VJA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | doub | 1.38Å | 1.40Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C37 | C35 | sing | 1.53Å | 1.54Å | |
| O29 | C9 | doub | 1.21Å | 1.22Å | |
| C6 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C31 | C30 | sing | 1.53Å | 1.53Å | |
| C4 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C7 | sing | 1.51Å | 1.51Å | |
| C32 | C30 | sing | 1.53Å | 1.52Å | |
| C35 | C34 | sing | 1.53Å | 1.53Å | |
| C35 | C36 | sing | 1.53Å | 1.53Å | |
| C34 | C14 | sing | 1.53Å | 1.53Å | |
| C11 | C30 | sing | 1.53Å | 1.51Å | |
| C11 | N10 | sing | 1.47Å | 1.43Å | |
| C11 | C12 | sing | 1.51Å | 1.50Å | |
| N13 | C14 | sing | 1.46Å | 1.46Å | |
| N13 | C12 | sing | 1.35Å | 1.33Å | |
| O38 | C15 | doub | 1.21Å | 1.22Å | |
| C9 | N10 | sing | 1.35Å | 1.32Å | |
| C9 | O8 | sing | 1.35Å | 1.45Å | |
| C7 | O8 | sing | 1.45Å | 1.42Å | |
| C14 | C15 | sing | 1.51Å | 1.51Å | |
| C12 | O33 | doub | 1.21Å | 1.22Å | |
| C15 | N16 | sing | 1.35Å | 1.34Å | |
| O11 | C10 | sing | 1.43Å | 1.44Å | |
| N16 | C17 | sing | 1.46Å | 1.47Å | |
| C21 | C22 | sing | 1.54Å | 1.52Å | |
| C21 | C20 | sing | 1.55Å | 1.52Å | |
| C10 | C17 | sing | 1.53Å | 1.53Å | |
| C22 | N23 | sing | 1.47Å | 1.45Å | |
| C17 | C19 | sing | 1.53Å | 1.53Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C20 | C24 | sing | 1.51Å | 1.50Å | |
| N23 | C24 | sing | 1.34Å | 1.33Å | |
| C24 | O26 | doub | 1.21Å | 1.22Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C14 | H5 | sing | 1.09Å | 1.10Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C19 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C2 | H9 | sing | 1.08Å | 1.08Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C3 | H15 | sing | 1.08Å | 1.08Å | |
| C30 | H16 | sing | 1.09Å | 1.10Å | |
| C31 | H17 | sing | 1.09Å | 1.10Å | |
| C31 | H18 | sing | 1.09Å | 1.10Å | |
| C31 | H19 | sing | 1.09Å | 1.10Å | |
| C32 | H20 | sing | 1.09Å | 1.10Å | |
| C32 | H21 | sing | 1.09Å | 1.10Å | |
| C32 | H22 | sing | 1.09Å | 1.10Å | |
| C34 | H23 | sing | 1.09Å | 1.10Å | |
| C34 | H24 | sing | 1.09Å | 1.10Å | |
| C35 | H25 | sing | 1.09Å | 1.10Å | |
| C36 | H26 | sing | 1.09Å | 1.10Å | |
| C36 | H27 | sing | 1.09Å | 1.10Å | |
| C36 | H28 | sing | 1.09Å | 1.10Å | |
| C37 | H29 | sing | 1.09Å | 1.10Å | |
| C37 | H30 | sing | 1.09Å | 1.10Å | |
| C37 | H31 | sing | 1.09Å | 1.10Å | |
| C5 | H32 | sing | 1.08Å | 1.08Å | |
| C6 | H33 | sing | 1.08Å | 1.08Å | |
| C7 | H34 | sing | 1.09Å | 1.10Å | |
