VHJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C4 | sing | 1.51Å | 1.52Å | |
| C7 | O8 | sing | 1.45Å | 1.43Å | |
| C5 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C1 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| O8 | C9 | sing | 1.35Å | 1.46Å | |
| C1 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C23 | C8 | doub | 1.38Å | 1.39Å | Aromatic |
| C10 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| O29 | C9 | doub | 1.22Å | 1.22Å | |
| C8 | C34 | sing | 1.51Å | 1.51Å | |
| C9 | N10 | sing | 1.35Å | 1.33Å | |
| N10 | C11 | sing | 1.47Å | 1.45Å | |
| C34 | C14 | sing | 1.53Å | 1.52Å | |
| N13 | C14 | sing | 1.46Å | 1.45Å | |
| N13 | C12 | sing | 1.35Å | 1.33Å | |
| C14 | C15 | sing | 1.51Å | 1.50Å | |
| C11 | C12 | sing | 1.51Å | 1.50Å | |
| C11 | C30 | sing | 1.53Å | 1.52Å | |
| C12 | O33 | doub | 1.21Å | 1.22Å | |
| C31 | C30 | sing | 1.53Å | 1.52Å | |
| C30 | C32 | sing | 1.53Å | 1.52Å | |
| C15 | N16 | sing | 1.35Å | 1.33Å | |
| C15 | O38 | doub | 1.21Å | 1.22Å | |
| N16 | C17 | sing | 1.47Å | 1.45Å | |
| C25 | C17 | sing | 1.53Å | 1.53Å | |
| C25 | O1 | sing | 1.43Å | 1.43Å | |
| C17 | C19 | sing | 1.53Å | 1.53Å | |
| O26 | C24 | doub | 1.21Å | 1.22Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C20 | C24 | sing | 1.51Å | 1.50Å | |
| C20 | C21 | sing | 1.55Å | 1.53Å | |
| C24 | N23 | sing | 1.34Å | 1.33Å | |
| C21 | C22 | sing | 1.54Å | 1.53Å | |
| N23 | C22 | sing | 1.47Å | 1.45Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C10 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.08Å | 1.08Å | |
| C14 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.08Å | 1.08Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C18 | H8 | sing | 1.08Å | 1.08Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C19 | H10 | sing | 1.09Å | 1.10Å | |
| C2 | H11 | sing | 1.08Å | 1.08Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.08Å | 1.08Å | |
| C25 | H17 | sing | 1.09Å | 1.10Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C3 | H19 | sing | 1.08Å | 1.08Å | |
| C30 | H20 | sing | 1.09Å | 1.10Å | |
| C31 | H21 | sing | 1.09Å | 1.10Å | |
| C31 | H22 | sing | 1.09Å | 1.10Å | |
| C31 | H23 | sing | 1.09Å | 1.10Å | |
| C32 | H24 | sing | 1.09Å | 1.10Å | |
| C32 | H25 | sing | 1.09Å | 1.10Å | |
| C32 | H26 | sing | 1.09Å | 1.10Å | |
| C34 | H27 | sing | 1.09Å | 1.10Å | |
| C34 | H28 | sing | 1.09Å | 1.10Å | |
| C5 | H29 | sing | 1.08Å | 1.08Å | |
| C6 | H30 | sing | 1.08Å | 1.08Å | |
