BQ0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C27 | sing | 1.51Å | 1.55Å | |
| C27 | C26 | doub | 1.38Å | 1.41Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.41Å | Aromatic |
| C26 | C25 | sing | 1.38Å | 1.41Å | Aromatic |
| C17 | C18 | sing | 1.55Å | 1.59Å | |
| C17 | C16 | sing | 1.55Å | 1.34Å | |
| C18 | C14 | sing | 1.54Å | 1.60Å | |
| C16 | C15 | sing | 1.54Å | 1.68Å | |
| C28 | C29 | doub | 1.38Å | 1.38Å | Aromatic |
| C25 | C31 | sing | 1.51Å | 1.56Å | |
| C25 | C24 | doub | 1.39Å | 1.41Å | Aromatic |
| C29 | C24 | sing | 1.39Å | 1.41Å | Aromatic |
| C24 | N23 | sing | 1.40Å | 1.47Å | |
| C14 | C15 | sing | 1.54Å | 1.29Å | |
| C14 | N07 | sing | 1.47Å | 1.58Å | |
| N07 | C04 | sing | 1.40Å | 1.53Å | |
| N07 | C08 | sing | 1.47Å | 1.40Å | |
| N23 | N22 | sing | 1.40Å | 1.31Å | Aromatic |
| N23 | C19 | sing | 1.37Å | 1.32Å | Aromatic |
| N22 | C21 | doub | 1.32Å | 1.31Å | Aromatic |
| C03 | C04 | doub | 1.38Å | 1.42Å | Aromatic |
| C03 | C02 | sing | 1.40Å | 1.42Å | Aromatic |
| C04 | C05 | sing | 1.40Å | 1.46Å | Aromatic |
| C08 | C09 | sing | 1.51Å | 1.57Å | |
| C08 | C12 | sing | 1.53Å | 1.54Å | |
| C09 | O13 | doub | 1.21Å | 1.41Å | |
| C09 | N10 | sing | 1.35Å | 1.39Å | |
| C19 | C02 | sing | 1.48Å | 1.52Å | |
| C19 | N20 | doub | 1.31Å | 1.32Å | Aromatic |
| C02 | C01 | doub | 1.40Å | 1.43Å | Aromatic |
| C21 | N20 | sing | 1.34Å | 1.35Å | Aromatic |
| C21 | C32 | sing | 1.48Å | 1.51Å | |
| C05 | N10 | sing | 1.40Å | 1.50Å | |
| C05 | C06 | doub | 1.39Å | 1.44Å | Aromatic |
| N10 | C11 | sing | 1.47Å | 1.48Å | |
| C32 | O33 | doub | 1.22Å | 1.19Å | |
| C32 | N34 | sing | 1.35Å | 1.44Å | |
| C36 | C35 | sing | 1.53Å | 1.52Å | |
| C36 | N37 | sing | 1.47Å | 1.42Å | |
| C01 | C06 | sing | 1.38Å | 1.40Å | Aromatic |
| C35 | N34 | sing | 1.47Å | 1.42Å | |
| C40 | N37 | sing | 1.47Å | 1.32Å | |
| N34 | C39 | sing | 1.47Å | 1.43Å | |
| C38 | N37 | sing | 1.47Å | 1.40Å | |
| C38 | C39 | sing | 1.53Å | 1.53Å | |
| C12 | H1 | sing | 1.09Å | 1.10Å | |
| C12 | H2 | sing | 1.09Å | 1.10Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.09Å | 1.10Å | |
| C15 | H6 | sing | 1.09Å | 1.10Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C17 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C18 | H11 | sing | 1.09Å | 1.10Å | |