| C7 | 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 | |
| O11 | H40 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 119.0° | 120.0° |
| C2 | C1 | C6 | 120.2° | 120.0° |
| C2 | C1 | H1 | 119.9° | 120.0° |
| C1 | C2 | H9 | 120.5° | 120.0° |
| C2 | C3 | C4 | 121.0° | 120.0° |
| C3 | C2 | H9 | 120.5° | 120.0° |
| C2 | C3 | H15 | 119.5° | 120.0° |
| C1 | C6 | C5 | 120.1° | 120.1° |
| C6 | C1 | H1 | 119.9° | 120.0° |
| C1 | C6 | H33 | 119.9° | 120.0° |
| C3 | C4 | C5 | 119.4° | 120.0° |
| C3 | C4 | C7 | 121.1° | 120.0° |
| C4 | C3 | H15 | 119.5° | 120.0° |
| C37 | C35 | C34 | 111.3° | 109.5° |
| C37 | C35 | C36 | 111.9° | 109.5° |
| C37 | C35 | H25 | 107.0° | 109.5° |
| C35 | C37 | H29 | 109.5° | 109.5° |
| C35 | C37 | H30 | 109.5° | 109.5° |
| C35 | C37 | H31 | 109.5° | 109.5° |
| O29 | C9 | N10 | 123.3° | 120.0° |
| O29 | C9 | O8 | 120.6° | 120.0° |
| C6 | C5 | C4 | 120.3° | 120.0° |
| C6 | C5 | H32 | 119.8° | 120.1° |
| C5 | C6 | H33 | 120.0° | 119.9° |
| C31 | C30 | C32 | 113.0° | 109.5° |
| C31 | C30 | C11 | 108.5° | 109.4° |
| C31 | C30 | H16 | 107.8° | 109.4° |
| C30 | C31 | H17 | 109.5° | 109.5° |
| C30 | C31 | H18 | 109.4° | 109.5° |
| C30 | C31 | H19 | 109.5° | 109.5° |
| C5 | C4 | C7 | 119.5° | 120.0° |
| C4 | C5 | H32 | 119.8° | 120.0° |
| C4 | C7 | O8 | 112.6° | 109.5° |
| C4 | C7 | H34 | 108.7° | 109.4° |
| C4 | C7 | H35 | 108.7° | 109.5° |
| C32 | C30 | C11 | 111.5° | 109.5° |
| C32 | C30 | H16 | 107.9° | 109.5° |
| C30 | C32 | H20 | 109.5° | 109.4° |
| C30 | C32 | H21 | 109.4° | 109.5° |
| C30 | C32 | H22 | 109.5° | 109.5° |
| C34 | C35 | C36 | 112.1° | 109.5° |
| C35 | C34 | C14 | 111.6° | 109.5° |
| C35 | C34 | H23 | 108.9° | 109.5° |
| C35 | C34 | H24 | 108.9° | 109.5° |
| C34 | C35 | H25 | 107.1° | 109.4° |
| C36 | C35 | H25 | 107.1° | 109.5° |
| C35 | C36 | H26 | 109.5° | 109.4° |
| C35 | C36 | H27 | 109.5° | 109.5° |
| C35 | C36 | H28 | 109.5° | 109.5° |
| C34 | C14 | N13 | 109.3° | 109.5° |
| C34 | C14 | C15 | 110.7° | 109.4° |
| C34 | C14 | H5 | 108.0° | 109.4° |
| C14 | C34 | H23 | 108.9° | 109.4° |
| C14 | C34 | H24 | 108.9° | 109.5° |
| C30 | C11 | N10 | 104.6° | 109.5° |
| C30 | C11 | C12 | 111.1° | 109.5° |
| C30 | C11 | H4 | 110.2° | 109.5° |
| C11 | C30 | H16 | 108.0° | 109.5° |
| N10 | C11 | C12 | 108.9° | 109.5° |
| C11 | N10 | C9 | 122.6° | 120.0° |
| N10 | C11 | H4 | 111.4° | 109.5° |
| C11 | N10 | H36 | 118.7° | 120.0° |
| C11 | C12 | N13 | 117.6° | 120.0° |