| C7 | H31 | sing | 1.09Å | 1.10Å | |
| C7 | H32 | sing | 1.09Å | 1.10Å | |
| N10 | H33 | sing | 0.97Å | 1.00Å | |
| N13 | H34 | sing | 0.97Å | 1.00Å | |
| N16 | H35 | sing | 0.97Å | 1.00Å | |
| O1 | H36 | sing | 0.97Å | 0.95Å | |
| C22 | H37 | sing | 1.09Å | 1.10Å | |
| N23 | H38 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | C16 | C13 | 121.3° | 120.0° |
| C16 | C18 | C23 | 120.5° | 120.0° |
| C18 | C16 | H6 | 119.4° | 120.0° |
| C16 | C18 | H8 | 119.7° | 120.0° |
| C16 | C13 | C10 | 117.8° | 120.0° |
| C16 | C13 | H4 | 121.1° | 120.0° |
| C13 | C16 | H6 | 119.3° | 120.0° |
| C18 | C23 | C8 | 118.4° | 120.0° |
| C23 | C18 | H8 | 119.8° | 120.0° |
| C18 | C23 | H16 | 120.8° | 120.0° |
| C13 | C10 | C8 | 121.5° | 120.0° |
| C13 | C10 | H2 | 119.3° | 120.0° |
| C10 | C13 | H4 | 121.1° | 120.0° |
| C4 | C7 | O8 | 112.0° | 109.5° |
| C7 | C4 | C5 | 121.3° | 120.0° |
| C7 | C4 | C3 | 119.8° | 120.0° |
| C4 | C7 | H31 | 108.8° | 109.5° |
| C4 | C7 | H32 | 108.8° | 109.5° |
| C7 | O8 | C9 | 120.4° | 117.0° |
| O8 | C7 | H31 | 108.9° | 109.5° |
| O8 | C7 | H32 | 108.8° | 109.5° |
| C4 | C5 | C6 | 120.7° | 120.0° |
| C5 | C4 | C3 | 118.9° | 120.0° |
| C4 | C5 | H29 | 119.6° | 120.0° |
| C5 | C6 | C1 | 119.9° | 120.0° |
| C6 | C5 | H29 | 119.7° | 120.0° |
| C5 | C6 | H30 | 120.0° | 120.0° |
| C4 | C3 | C2 | 120.8° | 120.0° |
| C4 | C3 | H19 | 119.6° | 120.0° |
| C6 | C1 | C2 | 119.6° | 120.0° |
| C6 | C1 | H1 | 120.2° | 120.0° |
| C1 | C6 | H30 | 120.0° | 120.0° |
| C3 | C2 | C1 | 120.1° | 120.0° |
| C3 | C2 | H11 | 120.0° | 120.0° |
| C2 | C3 | H19 | 119.6° | 120.0° |
| O8 | C9 | O29 | 119.8° | 120.0° |
| O8 | C9 | N10 | 118.0° | 120.0° |
| C2 | C1 | H1 | 120.2° | 120.0° |
| C1 | C2 | H11 | 120.0° | 120.0° |
| C23 | C8 | C10 | 120.6° | 120.0° |
| C23 | C8 | C34 | 121.7° | 120.0° |
| C8 | C23 | H16 | 120.8° | 120.0° |
| C10 | C8 | C34 | 117.7° | 120.0° |
| C8 | C10 | H2 | 119.2° | 120.0° |
| O29 | C9 | N10 | 122.2° | 120.0° |
| C8 | C34 | C14 | 113.7° | 109.4° |
| C8 | C34 | H27 | 108.4° | 109.5° |
| C8 | C34 | H28 | 108.4° | 109.5° |
| C9 | N10 | C11 | 120.7° | 120.0° |
| C9 | N10 | H33 | 119.6° | 120.0° |
| N10 | C11 | C12 | 111.7° | 109.5° |
| N10 | C11 | C30 | 107.7° | 109.5° |
| N10 | C11 | H3 | 109.6° | 109.4° |
| C11 | N10 | H33 | 119.6° | 119.9° |
| C34 | C14 | N13 | 109.9° | 109.5° |
| C34 | C14 | C15 | 104.5° | 109.4° |
| C34 | C14 | H5 | 109.6° | 109.5° |
| C14 | C34 | H27 | 108.4° | 109.5° |
| C14 | C34 | H28 | 108.4° | 109.5° |