| C18 | H12 | sing | 1.09Å | 1.10Å | |
| C28 | H13 | sing | 1.08Å | 1.08Å | |
| C29 | H14 | sing | 1.08Å | 1.08Å | |
| C31 | H15 | sing | 1.09Å | 1.10Å | |
| C31 | H16 | sing | 1.09Å | 1.10Å | |
| C31 | H17 | sing | 1.09Å | 1.10Å | |
| C01 | H18 | sing | 1.08Å | 1.08Å | |
| C03 | H19 | sing | 1.08Å | 1.08Å | |
| C06 | H20 | sing | 1.08Å | 1.08Å | |
| C08 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H23 | sing | 1.09Å | 1.10Å | |
| C11 | H24 | sing | 1.09Å | 1.10Å | |
| C11 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H27 | sing | 1.08Å | 1.08Å | |
| C30 | H28 | sing | 1.09Å | 1.10Å | |
| C30 | H29 | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C35 | H31 | sing | 1.09Å | 1.10Å | |
| C35 | H32 | sing | 1.09Å | 1.10Å | |
| C36 | H33 | sing | 1.09Å | 1.10Å | |
| C36 | H34 | sing | 1.09Å | 1.10Å | |
| C38 | H36 | sing | 1.09Å | 1.10Å | |
| C38 | H37 | sing | 1.09Å | 1.10Å | |
| C39 | H38 | sing | 1.09Å | 1.10Å | |
| C39 | H39 | sing | 1.09Å | 1.10Å | |
| C40 | H40 | sing | 1.09Å | 1.10Å | |
| C40 | H41 | sing | 1.09Å | 1.10Å | |
| C40 | H42 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C30 | C27 | C26 | 121.1° | 120.0° |
| C30 | C27 | C28 | 117.9° | 119.9° |
| C27 | C30 | H28 | 109.5° | 109.5° |
| C27 | C30 | H29 | 109.5° | 109.5° |
| C27 | C30 | H30 | 109.4° | 109.5° |
| C26 | C27 | C28 | 121.1° | 120.1° |
| C27 | C26 | C25 | 119.4° | 120.1° |
| C27 | C26 | H27 | 120.3° | 119.9° |
| C27 | C28 | C29 | 119.4° | 120.0° |
| C27 | C28 | H13 | 120.3° | 120.0° |
| C26 | C25 | C31 | 119.0° | 120.0° |
| C26 | C25 | C24 | 118.8° | 119.9° |
| C25 | C26 | H27 | 120.3° | 120.0° |
| C18 | C17 | C16 | 104.1° | 102.8° |
| C17 | C18 | C14 | 106.5° | 104.2° |
| C18 | C17 | H9 | 110.8° | 110.8° |
| C18 | C17 | H10 | 110.8° | 110.8° |
| C17 | C18 | H11 | 110.2° | 110.5° |
| C17 | C18 | H12 | 110.2° | 110.5° |
| C17 | C16 | C15 | 104.8° | 104.2° |
| C17 | C16 | H7 | 110.6° | 110.5° |
| C17 | C16 | H8 | 110.6° | 110.7° |
| C16 | C17 | H9 | 110.8° | 110.7° |
| C16 | C17 | H10 | 110.8° | 110.7° |
| C18 | C14 | C15 | 103.8° | 106.6° |
| C18 | C14 | N07 | 118.9° | 110.0° |
| C18 | C14 | H4 | 103.6° | 110.0° |
| C14 | C18 | H11 | 110.2° | 110.5° |
| C14 | C18 | H12 | 110.2° | 110.5° |
| C16 | C15 | C14 | 107.5° | 106.6° |