| C11 | C12 | O33 | 120.6° | 120.0° |
| C12 | C11 | H4 | 110.4° | 109.5° |
| C14 | N13 | C12 | 120.3° | 120.0° |
| N13 | C14 | C15 | 111.8° | 109.5° |
| N13 | C14 | H5 | 108.8° | 109.5° |
| C14 | N13 | H37 | 119.9° | 120.0° |
| N13 | C12 | O33 | 121.8° | 120.0° |
| C12 | N13 | H37 | 119.8° | 120.0° |
| O38 | C15 | C14 | 119.9° | 120.0° |
| O38 | C15 | N16 | 125.7° | 120.0° |
| N10 | C9 | O8 | 116.0° | 120.0° |
| C9 | N10 | H36 | 118.7° | 120.1° |
| C9 | O8 | C7 | 120.7° | 117.0° |
| O8 | C7 | H34 | 108.7° | 109.4° |
| O8 | C7 | H35 | 108.7° | 109.5° |
| C14 | C15 | N16 | 114.4° | 120.0° |
| C15 | C14 | H5 | 108.1° | 109.5° |
| C15 | N16 | C17 | 132.3° | 120.0° |
| C15 | N16 | H38 | 113.8° | 120.0° |
| O11 | C10 | C17 | 110.2° | 109.5° |
| O11 | C10 | H2 | 109.3° | 109.5° |
| O11 | C10 | H3 | 109.3° | 109.5° |
| C10 | O11 | H40 | 109.5° | 114.0° |
| N16 | C17 | C10 | 116.4° | 109.4° |
| N16 | C17 | C19 | 112.1° | 109.5° |
| N16 | C17 | H6 | 105.6° | 109.5° |
| C17 | N16 | H38 | 113.9° | 120.0° |
| C22 | C21 | C20 | 105.1° | 101.8° |
| C21 | C22 | N23 | 105.1° | 105.5° |
| C22 | C21 | H11 | 110.5° | 111.0° |
| C22 | C21 | H12 | 110.6° | 111.0° |
| C21 | C22 | H13 | 110.5° | 110.2° |
| C21 | C22 | H14 | 110.6° | 110.3° |
| C21 | C20 | C19 | 108.8° | 110.5° |
| C21 | C20 | C24 | 104.1° | 104.2° |
| C21 | C20 | H10 | 110.2° | 110.6° |
| C20 | C21 | H11 | 110.6° | 111.0° |
| C20 | C21 | H12 | 110.5° | 110.9° |
| C10 | C17 | C19 | 111.7° | 109.4° |
| C17 | C10 | H2 | 109.3° | 109.5° |
| C17 | C10 | H3 | 109.3° | 109.5° |
| C10 | C17 | H6 | 104.9° | 109.5° |
| C22 | N23 | C24 | 112.6° | 111.3° |
| N23 | C22 | H13 | 110.5° | 110.2° |
| N23 | C22 | H14 | 110.6° | 110.3° |
| C22 | N23 | H39 | 123.7° | 124.4° |
| C17 | C19 | C20 | 111.2° | 109.4° |
| C19 | C17 | H6 | 105.0° | 109.5° |
| C17 | C19 | H7 | 109.0° | 109.5° |
| C17 | C19 | H8 | 109.1° | 109.5° |
| C19 | C20 | C24 | 112.8° | 110.5° |
| C20 | C19 | H7 | 109.0° | 109.5° |
| C20 | C19 | H8 | 109.0° | 109.5° |
| C19 | C20 | H10 | 110.2° | 110.5° |
| C20 | C24 | N23 | 110.8° | 110.2° |
| C20 | C24 | O26 | 124.2° | 124.9° |
| C24 | C20 | H10 | 110.5° | 110.5° |
| N23 | C24 | O26 | 125.1° | 124.9° |
| C24 | N23 | H39 | 123.7° | 124.4° |
| H2 | C10 | H3 | 109.5° | 109.4° |
| H7 | C19 | H8 | 109.5° | 109.5° |
| H11 | C21 | H12 | 109.5° | 110.9° |
| H13 | C22 | H14 | 109.5° | 110.3° |
| H17 | C31 | H18 | 109.5° | 109.5° |
| H17 | C31 | H19 | 109.5° | 109.4° |
| H18 | C31 | H19 | 109.5° | 109.4° |