| C14 | N13 | C12 | 124.0° | 120.0° |
| N13 | C14 | C15 | 112.0° | 109.4° |
| N13 | C14 | H5 | 110.6° | 109.5° |
| C14 | N13 | H34 | 118.0° | 120.0° |
| N13 | C12 | C11 | 115.1° | 120.0° |
| N13 | C12 | O33 | 124.1° | 120.0° |
| C12 | N13 | H34 | 118.0° | 120.0° |
| C14 | C15 | N16 | 117.5° | 120.0° |
| C14 | C15 | O38 | 120.0° | 120.0° |
| C15 | C14 | H5 | 110.0° | 109.5° |
| C12 | C11 | C30 | 110.2° | 109.5° |
| C11 | C12 | O33 | 120.8° | 120.0° |
| C12 | C11 | H3 | 108.9° | 109.5° |
| C11 | C30 | C31 | 108.6° | 109.5° |
| C11 | C30 | C32 | 111.1° | 109.5° |
| C30 | C11 | H3 | 108.7° | 109.4° |
| C11 | C30 | H20 | 107.9° | 109.5° |
| C31 | C30 | C32 | 113.4° | 109.4° |
| C31 | C30 | H20 | 107.8° | 109.5° |
| C30 | C31 | H21 | 109.5° | 109.5° |
| C30 | C31 | H22 | 109.5° | 109.5° |
| C30 | C31 | H23 | 109.5° | 109.4° |
| C32 | C30 | H20 | 107.8° | 109.5° |
| C30 | C32 | H24 | 109.5° | 109.5° |
| C30 | C32 | H25 | 109.5° | 109.5° |
| C30 | C32 | H26 | 109.5° | 109.5° |
| N16 | C15 | O38 | 122.5° | 120.0° |
| C15 | N16 | C17 | 120.3° | 120.0° |
| C15 | N16 | H35 | 119.8° | 120.0° |
| N16 | C17 | C25 | 110.2° | 109.5° |
| N16 | C17 | C19 | 106.6° | 109.5° |
| N16 | C17 | H7 | 109.5° | 109.5° |
| C17 | N16 | H35 | 119.8° | 120.0° |
| C17 | C25 | O1 | 112.5° | 109.5° |
| C25 | C17 | C19 | 113.5° | 109.5° |
| C25 | C17 | H7 | 108.4° | 109.5° |
| C17 | C25 | H17 | 108.7° | 109.5° |
| C17 | C25 | H18 | 108.7° | 109.5° |
| O1 | C25 | H17 | 108.7° | 109.5° |
| O1 | C25 | H18 | 108.7° | 109.5° |
| C25 | O1 | H36 | 109.5° | 114.0° |
| C17 | C19 | C20 | 109.5° | 109.5° |
| C19 | C17 | H7 | 108.5° | 109.4° |
| C17 | C19 | H9 | 109.4° | 109.5° |
| C17 | C19 | H10 | 109.5° | 109.5° |
| O26 | C24 | C20 | 121.7° | 124.9° |
| O26 | C24 | N23 | 126.6° | 125.0° |
| C19 | C20 | C24 | 109.5° | 110.5° |
| C19 | C20 | C21 | 112.7° | 110.5° |
| C20 | C19 | H9 | 109.5° | 109.5° |
| C20 | C19 | H10 | 109.5° | 109.5° |
| C19 | C20 | H12 | 110.2° | 110.4° |
| C24 | C20 | C21 | 103.7° | 104.2° |
| C20 | C24 | N23 | 111.7° | 110.1° |
| C24 | C20 | H12 | 110.5° | 110.5° |
| C20 | C21 | C22 | 106.4° | 101.8° |
| C21 | C20 | H12 | 110.1° | 110.6° |
| C20 | C21 | H13 | 110.2° | 111.0° |
| C20 | C21 | H14 | 110.2° | 110.9° |
| C24 | N23 | C22 | 112.6° | 111.3° |
| C24 | N23 | H38 | 123.7° | 124.3° |
| C21 | C22 | N23 | 105.2° | 105.5° |
| C22 | C21 | H13 | 110.2° | 111.0° |
| C22 | C21 | H14 | 110.2° | 111.0° |
| C21 | C22 | H15 | 110.5° | 110.3° |