| C16 | C15 | H5 | 109.9° | 110.0° |
| C16 | C15 | H6 | 110.0° | 110.1° |
| C15 | C16 | H7 | 110.6° | 110.5° |
| C15 | C16 | H8 | 110.6° | 110.5° |
| C28 | C29 | C24 | 120.2° | 119.9° |
| C29 | C28 | H13 | 120.3° | 120.0° |
| C28 | C29 | H14 | 119.9° | 120.0° |
| C31 | C25 | C24 | 122.0° | 120.1° |
| C25 | C31 | H15 | 109.5° | 109.5° |
| C25 | C31 | H16 | 109.5° | 109.5° |
| C25 | C31 | H17 | 109.4° | 109.4° |
| C25 | C24 | C29 | 121.0° | 119.9° |
| C25 | C24 | N23 | 124.4° | 120.1° |
| C29 | C24 | N23 | 114.7° | 120.0° |
| C24 | C29 | H14 | 119.9° | 120.1° |
| C24 | N23 | N22 | 124.6° | 126.9° |
| C24 | N23 | C19 | 126.2° | 126.8° |
| C15 | C14 | N07 | 118.3° | 110.1° |
| C15 | C14 | H4 | 106.9° | 110.0° |
| C14 | C15 | H5 | 110.0° | 110.0° |
| C14 | C15 | H6 | 110.0° | 110.0° |
| C14 | N07 | C04 | 140.3° | 111.0° |
| C14 | N07 | C08 | 106.3° | 111.0° |
| N07 | C14 | H4 | 103.9° | 110.0° |
| C04 | N07 | C08 | 110.5° | 111.9° |
| N07 | C04 | C03 | 125.8° | 120.1° |
| N07 | C04 | C05 | 118.0° | 120.2° |
| N07 | C08 | C09 | 107.7° | 110.0° |
| N07 | C08 | C12 | 107.3° | 109.4° |
| N07 | C08 | H21 | 108.0° | 109.4° |
| N22 | N23 | C19 | 109.1° | 106.3° |
| N23 | N22 | C21 | 106.5° | 107.0° |
| N23 | C19 | C02 | 125.1° | 126.1° |
| N23 | C19 | N20 | 109.1° | 107.8° |
| N22 | C21 | N20 | 110.5° | 109.1° |
| N22 | C21 | C32 | 125.1° | 125.5° |
| C04 | C03 | C02 | 119.9° | 119.9° |
| C03 | C04 | C05 | 116.2° | 119.7° |
| C04 | C03 | H19 | 120.1° | 120.1° |
| C03 | C02 | C19 | 118.6° | 120.0° |
| C03 | C02 | C01 | 123.8° | 120.0° |
| C02 | C03 | H19 | 120.0° | 120.0° |
| C04 | C05 | N10 | 119.1° | 119.4° |
| C04 | C05 | C06 | 122.9° | 120.3° |
| C09 | C08 | C12 | 120.9° | 109.4° |
| C08 | C09 | O13 | 112.0° | 120.3° |
| C08 | C09 | N10 | 114.3° | 119.5° |
| C09 | C08 | H21 | 106.1° | 109.4° |
| C08 | C12 | H1 | 109.5° | 109.4° |
| C08 | C12 | H2 | 109.5° | 109.5° |
| C08 | C12 | H3 | 109.5° | 109.5° |
| C12 | C08 | H21 | 106.3° | 109.3° |
| O13 | C09 | N10 | 115.3° | 120.2° |
| C09 | N10 | C05 | 116.6° | 118.7° |
| C09 | N10 | C11 | 119.6° | 120.7° |
| C02 | C19 | N20 | 125.7° | 126.1° |
| C19 | C02 | C01 | 117.6° | 120.0° |
| C19 | N20 | C21 | 104.6° | 109.8° |
| C02 | C01 | C06 | 117.8° | 120.0° |
| C02 | C01 | H18 | 121.1° | 120.0° |