| H20 | C32 | H21 | 109.5° | 109.5° |
| H20 | C32 | H22 | 109.5° | 109.5° |
| H21 | C32 | H22 | 109.5° | 109.5° |
| H23 | C34 | H24 | 109.5° | 109.5° |
| H26 | C36 | H27 | 109.5° | 109.5° |
| H26 | C36 | H28 | 109.5° | 109.5° |
| H27 | C36 | H28 | 109.4° | 109.5° |
| H29 | C37 | H30 | 109.4° | 109.5° |
| H29 | C37 | H31 | 109.5° | 109.5° |
| H30 | C37 | H31 | 109.5° | 109.5° |
| H34 | C7 | H35 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | H9 | 180.0° | 179.9° |
| C2 | C1 | C6 | H1 | 180.0° | 179.7° |
| C1 | C2 | C3 | C4 | 0.2° | 0.1° |
| C2 | C1 | C6 | C5 | 0.8° | 0.1° |
| C1 | C2 | C3 | H15 | 179.8° | 179.9° |
| C2 | C1 | C6 | H33 | 179.2° | 179.7° |
| C3 | C2 | C1 | C6 | 0.5° | 0.1° |
| C2 | C3 | C4 | H15 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.7° | 0.0° |
| C2 | C3 | C4 | C7 | 179.4° | 180.0° |
| C3 | C2 | C1 | H1 | 179.4° | 179.7° |
| C1 | C6 | C5 | H33 | 180.0° | 179.7° |
| C1 | C6 | C5 | C4 | 0.3° | 0.1° |
| C6 | C1 | C2 | H9 | 179.4° | 180.0° |
| C1 | C6 | C5 | H32 | 179.7° | 180.0° |
| C3 | C4 | C5 | C6 | 0.5° | 0.1° |
| C3 | C4 | C5 | C7 | 179.8° | 179.9° |
| C3 | C4 | C7 | O8 | 100.5° | 90.1° |
| C4 | C3 | C2 | H9 | 179.8° | 180.0° |
| C3 | C4 | C5 | H32 | 179.5° | 179.9° |
| C3 | C4 | C7 | H34 | 139.0° | 150.0° |
| C3 | C4 | C7 | H35 | 19.9° | 30.0° |
| C37 | C35 | C34 | C36 | 126.2° | 120.0° |
| C37 | C35 | C34 | H25 | 116.6° | 120.0° |
| C37 | C35 | C36 | H25 | 117.0° | 120.0° |
| C37 | C35 | C34 | C14 | 173.1° | 173.5° |
| C37 | C35 | C34 | H23 | 66.5° | 66.6° |
| C37 | C35 | C34 | H24 | 52.8° | 53.4° |
| C37 | C35 | C36 | H26 | 180.0° | 55.9° |
| C37 | C35 | C36 | H27 | 60.0° | 64.1° |
| C37 | C35 | C36 | H28 | 60.0° | 175.9° |
| C35 | C37 | H29 | H30 | 120.0° | 120.0° |
| C35 | C37 | H29 | H31 | 120.0° | 120.0° |
| C35 | C37 | H30 | H31 | 120.0° | 120.0° |
| O29 | C9 | N10 | C11 | 14.1° | 0.0° |
| O29 | C9 | N10 | O8 | 179.2° | 180.0° |
| O29 | C9 | O8 | C7 | 45.2° | 0.0° |
| O29 | C9 | N10 | H36 | 165.9° | 180.0° |
| C6 | C5 | C4 | H32 | 180.0° | 179.9° |
| C6 | C5 | C4 | C7 | 179.7° | 179.9° |
| C5 | C6 | C1 | H1 | 179.2° | 179.6° |
| C31 | C30 | C32 | C11 | 122.5° | 120.0° |
| C31 | C30 | C32 | H16 | 119.1° | 120.0° |
| C31 | C30 | C11 | H16 | 116.6° | 119.9° |
| C31 | C30 | C11 | N10 | 57.0° | 179.7° |
| C31 | C30 | C11 | C12 | 174.4° | 59.7° |
| C31 | C30 | C11 | H4 | 62.8° | 60.3° |
| C30 | C31 | H17 | H18 | 120.0° | 120.0° |
| C30 | C31 | H17 | H19 | 120.0° | 120.0° |