| C21 | C22 | H37 | 110.5° | 110.3° |
| N23 | C22 | H15 | 110.5° | 110.2° |
| N23 | C22 | H37 | 110.6° | 110.3° |
| C22 | N23 | H38 | 123.7° | 124.4° |
| H9 | C19 | H10 | 109.5° | 109.4° |
| H13 | C21 | H14 | 109.5° | 110.9° |
| H15 | C22 | H37 | 109.5° | 110.2° |
| H17 | C25 | H18 | 109.5° | 109.5° |
| H21 | C31 | H22 | 109.4° | 109.5° |
| H21 | C31 | H23 | 109.4° | 109.5° |
| H22 | C31 | H23 | 109.5° | 109.5° |
| H24 | C32 | H25 | 109.5° | 109.4° |
| H24 | C32 | H26 | 109.5° | 109.5° |
| H25 | C32 | H26 | 109.5° | 109.4° |
| H27 | C34 | H28 | 109.5° | 109.5° |
| H31 | C7 | H32 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | C16 | C13 | H6 | 180.0° | 180.0° |
| C16 | C18 | C23 | H8 | 180.0° | 180.0° |
| C18 | C16 | C13 | C10 | 0.1° | 0.1° |
| C16 | C18 | C23 | C8 | 0.3° | 0.0° |
| C18 | C16 | C13 | H4 | 179.9° | 180.0° |
| C16 | C18 | C23 | H16 | 179.7° | 179.9° |
| C13 | C16 | C18 | C23 | 0.2° | 0.0° |
| C16 | C13 | C10 | H4 | 180.0° | 179.9° |
| C16 | C13 | C10 | C8 | 0.1° | 0.1° |
| C16 | C13 | C10 | H2 | 179.8° | 179.8° |
| C13 | C16 | C18 | H8 | 179.8° | 180.0° |
| C18 | C23 | C8 | H16 | 180.0° | 179.9° |
| C18 | C23 | C8 | C10 | 0.3° | 0.0° |
| C18 | C23 | C8 | C34 | 179.9° | 179.8° |
| C23 | C18 | C16 | H6 | 179.8° | 180.0° |
| C13 | C10 | C8 | C23 | 0.3° | 0.0° |
| C13 | C10 | C8 | H2 | 180.0° | 179.6° |
| C13 | C10 | C8 | C34 | 179.9° | 179.7° |
| C10 | C13 | C16 | H6 | 179.9° | 179.9° |
| C4 | C7 | O8 | H31 | 120.4° | 120.0° |
| C4 | C7 | O8 | H32 | 120.4° | 120.0° |
| C7 | C4 | C5 | C3 | 179.4° | 179.9° |
| C7 | C4 | C5 | C6 | 179.7° | 179.8° |
| C7 | C4 | C3 | C2 | 179.9° | 179.9° |
| C4 | C7 | O8 | C9 | 55.5° | 180.0° |
| C7 | C4 | C3 | H19 | 0.1° | 0.0° |
| C7 | C4 | C5 | H29 | 0.3° | 0.1° |
| C4 | C7 | H31 | H32 | 118.8° | 120.0° |
| O8 | C7 | C4 | C5 | 100.9° | 90.1° |
| O8 | C7 | C4 | C3 | 79.7° | 90.0° |
| C7 | O8 | C9 | O29 | 24.4° | 0.1° |
| C7 | O8 | C9 | N10 | 156.6° | 180.0° |
| O8 | C7 | H31 | H32 | 118.8° | 120.0° |
| C4 | C5 | C6 | H29 | 180.0° | 179.7° |
| C4 | C5 | C6 | C1 | 0.4° | 0.6° |
| C5 | C4 | C3 | C2 | 0.5° | 0.0° |
| C5 | C4 | C3 | H19 | 179.5° | 180.0° |
| C4 | C5 | C6 | H30 | 179.6° | 180.0° |
| C5 | C4 | C7 | H31 | 138.7° | 29.9° |
| C5 | C4 | C7 | H32 | 19.4° | 149.9° |
| C6 | C5 | C4 | C3 | 0.4° | 0.3° |
| C5 | C6 | C1 | H30 | 180.0° | 179.5° |
| C5 | C6 | C1 | C2 | 0.5° | 0.6° |
| C5 | C6 | C1 | H1 | 179.5° | 179.7° |
| C4 | C3 | C2 | H19 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.7° | 0.0° |
