 121.9° | 120.0° |
| C40 | C42 | C45 | C47 | 137.1° | 65.1° |
| C42 | C40 | N38 | H22 | 151.7° | 95.3° |
| C40 | C42 | H24 | H25 | 113.8° | 120.0° |
| C40 | C42 | C45 | H26 | 107.1° | 57.4° |
| C42 | C40 | C57 | H32 | 2.7° | 173.1° |
| O40 | C57 | C40 | H23 | 7.2° | 173.1° |
| C51 | N49 | C47 | C45 | 4.9° | 0.3° |
| C51 | N49 | C47 | H27 | 180.0° | 179.9° |
| C51 | N49 | C47 | O48 | 177.7° | 179.5° |
| N49 | C51 | H28 | H29 | 122.4° | 121.9° |
| N49 | C51 | C54 | H30 | 140.7° | 143.5° |
| N49 | C51 | C54 | H31 | 97.5° | 92.7° |
| C42 | C45 | C47 | H26 | 115.6° | 122.5° |
| C42 | C45 | C47 | N49 | 151.5° | 102.4° |
| C42 | C45 | C47 | O48 | 31.1° | 77.5° |
| C45 | C42 | C40 | H23 | 79.3° | 44.4° |
| C45 | C42 | H24 | H25 | 113.8° | 120.0° |
| C42 | C45 | C54 | H30 | 89.9° | 24.2° |
| C42 | C45 | C54 | H31 | 31.8° | 148.0° |
| C45 | C47 | N49 | O48 | 177.3° | 179.9° |
| C47 | C45 | C42 | H24 | 101.0° | 54.9° |
| C47 | C45 | C42 | H25 | 15.2° | 174.9° |
| C45 | C47 | N49 | H27 | 175.1° | 179.6° |
| C47 | C45 | C54 | H30 | 143.2° | 142.9° |
| C47 | C45 | C54 | H31 | 95.1° | 93.3° |
| N49 | C47 | C45 | H26 | 92.9° | 135.1° |
| C47 | N49 | C51 | H28 | 130.2° | 136.0° |
| C47 | N49 | C51 | H29 | 108.2° | 102.1° |
| O48 | C47 | C45 | H26 | 84.5° | 45.0° |
| O48 | C47 | N49 | H27 | 2.2° | 0.6° |
| H1 | C31 | H2 | H3 | 120.0° | 120.0° |
| H4 | C32 | H5 | H6 | 120.0° | 120.0° |
| H7 | C33 | H8 | H9 | 120.0° | 119.9° |
| H10 | C18 | C17 | H12 | 0.1° | 0.0° |
| H12 | C17 | C16 | H13 | 0.2° | 0.0° |
| H14 | C20 | C22 | H15 | 172.2° | 65.0° |
| H14 | C20 | C22 | H16 | 67.2° | 175.0° |
| H15 | C22 | C29 | H17 | 165.1° | 149.5° |
| H16 | C22 | C29 | H17 | 74.4° | 90.5° |
| H17 | C29 | C34 | H18 | 2.4° | 145.0° |
| H17 | C29 | C34 | H19 | 143.5° | 0.1° |
| H17 | C29 | C30 | H20 | 143.4° | 0.0° |
| H17 | C29 | C30 | H21 | 2.2° | 145.0° |
| H18 | C34 | C30 | H20 | 141.1° | 145.0° |
| H18 | C34 | C30 | H21 | 0.1° | 0.0° |
| H19 | C34 | C30 | H20 | 0.0° | 0.0° |
| H19 | C34 | C30 | H21 | 141.1° | 145.0° |
| H22 | N38 | C40 | H23 | 36.8° | 144.8° |
| H23 | C40 | C42 | H24 | 158.8° | 75.6° |
| H23 | C40 | C42 | H25 | 42.6° | 164.4° |
| H23 | C40 | C57 | H32 | 106.7° | 66.9° |
| H24 | C42 | C45 | H26 | 14.8° | 177.4° |
| H25 | C42 | C45 | H26 | 131.0° | 62.6° |
| H26 | C45 | C54 | H30 | 31.5° | 98.4° |
| H26 | C45 | C54 | H31 | 153.2° | 25.4° |
| H27 | N49 | C51 | H28 | 49.8° | 43.9° |
| H27 | N49 | C51 | H29 | 71.9° | 78.0° |
| H28 | C51 | C54 | H30 | 100.1° | 97.5° |
| H28 | C51 | C54 | H31 | 21.7° | 26.3° |
| H29 | C51 | C54 | H30 | 21.6° | 24.4° |
| H29 | C51 | C54 | H31 | 143.3° | 148.3° |
| H32 | C57 | O40 | H33 | 116.7° | 180.0° |
| H34 | N36 | C13 | H35 | 51.6° | 120.1° |
| H34 | N36 | C13 | H36 | 170.4° | 120.0° |
| H37 | C28 | C26 | H38 | 1.3° | 0.0° |
| H38 | C26 | C25 | H39 | 0.2° | 0.0° |
| H39 | C25 | C23 | H40 | 0.1° | 0.0° |
| H40 | C23 | C15 | H41 | 0.5° | 0.1° |