| C30 | C31 | H18 | H19 | 120.0° | 120.0° |
| C31 | C30 | C32 | H20 | 180.0° | 180.0° |
| C31 | C30 | C32 | H21 | 60.0° | 60.0° |
| C31 | C30 | C32 | H22 | 60.0° | 60.0° |
| C5 | C4 | C7 | O8 | 79.3° | 90.0° |
| C5 | C4 | C3 | H15 | 179.3° | 180.0° |
| C4 | C5 | C6 | H33 | 179.8° | 179.8° |
| C5 | C4 | C7 | H34 | 41.2° | 29.9° |
| C5 | C4 | C7 | H35 | 160.3° | 150.0° |
| C4 | C7 | O8 | C9 | 48.1° | 180.0° |
| C4 | C7 | O8 | H34 | 120.5° | 119.9° |
| C4 | C7 | O8 | H35 | 120.5° | 120.1° |
| C7 | C4 | C3 | H15 | 0.6° | 0.0° |
| C7 | C4 | C5 | H32 | 0.3° | 0.0° |
| C4 | C7 | H34 | H35 | 118.6° | 120.1° |
| C32 | C30 | C11 | H16 | 118.3° | 120.1° |
| C32 | C30 | C11 | N10 | 177.9° | 60.3° |
| C32 | C30 | C11 | C12 | 60.5° | 179.7° |
| C32 | C30 | C11 | H4 | 62.3° | 59.7° |
| C32 | C30 | C31 | H17 | 180.0° | 61.9° |
| C32 | C30 | C31 | H18 | 60.0° | 58.1° |
| C32 | C30 | C31 | H19 | 60.0° | 178.1° |
| C30 | C32 | H20 | H21 | 120.0° | 120.0° |
| C30 | C32 | H20 | H22 | 120.0° | 120.0° |
| C30 | C32 | H21 | H22 | 120.0° | 120.0° |
| C34 | C35 | C36 | H25 | 117.1° | 120.0° |
| C35 | C34 | C14 | H23 | 120.3° | 120.0° |
| C35 | C34 | C14 | H24 | 120.4° | 120.0° |
| C35 | C34 | C14 | N13 | 64.0° | 174.9° |
| C35 | C34 | C14 | C15 | 172.5° | 65.0° |
| C35 | C34 | C14 | H5 | 54.3° | 54.9° |
| C35 | C34 | H23 | H24 | 119.0° | 120.0° |
| C34 | C35 | C36 | H26 | 54.1° | 64.1° |
| C34 | C35 | C36 | H27 | 174.1° | 175.9° |
| C34 | C35 | C36 | H28 | 65.9° | 55.9° |
| C34 | C35 | C37 | H29 | 180.0° | 60.0° |
| C34 | C35 | C37 | H30 | 60.0° | 180.0° |
| C34 | C35 | C37 | H31 | 60.0° | 60.0° |
| C36 | C35 | C34 | C14 | 60.6° | 66.5° |
| C36 | C35 | C34 | H23 | 59.7° | 53.5° |
| C36 | C35 | C34 | H24 | 179.0° | 173.5° |
| C35 | C36 | H26 | H27 | 120.0° | 120.0° |
| C35 | C36 | H26 | H28 | 120.0° | 120.0° |
| C35 | C36 | H27 | H28 | 120.0° | 120.0° |
| C36 | C35 | C37 | H29 | 53.7° | 180.0° |
| C36 | C35 | C37 | H30 | 173.7° | 60.0° |
| C36 | C35 | C37 | H31 | 66.3° | 60.0° |
| C34 | C14 | N13 | C15 | 122.9° | 120.0° |
| C34 | C14 | N13 | H5 | 117.7° | 120.0° |
| C34 | C14 | N13 | C12 | 163.8° | 88.7° |
| C34 | C14 | C15 | O38 | 44.4° | 99.2° |
| C34 | C14 | C15 | H5 | 118.1° | 120.0° |
| C34 | C14 | C15 | N16 | 138.7° | 80.8° |
| C14 | C34 | H23 | H24 | 119.0° | 120.0° |
| C14 | C34 | C35 | H25 | 56.5° | 53.5° |
| C34 | C14 | N13 | H37 | 16.2° | 91.4° |
| C30 | C11 | N10 | C12 | 118.9° | 120.0° |
| C30 | C11 | N10 | H4 | 119.0° | 120.0° |