| C4 | C3 | C2 | H11 | 179.3° | 180.0° |
| C3 | C4 | C5 | H29 | 179.6° | 180.0° |
| C3 | C4 | C7 | H31 | 40.7° | 150.0° |
| C3 | C4 | C7 | H32 | 159.9° | 30.0° |
| C6 | C1 | C2 | C3 | 0.7° | 0.2° |
| C6 | C1 | C2 | H1 | 180.0° | 179.8° |
| C6 | C1 | C2 | H11 | 179.3° | 179.7° |
| C1 | C6 | C5 | H29 | 179.6° | 179.7° |
| C3 | C2 | C1 | H11 | 180.0° | 180.0° |
| C3 | C2 | C1 | H1 | 179.3° | 180.0° |
| O8 | C9 | O29 | N10 | 179.0° | 180.0° |
| O8 | C9 | N10 | C11 | 170.6° | 179.9° |
| C9 | O8 | C7 | H31 | 175.9° | 59.9° |
| C9 | O8 | C7 | H32 | 64.9° | 60.0° |
| O8 | C9 | N10 | H33 | 9.4° | 0.0° |
| C1 | C2 | C3 | H19 | 179.3° | 180.0° |
| C2 | C1 | C6 | H30 | 179.5° | 180.0° |
| C23 | C8 | C10 | C34 | 179.8° | 179.7° |
| C23 | C8 | C34 | C14 | 5.4° | 90.3° |
| C23 | C8 | C10 | H2 | 179.7° | 179.7° |
| C8 | C23 | C18 | H8 | 179.7° | 179.9° |
| C23 | C8 | C34 | H27 | 115.2° | 149.7° |
| C23 | C8 | C34 | H28 | 126.0° | 29.7° |
| C10 | C8 | C34 | C14 | 174.8° | 90.0° |
| C8 | C10 | C13 | H4 | 179.8° | 180.0° |
| C10 | C8 | C23 | H16 | 179.7° | 179.9° |
| C10 | C8 | C34 | H27 | 64.5° | 30.0° |
| C10 | C8 | C34 | H28 | 54.2° | 150.0° |
| O29 | C9 | N10 | C11 | 8.4° | 0.0° |
| O29 | C9 | N10 | H33 | 171.6° | 180.0° |
| C8 | C34 | C14 | H27 | 120.6° | 120.0° |
| C8 | C34 | C14 | H28 | 120.6° | 120.0° |
| C8 | C34 | C14 | N13 | 72.8° | 65.0° |
| C8 | C34 | C14 | C15 | 166.8° | 175.0° |
| C34 | C8 | C10 | H2 | 0.1° | 0.0° |
| C8 | C34 | C14 | H5 | 49.0° | 55.1° |
| C34 | C8 | C23 | H16 | 0.1° | 0.4° |
| C8 | C34 | H27 | H28 | 118.1° | 120.1° |
| C9 | N10 | C11 | H33 | 180.0° | 179.9° |
| C9 | N10 | C11 | C12 | 106.3° | 155.0° |
| C9 | N10 | C11 | C30 | 132.5° | 84.9° |
| C9 | N10 | C11 | H3 | 14.4° | 35.0° |
| N10 | C11 | C12 | N13 | 117.0° | 160.6° |
| N10 | C11 | C12 | C30 | 119.7° | 120.1° |
| N10 | C11 | C12 | H3 | 121.2° | 120.0° |
| N10 | C11 | C30 | H3 | 118.7° | 120.0° |
| N10 | C11 | C12 | O33 | 62.1° | 19.4° |
| N10 | C11 | C30 | C31 | 50.5° | 64.0° |
| N10 | C11 | C30 | C32 | 175.9° | 56.0° |
| N10 | C11 | C30 | H20 | 66.1° | 175.9° |
| C34 | C14 | N13 | C15 | 115.7° | 120.0° |
| C34 | C14 | N13 | H5 | 121.2° | 120.1° |
| C34 | C14 | N13 | C12 | 176.0° | 85.0° |
| C34 | C14 | C15 | H5 | 117.6° | 120.0° |
| C34 | C14 | C15 | N16 | 123.2° | 60.0° |
| C34 | C14 | C15 | O38 | 55.8° | 120.0° |
| C14 | C34 | H27 | H28 | 118.1° | 120.0° |
| C34 | C14 | N13 | H34 | 4.0° | 94.9° |
| C14 | N13 | C12 | H34 | 180.0° | 180.0° |