| N20 | C21 | C32 | 124.4° | 125.4° |
| C21 | C32 | O33 | 120.5° | 120.0° |
| C21 | C32 | N34 | 116.5° | 120.0° |
| N10 | C05 | C06 | 118.0° | 120.3° |
| C05 | N10 | C11 | 119.6° | 120.7° |
| C05 | C06 | C01 | 119.4° | 120.1° |
| C05 | C06 | H20 | 120.3° | 119.9° |
| N10 | C11 | H23 | 109.5° | 109.5° |
| N10 | C11 | H24 | 109.5° | 109.5° |
| N10 | C11 | H25 | 109.5° | 109.5° |
| O33 | C32 | N34 | 122.9° | 120.0° |
| C32 | N34 | C35 | 123.8° | 120.9° |
| C32 | N34 | C39 | 123.8° | 120.9° |
| C35 | C36 | N37 | 115.1° | 109.3° |
| C36 | C35 | N34 | 113.5° | 108.5° |
| C36 | C35 | H31 | 108.4° | 109.6° |
| C36 | C35 | H32 | 108.5° | 109.8° |
| C35 | C36 | H33 | 108.1° | 109.5° |
| C35 | C36 | H34 | 108.1° | 109.5° |
| C36 | N37 | C40 | 112.1° | 111.0° |
| C36 | N37 | C38 | 112.3° | 111.2° |
| N37 | C36 | H33 | 108.1° | 109.5° |
| N37 | C36 | H34 | 108.0° | 109.5° |
| C06 | C01 | H18 | 121.1° | 120.0° |
| C01 | C06 | H20 | 120.3° | 120.0° |
| C35 | N34 | C39 | 112.4° | 118.2° |
| N34 | C35 | H31 | 108.5° | 109.6° |
| N34 | C35 | H32 | 108.5° | 109.7° |
| C40 | N37 | C38 | 115.0° | 111.0° |
| N37 | C40 | H40 | 109.5° | 109.5° |
| N37 | C40 | H41 | 109.4° | 109.5° |
| N37 | C40 | H42 | 109.5° | 109.5° |
| N34 | C39 | C38 | 113.7° | 108.7° |
| N34 | C39 | H38 | 108.4° | 109.6° |
| N34 | C39 | H39 | 108.4° | 109.7° |
| N37 | C38 | C39 | 108.5° | 109.4° |
| N37 | C38 | H36 | 109.7° | 109.5° |
| N37 | C38 | H37 | 109.7° | 109.5° |
| C39 | C38 | H36 | 109.7° | 109.6° |
| C39 | C38 | H37 | 109.7° | 109.3° |
| C38 | C39 | H38 | 108.4° | 109.5° |
| C38 | C39 | H39 | 108.4° | 109.5° |
| H1 | C12 | H2 | 109.4° | 109.5° |
| H1 | C12 | H3 | 109.5° | 109.5° |
| H2 | C12 | H3 | 109.5° | 109.5° |
| H5 | C15 | H6 | 109.5° | 110.1° |
| H7 | C16 | H8 | 109.5° | 110.4° |
| H9 | C17 | H10 | 109.5° | 110.8° |
| H11 | C18 | H12 | 109.4° | 110.5° |
| H15 | C31 | H16 | 109.5° | 109.5° |
| H15 | C31 | H17 | 109.5° | 109.5° |
| H16 | C31 | H17 | 109.5° | 109.4° |
| H23 | C11 | H24 | 109.5° | 109.5° |
| H23 | C11 | H25 | 109.5° | 109.4° |
| H24 | C11 | H25 | 109.5° | 109.5° |
| H28 | C30 | H29 | 109.5° | 109.5° |
| H28 | C30 | H30 | 109.4° | 109.4° |
| H29 | C30 | H30 | 109.5° | 109.4° |
| H31 | C35 | H32 | 109.4° | 109.6° |
| H33 | C36 | H34 | 109.5° | 109.5° |
| H36 | C38 | H37 | 109.5° | 109.5° |