| C30 | C11 | C12 | H4 | 122.6° | 120.1° |
| C30 | C11 | C12 | N13 | 122.5° | 73.3° |
| C30 | C11 | N10 | C9 | 147.9° | 85.0° |
| C30 | C11 | C12 | O33 | 58.4° | 106.8° |
| C11 | C30 | C31 | H17 | 55.8° | 58.1° |
| C11 | C30 | C31 | H18 | 175.8° | 178.1° |
| C11 | C30 | C31 | H19 | 64.2° | 61.9° |
| C11 | C30 | C32 | H20 | 57.5° | 60.0° |
| C11 | C30 | C32 | H21 | 62.5° | 180.0° |
| C11 | C30 | C32 | H22 | 177.5° | 59.9° |
| C30 | C11 | N10 | H36 | 32.1° | 95.0° |
| N10 | C11 | C12 | H4 | 122.6° | 120.0° |
| N10 | C11 | C12 | N13 | 122.8° | 166.7° |
| C11 | N10 | C9 | H36 | 180.0° | 180.0° |
| C11 | N10 | C9 | O8 | 165.1° | 180.0° |
| N10 | C11 | C12 | O33 | 56.4° | 13.2° |
| N10 | C11 | C30 | H16 | 59.5° | 59.8° |
| C11 | C12 | N13 | C14 | 173.7° | 175.4° |
| C11 | C12 | N13 | O33 | 179.1° | 179.9° |
| C12 | C11 | N10 | C9 | 93.2° | 155.0° |
| C12 | C11 | C30 | H16 | 57.9° | 60.2° |
| C12 | C11 | N10 | H36 | 86.8° | 25.0° |
| C11 | C12 | N13 | H37 | 6.3° | 4.7° |
| C14 | N13 | C12 | H37 | 180.0° | 179.9° |
| N13 | C14 | C15 | O38 | 77.8° | 20.8° |
| N13 | C14 | C15 | H5 | 119.8° | 120.1° |
| C14 | N13 | C12 | O33 | 7.1° | 4.6° |
| N13 | C14 | C15 | N16 | 99.1° | 159.2° |
| N13 | C14 | C34 | H23 | 175.7° | 55.0° |
| N13 | C14 | C34 | H24 | 56.4° | 65.0° |
| C12 | N13 | C14 | C15 | 73.2° | 151.4° |
| N13 | C12 | C11 | H4 | 0.2° | 46.7° |
| C12 | N13 | C14 | H5 | 46.1° | 31.3° |
| O38 | C15 | C14 | N16 | 176.9° | 180.0° |
| O38 | C15 | N16 | C17 | 42.4° | 5.0° |
| O38 | C15 | C14 | H5 | 162.5° | 140.9° |
| O38 | C15 | N16 | H38 | 137.6° | 174.9° |
| N10 | C9 | O8 | C7 | 135.6° | 180.0° |
| C9 | N10 | C11 | H4 | 28.8° | 35.1° |
| C9 | O8 | C7 | H34 | 168.6° | 60.0° |
| C9 | O8 | C7 | H35 | 72.4° | 60.0° |
| O8 | C9 | N10 | H36 | 14.9° | 0.0° |
| O8 | C7 | H34 | H35 | 118.5° | 120.0° |
| C14 | C15 | N16 | C17 | 140.9° | 175.0° |
| C15 | C14 | C34 | H23 | 52.2° | 175.0° |
| C15 | C14 | C34 | H24 | 67.2° | 55.0° |
| C15 | C14 | N13 | H37 | 106.8° | 28.6° |
| C14 | C15 | N16 | H38 | 39.1° | 5.1° |
| O33 | C12 | C11 | H4 | 179.0° | 133.2° |
| O33 | C12 | N13 | H37 | 172.9° | 175.4° |
| C15 | N16 | C17 | H38 | 180.0° | 179.9° |
| C15 | N16 | C17 | C10 | 16.3° | 85.1° |
| C15 | N16 | C17 | C19 | 114.1° | 155.0° |
| N16 | C15 | C14 | H5 | 20.6° | 39.2° |
| C15 | N16 | C17 | H6 | 132.2° | 35.0° |
| O11 | C10 | C17 | N16 | 90.9° | 65.0° |
| O11 | C10 | C17 | H2 | 120.1° | 120.0° |
| O11 | C10 | C17 | H3 | 120.1° | 120.1° |
| O11 | C10 | C17 | C19 | 39.7° | 55.0° |