| N13 | C14 | C15 | H5 | 123.4° | 120.0° |
| C14 | N13 | C12 | C11 | 170.5° | 175.8° |
| C14 | N13 | C12 | O33 | 10.4° | 4.2° |
| N13 | C14 | C15 | N16 | 117.8° | 180.0° |
| N13 | C14 | C15 | O38 | 63.1° | 0.0° |
| N13 | C14 | C34 | H27 | 166.5° | 54.9° |
| N13 | C14 | C34 | H28 | 47.8° | 175.0° |
| C12 | N13 | C14 | C15 | 60.3° | 155.0° |
| N13 | C12 | C11 | O33 | 179.1° | 180.0° |
| N13 | C12 | C11 | C30 | 123.3° | 79.4° |
| N13 | C12 | C11 | H3 | 4.2° | 40.6° |
| C12 | N13 | C14 | H5 | 62.8° | 35.0° |
| C14 | C15 | N16 | O38 | 179.0° | 180.0° |
| C14 | C15 | N16 | C17 | 166.2° | 180.0° |
| C15 | C14 | C34 | H27 | 46.2° | 65.0° |
| C15 | C14 | C34 | H28 | 72.6° | 55.0° |
| C15 | C14 | N13 | H34 | 119.7° | 25.0° |
| C14 | C15 | N16 | H35 | 13.8° | 0.0° |
| C12 | C11 | C30 | H3 | 119.2° | 120.0° |
| C12 | C11 | C30 | C31 | 172.5° | 175.9° |
| C12 | C11 | C30 | C32 | 62.0° | 64.1° |
| C12 | C11 | C30 | H20 | 56.0° | 55.9° |
| C12 | C11 | N10 | H33 | 73.7° | 25.1° |
| C11 | C12 | N13 | H34 | 9.5° | 4.2° |
| C30 | C11 | C12 | O33 | 57.6° | 100.6° |
| C11 | C30 | C31 | C32 | 124.1° | 120.0° |
| C11 | C30 | C31 | H20 | 116.7° | 120.0° |
| C11 | C30 | C32 | H20 | 118.0° | 120.0° |
| C11 | C30 | C31 | H21 | 180.0° | 65.9° |
| C11 | C30 | C31 | H22 | 60.0° | 174.1° |
| C11 | C30 | C31 | H23 | 60.0° | 54.1° |
| C11 | C30 | C32 | H24 | 180.0° | 60.0° |
| C11 | C30 | C32 | H25 | 60.0° | 180.0° |
| C11 | C30 | C32 | H26 | 60.0° | 60.0° |
| C30 | C11 | N10 | H33 | 47.4° | 95.0° |
| O33 | C12 | C11 | H3 | 176.7° | 139.4° |
| O33 | C12 | N13 | H34 | 169.6° | 175.8° |
| C31 | C30 | C32 | H20 | 119.3° | 120.0° |
| C31 | C30 | C11 | H3 | 68.2° | 55.9° |
| C30 | C31 | H21 | H22 | 120.0° | 120.0° |
| C30 | C31 | H21 | H23 | 120.0° | 120.0° |
| C30 | C31 | H22 | H23 | 120.0° | 120.0° |
| C31 | C30 | C32 | H24 | 57.3° | 180.0° |
| C31 | C30 | C32 | H25 | 177.3° | 60.0° |
| C31 | C30 | C32 | H26 | 62.7° | 60.0° |
| C32 | C30 | C11 | H3 | 57.2° | 175.9° |
| C32 | C30 | C31 | H21 | 55.9° | 54.1° |
| C32 | C30 | C31 | H22 | 64.0° | 65.9° |
| C32 | C30 | C31 | H23 | 175.9° | 174.1° |
| C30 | C32 | H24 | H25 | 120.0° | 120.0° |
| C30 | C32 | H24 | H26 | 120.0° | 120.1° |
| C30 | C32 | H25 | H26 | 120.0° | 120.0° |
| C15 | N16 | C17 | H35 | 180.0° | 180.0° |
| C15 | N16 | C17 | C25 | 107.8° | 85.0° |
| C15 | N16 | C17 | C19 | 128.5° | 155.0° |
| N16 | C15 | C14 | H5 | 5.6° | 60.0° |
| C15 | N16 | C17 | H7 | 11.3° | 35.0° |