| H38 | C39 | H39 | 109.5° | 109.8° |
| H40 | C40 | H41 | 109.4° | 109.5° |
| H40 | C40 | H42 | 109.4° | 109.4° |
| H41 | C40 | H42 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C30 | C27 | C26 | C28 | 179.1° | 179.7° |
| C30 | C27 | C26 | C25 | 179.7° | 180.0° |
| C30 | C27 | C28 | C29 | 177.8° | 180.0° |
| C30 | C27 | C28 | H13 | 2.2° | 0.0° |
| C30 | C27 | C26 | H27 | 0.3° | 0.0° |
| C27 | C30 | H28 | H29 | 120.0° | 120.1° |
| C27 | C30 | H28 | H30 | 120.0° | 120.0° |
| C27 | C30 | H29 | H30 | 120.0° | 120.0° |
| C27 | C26 | C25 | H27 | 180.0° | 180.0° |
| C26 | C27 | C28 | C29 | 1.3° | 0.3° |
| C27 | C26 | C25 | C31 | 177.6° | 180.0° |
| C27 | C26 | C25 | C24 | 2.8° | 0.0° |
| C26 | C27 | C28 | H13 | 178.7° | 179.7° |
| C26 | C27 | C30 | H28 | 89.5° | 90.0° |
| C26 | C27 | C30 | H29 | 150.4° | 150.0° |
| C26 | C27 | C30 | H30 | 30.5° | 30.0° |
| C28 | C27 | C26 | C25 | 1.2° | 0.3° |
| C27 | C28 | C29 | H13 | 180.0° | 180.0° |
| C27 | C28 | C29 | C24 | 2.3° | 0.0° |
| C27 | C28 | C29 | H14 | 177.7° | 180.0° |
| C28 | C27 | C26 | H27 | 178.8° | 179.7° |
| C28 | C27 | C30 | H28 | 89.6° | 89.7° |
| C28 | C27 | C30 | H29 | 30.5° | 30.3° |
| C28 | C27 | C30 | H30 | 150.4° | 150.3° |
| C26 | C25 | C31 | C24 | 174.6° | 179.9° |
| C26 | C25 | C24 | C29 | 1.9° | 0.3° |
| C26 | C25 | C24 | N23 | 177.5° | 180.0° |
| C26 | C25 | C31 | H15 | 92.5° | 85.2° |
| C26 | C25 | C31 | H16 | 147.5° | 34.9° |
| C26 | C25 | C31 | H17 | 27.4° | 154.8° |
| C18 | C17 | C16 | H9 | 119.1° | 118.3° |
| C18 | C17 | C16 | H10 | 119.1° | 118.3° |
| C17 | C18 | C14 | H11 | 119.6° | 118.7° |
| C17 | C18 | C14 | H12 | 119.5° | 118.7° |
| C18 | C17 | C16 | C15 | 28.4° | 37.9° |
| C17 | C18 | C14 | C15 | 11.9° | 23.6° |
| C17 | C18 | C14 | N07 | 145.7° | 142.9° |
| C17 | C18 | C14 | H4 | 99.7° | 95.7° |
| C18 | C17 | C16 | H7 | 147.6° | 156.6° |
| C18 | C17 | C16 | H8 | 90.9° | 80.8° |
| C18 | C17 | H9 | H10 | 122.5° | 123.4° |
| C17 | C18 | H11 | H12 | 121.4° | 122.7° |
| C16 | C17 | C18 | C14 | 13.8° | 37.9° |
| C17 | C16 | C15 | H7 | 119.3° | 118.7° |
| C17 | C16 | C15 | H8 | 119.3° | 118.9° |
| C17 | C16 | C15 | C14 | 40.1° | 23.6° |
| C17 | C16 | C15 | H5 | 79.6° | 95.6° |
| C17 | C16 | C15 | H6 | 159.8° | 142.9° |
| C17 | C16 | H7 | H8 | 122.2° | 122.7° |