| O11 | C10 | H2 | H3 | 119.7° | 120.1° |
| O11 | C10 | C17 | H6 | 152.9° | 174.9° |
| N16 | C17 | C10 | C19 | 130.5° | 120.0° |
| N16 | C17 | C10 | H6 | 116.3° | 120.1° |
| N16 | C17 | C19 | H6 | 114.1° | 120.1° |
| N16 | C17 | C19 | C20 | 22.9° | 65.0° |
| N16 | C17 | C10 | H2 | 29.3° | 175.0° |
| N16 | C17 | C10 | H3 | 149.0° | 55.1° |
| N16 | C17 | C19 | H7 | 143.2° | 175.0° |
| N16 | C17 | C19 | H8 | 97.3° | 54.9° |
| C22 | C21 | C20 | H11 | 119.3° | 118.1° |
| C22 | C21 | C20 | H12 | 119.3° | 118.1° |
| C21 | C22 | N23 | H13 | 119.3° | 119.0° |
| C21 | C22 | N23 | H14 | 119.3° | 119.0° |
| C22 | C21 | C20 | C19 | 135.5° | 93.9° |
| C22 | C21 | C20 | C24 | 14.9° | 24.8° |
| C21 | C22 | N23 | C24 | 7.3° | 17.0° |
| C22 | C21 | C20 | H10 | 103.6° | 143.5° |
| C22 | C21 | H11 | H12 | 122.0° | 123.8° |
| C21 | C22 | H13 | H14 | 122.0° | 122.0° |
| C21 | C22 | N23 | H39 | 172.7° | 163.0° |
| C20 | C21 | C22 | N23 | 13.7° | 25.4° |
| C21 | C20 | C19 | C17 | 130.0° | 178.8° |
| C21 | C20 | C19 | C24 | 115.0° | 114.7° |
| C21 | C20 | C19 | H10 | 121.0° | 122.7° |
| C21 | C20 | C24 | H10 | 118.3° | 118.8° |
| C21 | C20 | C24 | N23 | 11.3° | 16.2° |
| C21 | C20 | C24 | O26 | 168.9° | 163.8° |
| C21 | C20 | C19 | H7 | 109.7° | 61.2° |
| C21 | C20 | C19 | H8 | 9.7° | 58.8° |
| C20 | C21 | H11 | H12 | 122.0° | 123.8° |
| C20 | C21 | C22 | H13 | 133.1° | 93.6° |
| C20 | C21 | C22 | H14 | 105.6° | 144.4° |
| C10 | C17 | C19 | H6 | 113.2° | 120.0° |
| C10 | C17 | C19 | C20 | 155.7° | 175.0° |
| C17 | C10 | H2 | H3 | 119.7° | 119.9° |
| C10 | C17 | C19 | H7 | 84.1° | 55.1° |
| C10 | C17 | C19 | H8 | 35.4° | 65.0° |
| C10 | C17 | N16 | H38 | 163.7° | 95.0° |
| C17 | C10 | O11 | H40 | 180.0° | 180.0° |
| C22 | N23 | C24 | C20 | 2.5° | 0.4° |
| C22 | N23 | C24 | H39 | 180.0° | 179.9° |
| C22 | N23 | C24 | O26 | 177.6° | 179.6° |
| N23 | C22 | C21 | H11 | 133.1° | 143.5° |
| N23 | C22 | C21 | H12 | 105.5° | 92.7° |
| N23 | C22 | H13 | H14 | 122.0° | 122.0° |
| C17 | C19 | C20 | H7 | 120.2° | 120.0° |
| C17 | C19 | C20 | H8 | 120.3° | 120.0° |
| C17 | C19 | C20 | C24 | 115.0° | 66.5° |
| C19 | C17 | C10 | H2 | 159.8° | 65.0° |
| C19 | C17 | C10 | H3 | 80.4° | 175.1° |
| C17 | C19 | H7 | H8 | 119.3° | 120.0° |
| C17 | C19 | C20 | H10 | 9.1° | 56.1° |
| C19 | C17 | N16 | H38 | 66.0° | 24.9° |
| C19 | C20 | C24 | H10 | 123.9° | 122.6° |
| C19 | C20 | C24 | N23 | 129.1° | 102.4° |
| C19 | C20 | C24 | O26 | 51.1° | 77.6° |