| O38 | C15 | N16 | C17 | 12.8° | 0.0° |
| O38 | C15 | C14 | H5 | 173.4° | 120.0° |
| O38 | C15 | N16 | H35 | 167.2° | 180.0° |
| N16 | C17 | C25 | C19 | 119.5° | 120.1° |
| N16 | C17 | C25 | H7 | 119.8° | 120.0° |
| N16 | C17 | C25 | O1 | 172.0° | 65.0° |
| N16 | C17 | C19 | H7 | 117.9° | 120.0° |
| N16 | C17 | C19 | C20 | 53.3° | 65.0° |
| N16 | C17 | C19 | H9 | 66.7° | 55.0° |
| N16 | C17 | C19 | H10 | 173.3° | 175.0° |
| N16 | C17 | C25 | H17 | 67.6° | 55.0° |
| N16 | C17 | C25 | H18 | 51.5° | 175.0° |
| C17 | C25 | O1 | H17 | 120.4° | 120.0° |
| C17 | C25 | O1 | H18 | 120.4° | 120.0° |
| C25 | C17 | C19 | H7 | 120.6° | 120.0° |
| C25 | C17 | C19 | C20 | 174.9° | 175.0° |
| C25 | C17 | C19 | H9 | 54.8° | 65.0° |
| C25 | C17 | C19 | H10 | 65.1° | 54.9° |
| C17 | C25 | H17 | H18 | 118.6° | 120.0° |
| C25 | C17 | N16 | H35 | 72.2° | 95.0° |
| C17 | C25 | O1 | H36 | 180.0° | 180.0° |
| O1 | C25 | C17 | C19 | 68.5° | 55.0° |
| O1 | C25 | C17 | H7 | 52.1° | 175.0° |
| O1 | C25 | H17 | H18 | 118.6° | 120.0° |
| C17 | C19 | C20 | H9 | 120.0° | 120.0° |
| C17 | C19 | C20 | H10 | 120.0° | 120.1° |
| C17 | C19 | C20 | C24 | 162.6° | 66.4° |
| C17 | C19 | C20 | C21 | 82.5° | 178.8° |
| C17 | C19 | H9 | H10 | 120.0° | 120.0° |
| C17 | C19 | C20 | H12 | 40.9° | 56.1° |
| C19 | C17 | C25 | H17 | 51.9° | 175.1° |
| C19 | C17 | C25 | H18 | 171.0° | 65.0° |
| C19 | C17 | N16 | H35 | 51.5° | 25.0° |
| O26 | C24 | C20 | C19 | 53.4° | 77.6° |
| O26 | C24 | C20 | N23 | 180.0° | 180.0° |
| O26 | C24 | C20 | C21 | 173.8° | 163.8° |
| O26 | C24 | N23 | C22 | 176.2° | 179.6° |
| O26 | C24 | C20 | H12 | 68.2° | 45.0° |
| O26 | C24 | N23 | H38 | 3.7° | 0.3° |
| C19 | C20 | C24 | C21 | 120.5° | 118.7° |
| C19 | C20 | C24 | H12 | 121.5° | 122.5° |
| C19 | C20 | C21 | H12 | 123.4° | 122.6° |
| C19 | C20 | C24 | N23 | 126.6° | 102.4° |
| C19 | C20 | C21 | C22 | 124.3° | 93.9° |
| C20 | C19 | C17 | H7 | 64.5° | 55.0° |
| C20 | C19 | H9 | H10 | 120.0° | 120.0° |
| C19 | C20 | C21 | H13 | 4.8° | 24.2° |
| C19 | C20 | C21 | H14 | 116.2° | 148.0° |
| C24 | C20 | C21 | H12 | 118.3° | 118.7° |
| C24 | C20 | C21 | C22 | 6.0° | 24.8° |
| C20 | C24 | N23 | C22 | 3.7° | 0.4° |
| C24 | C20 | C19 | H9 | 42.6° | 53.6° |
| C24 | C20 | C19 | H10 | 77.4° | 173.5° |
| C24 | C20 | C21 | H13 | 113.5° | 142.9° |
| C24 | C20 | C21 | H14 | 125.5° | 93.3° |
| C20 | C24 | N23 | H38 | 176.3° | 179.7° |
| C21 | C20 | C24 | N23 | 6.1° | 16.2° |
| C20 | C21 | C22 | H13 | 119.5° | 118.1° |