| C16 | C17 | H9 | H10 | 122.5° | 123.3° |
| C16 | C17 | C18 | H11 | 105.8° | 80.7° |
| C16 | C17 | C18 | H12 | 133.3° | 156.6° |
| C18 | C14 | C15 | C16 | 28.1° | 0.0° |
| C18 | C14 | C15 | N07 | 134.2° | 119.3° |
| C18 | C14 | C15 | H4 | 109.2° | 119.3° |
| C18 | C14 | N07 | H4 | 114.4° | 121.4° |
| C18 | C14 | N07 | C04 | 68.0° | 69.9° |
| C18 | C14 | N07 | C08 | 134.3° | 164.9° |
| C18 | C14 | C15 | H5 | 91.5° | 119.2° |
| C18 | C14 | C15 | H6 | 147.8° | 119.3° |
| C14 | C18 | C17 | H9 | 105.4° | 80.4° |
| C14 | C18 | C17 | H10 | 132.9° | 156.2° |
| C14 | C18 | H11 | H12 | 121.3° | 122.6° |
| C16 | C15 | C14 | H5 | 119.7° | 119.3° |
| C16 | C15 | C14 | H6 | 119.7° | 119.3° |
| C16 | C15 | C14 | N07 | 162.3° | 119.3° |
| C16 | C15 | C14 | H4 | 81.0° | 119.3° |
| C16 | C15 | H5 | H6 | 120.9° | 121.4° |
| C15 | C16 | H7 | H8 | 122.2° | 122.5° |
| C15 | C16 | C17 | H9 | 90.7° | 80.4° |
| C15 | C16 | C17 | H10 | 147.5° | 156.3° |
| C28 | C29 | C24 | C25 | 0.7° | 0.3° |
| C28 | C29 | C24 | H14 | 180.0° | 180.0° |
| C28 | C29 | C24 | N23 | 179.9° | 180.0° |
| C31 | C25 | C24 | C29 | 176.5° | 179.7° |
| C31 | C25 | C24 | N23 | 2.9° | 0.0° |
| C25 | C31 | H15 | H16 | 120.0° | 120.1° |
| C25 | C31 | H15 | H17 | 120.0° | 119.9° |
| C25 | C31 | H16 | H17 | 120.0° | 119.9° |
| C31 | C25 | C26 | H27 | 2.4° | 0.0° |
| C25 | C24 | C29 | N23 | 179.5° | 179.7° |
| C25 | C24 | N23 | N22 | 66.6° | 54.3° |
| C25 | C24 | N23 | C19 | 118.5° | 125.6° |
| C25 | C24 | C29 | H14 | 179.4° | 179.7° |
| C24 | C25 | C31 | H15 | 92.9° | 94.7° |
| C24 | C25 | C31 | H16 | 27.1° | 145.2° |
| C24 | C25 | C31 | H17 | 147.2° | 25.2° |
| C24 | C25 | C26 | H27 | 177.2° | 180.0° |
| C29 | C24 | N23 | N22 | 112.9° | 125.4° |
| C29 | C24 | N23 | C19 | 62.1° | 54.7° |
| C24 | C29 | C28 | H13 | 177.7° | 180.0° |
| C24 | N23 | N22 | C19 | 175.7° | 179.9° |
| C24 | N23 | N22 | C21 | 177.8° | 179.9° |
| C24 | N23 | C19 | C02 | 4.3° | 0.1° |
| C24 | N23 | C19 | N20 | 176.0° | 179.8° |
| N23 | C24 | C29 | H14 | 0.1° | 0.0° |
| C15 | C14 | N07 | H4 | 118.3° | 121.4° |
| C15 | C14 | N07 | C04 | 59.3° | 47.3° |
| C15 | C14 | N07 | C08 | 98.3° | 77.9° |
| C14 | C15 | H5 | H6 | 120.9° | 121.4° |
| C14 | C15 | C16 | H7 | 159.3° | 142.3° |
| C14 | C15 | C16 | H8 | 79.2° | 95.2° |