| C20 | C19 | C17 | H6 | 91.2° | 55.0° |
| C20 | C19 | H7 | H8 | 119.2° | 120.0° |
| C19 | C20 | C21 | H11 | 105.3° | 24.3° |
| C19 | C20 | C21 | H12 | 16.2° | 148.0° |
| C20 | C24 | N23 | O26 | 179.8° | 180.0° |
| C24 | C20 | C19 | H7 | 5.3° | 53.5° |
| C24 | C20 | C19 | H8 | 124.7° | 173.6° |
| C24 | C20 | C21 | H11 | 134.2° | 142.9° |
| C24 | C20 | C21 | H12 | 104.4° | 93.4° |
| C20 | C24 | N23 | H39 | 177.5° | 179.5° |
| N23 | C24 | C20 | H10 | 107.0° | 135.0° |
| C24 | N23 | C22 | H13 | 126.6° | 102.0° |
| C24 | N23 | C22 | H14 | 112.0° | 136.0° |
| O26 | C24 | C20 | H10 | 72.8° | 45.0° |
| O26 | C24 | N23 | H39 | 2.4° | 0.5° |
| H1 | C1 | C2 | H9 | 0.6° | 0.3° |
| H1 | C1 | C6 | H33 | 0.8° | 0.0° |
| H2 | C10 | C17 | H6 | 87.0° | 54.9° |
| H2 | C10 | O11 | H40 | 59.9° | 60.0° |
| H3 | C10 | C17 | H6 | 32.8° | 65.0° |
| H3 | C10 | O11 | H40 | 59.9° | 59.9° |
| H4 | C11 | C30 | H16 | 179.4° | 179.8° |
| H4 | C11 | N10 | H36 | 151.2° | 145.0° |
| H5 | C14 | C34 | H23 | 66.0° | 65.1° |
| H5 | C14 | C34 | H24 | 174.6° | 175.0° |
| H5 | C14 | N13 | H37 | 133.9° | 148.6° |
| H6 | C17 | C19 | H7 | 29.1° | 64.9° |
| H6 | C17 | C19 | H8 | 148.6° | 175.0° |
| H6 | C17 | N16 | H38 | 47.8° | 145.0° |
| H7 | C19 | C20 | H10 | 129.3° | 176.1° |
| H8 | C19 | C20 | H10 | 111.2° | 63.8° |
| H9 | C2 | C3 | H15 | 0.2° | 0.0° |
| H10 | C20 | C21 | H11 | 15.7° | 98.3° |
| H10 | C20 | C21 | H12 | 137.1° | 25.4° |
| H11 | C21 | C22 | H13 | 107.6° | 24.6° |
| H11 | C21 | C22 | H14 | 13.7° | 97.5° |
| H12 | C21 | C22 | H13 | 13.8° | 148.4° |
| H12 | C21 | C22 | H14 | 135.1° | 26.3° |
| H13 | C22 | N23 | H39 | 53.4° | 78.1° |
| H14 | C22 | N23 | H39 | 68.0° | 43.9° |
| H16 | C30 | C31 | H17 | 60.9° | 178.0° |
| H16 | C30 | C31 | H18 | 59.1° | 62.0° |
| H16 | C30 | C31 | H19 | 179.1° | 58.0° |
| H16 | C30 | C32 | H20 | 60.9° | 60.0° |
| H16 | C30 | C32 | H21 | 179.1° | 60.0° |
| H16 | C30 | C32 | H22 | 59.1° | 180.0° |
| H17 | C31 | H18 | H19 | 120.0° | 119.9° |
| H20 | C32 | H21 | H22 | 120.0° | 120.0° |
| H23 | C34 | C35 | H25 | 176.8° | 173.5° |
| H24 | C34 | C35 | H25 | 63.8° | 66.5° |
| H25 | C35 | C36 | H26 | 63.1° | 175.9° |
| H25 | C35 | C36 | H27 | 57.0° | 55.9° |
| H25 | C35 | C36 | H28 | 177.0° | 64.1° |
| H25 | C35 | C37 | H29 | 63.3° | 60.0° |
| H25 | C35 | C37 | H30 | 56.7° | 60.0° |
| H25 | C35 | C37 | H31 | 176.7° | 180.0° |
| H26 | C36 | H27 | H28 | 120.0° | 120.0° |
| H29 | C37 | H30 | H31 | 120.0° | 120.0° |
| H32 | C5 | C6 | H33 | 0.3° | 0.3° |