| C20 | C21 | C22 | H14 | 119.5° | 118.1° |
| C20 | C21 | C22 | N23 | 4.2° | 25.4° |
| C21 | C20 | C19 | H9 | 157.5° | 61.2° |
| C21 | C20 | C19 | H10 | 37.5° | 58.7° |
| C20 | C21 | H13 | H14 | 121.4° | 123.8° |
| C20 | C21 | C22 | H15 | 123.5° | 93.6° |
| C20 | C21 | C22 | H37 | 115.2° | 144.5° |
| C24 | N23 | C22 | C21 | 0.4° | 17.1° |
| C24 | N23 | C22 | H38 | 180.0° | 179.9° |
| N23 | C24 | C20 | H12 | 111.9° | 135.0° |
| C24 | N23 | C22 | H15 | 119.7° | 102.0° |
| C24 | N23 | C22 | H37 | 118.9° | 136.1° |
| C21 | C22 | N23 | H15 | 119.3° | 119.1° |
| C21 | C22 | N23 | H37 | 119.3° | 119.1° |
| C22 | C21 | C20 | H12 | 112.3° | 143.5° |
| C22 | C21 | H13 | H14 | 121.4° | 123.9° |
| C21 | C22 | H15 | H37 | 122.0° | 122.0° |
| C21 | C22 | N23 | H38 | 179.6° | 163.1° |
| N23 | C22 | C21 | H13 | 115.3° | 143.6° |
| N23 | C22 | C21 | H14 | 123.7° | 92.6° |
| N23 | C22 | H15 | H37 | 122.0° | 121.9° |
| H1 | C1 | C2 | H11 | 0.7° | 0.0° |
| H1 | C1 | C6 | H30 | 0.5° | 0.2° |
| H2 | C10 | C13 | H4 | 0.2° | 0.4° |
| H3 | C11 | C30 | H20 | 175.2° | 64.1° |
| H3 | C11 | N10 | H33 | 165.6° | 145.0° |
| H4 | C13 | C16 | H6 | 0.1° | 0.1° |
| H5 | C14 | C34 | H27 | 71.7° | 175.0° |
| H5 | C14 | C34 | H28 | 169.6° | 65.0° |
| H5 | C14 | N13 | H34 | 117.2° | 145.0° |
| H6 | C16 | C18 | H8 | 0.2° | 0.1° |
| H7 | C17 | C19 | H9 | 175.4° | 175.0° |
| H7 | C17 | C19 | H10 | 55.5° | 65.1° |
| H7 | C17 | C25 | H17 | 172.6° | 65.0° |
| H7 | C17 | C25 | H18 | 68.3° | 55.0° |
| H7 | C17 | N16 | H35 | 168.7° | 145.0° |
| H8 | C18 | C23 | H16 | 0.3° | 0.0° |
| H9 | C19 | C20 | H12 | 79.1° | 176.1° |
| H10 | C19 | C20 | H12 | 160.9° | 64.0° |
| H11 | C2 | C3 | H19 | 0.7° | 0.0° |
| H12 | C20 | C21 | H13 | 128.2° | 98.4° |
| H12 | C20 | C21 | H14 | 7.2° | 25.4° |
| H13 | C21 | C22 | H15 | 4.0° | 24.5° |
| H13 | C21 | C22 | H37 | 125.3° | 97.4° |
| H14 | C21 | C22 | H15 | 117.0° | 148.3° |
| H14 | C21 | C22 | H37 | 4.3° | 26.4° |
| H15 | C22 | N23 | H38 | 60.3° | 77.9° |
| H17 | C25 | O1 | H36 | 59.5° | 60.0° |
| H18 | C25 | O1 | H36 | 59.6° | 60.0° |
| H20 | C30 | C31 | H21 | 63.4° | 174.1° |
| H20 | C30 | C31 | H22 | 176.7° | 54.0° |
| H20 | C30 | C31 | H23 | 56.7° | 65.9° |
| H20 | C30 | C32 | H24 | 61.9° | 60.0° |
| H20 | C30 | C32 | H25 | 58.1° | 60.0° |
| H20 | C30 | C32 | H26 | 178.0° | 180.0° |
| H21 | C31 | H22 | H23 | 119.9° | 120.0° |
| H24 | C32 | H25 | H26 | 120.0° | 119.9° |
| H29 | C5 | C6 | H30 | 0.4° | 0.2° |
| H37 | C22 | N23 | H38 | 61.1° | 44.0° |