| C15 | C14 | C18 | H11 | 131.5° | 95.1° |
| C15 | C14 | C18 | H12 | 107.6° | 142.3° |
| C14 | N07 | C04 | C08 | 157.0° | 124.7° |
| C14 | N07 | C04 | C03 | 9.2° | 91.0° |
| C14 | N07 | C04 | C05 | 171.0° | 88.8° |
| C14 | N07 | C08 | C09 | 134.4° | 74.0° |
| C14 | N07 | C08 | C12 | 93.9° | 46.2° |
| N07 | C14 | C15 | H5 | 42.7° | 121.4° |
| N07 | C14 | C15 | H6 | 78.0° | 0.0° |
| N07 | C14 | C18 | H11 | 94.7° | 24.2° |
| N07 | C14 | C18 | H12 | 26.2° | 98.4° |
| C14 | N07 | C08 | H21 | 20.3° | 165.9° |
| N07 | C04 | C03 | C05 | 179.7° | 179.7° |
| N07 | C04 | C03 | C02 | 178.6° | 179.7° |
| C04 | N07 | C08 | C09 | 60.6° | 50.7° |
| C04 | N07 | C08 | C12 | 71.0° | 170.9° |
| N07 | C04 | C05 | N10 | 0.6° | 0.5° |
| N07 | C04 | C05 | C06 | 178.7° | 179.6° |
| C04 | N07 | C14 | H4 | 177.5° | 168.7° |
| N07 | C04 | C03 | H19 | 1.4° | 0.3° |
| C04 | N07 | C08 | H21 | 174.8° | 69.5° |
| C08 | N07 | C04 | C03 | 147.8° | 144.4° |
| C08 | N07 | C04 | C05 | 32.0° | 35.9° |
| N07 | C08 | C09 | C12 | 123.7° | 120.2° |
| N07 | C08 | C09 | H21 | 115.4° | 120.2° |
| N07 | C08 | C12 | H21 | 115.3° | 119.8° |
| N07 | C08 | C09 | O13 | 162.4° | 145.1° |
| N07 | C08 | C09 | N10 | 64.0° | 34.9° |
| N07 | C08 | C12 | H1 | 180.0° | 53.4° |
| N07 | C08 | C12 | H2 | 60.0° | 173.4° |
| N07 | C08 | C12 | H3 | 60.0° | 66.6° |
| C08 | N07 | C14 | H4 | 19.9° | 43.5° |
| N22 | N23 | C19 | C02 | 179.9° | 180.0° |
| N22 | N23 | C19 | N20 | 0.4° | 0.3° |
| N23 | N22 | C21 | N20 | 3.1° | 0.0° |
| N23 | N22 | C21 | C32 | 178.2° | 179.8° |
| C19 | N23 | N22 | C21 | 2.1° | 0.2° |
| N23 | C19 | C02 | C03 | 49.4° | 149.5° |
| N23 | C19 | C02 | N20 | 179.7° | 179.7° |
| N23 | C19 | C02 | C01 | 131.3° | 30.5° |
| N23 | C19 | N20 | C21 | 1.4° | 0.3° |
| N22 | C21 | N20 | C19 | 2.8° | 0.1° |
| N22 | C21 | N20 | C32 | 178.8° | 179.9° |
| N22 | C21 | C32 | O33 | 88.9° | 7.3° |
| N22 | C21 | C32 | N34 | 93.6° | 172.6° |
| C04 | C03 | C02 | H19 | 180.0° | 180.0° |
| C04 | C03 | C02 | C19 | 179.3° | 180.0° |
| C04 | C03 | C02 | C01 | 0.0° | 0.0° |
| C03 | C04 | C05 | N10 | 179.6° | 179.8° |
| C03 | C04 | C05 | C06 | 1.1° | 0.1° |
| C02 | C03 | C04 | C05 | 1.1° | 0.1° |
| C03 | C02 | C19 | C01 | 179.3° | 179.9° |
| C03 | C02 | C19 | N20 | 130.3° | 30.2° |
| C03 | C02 | C01 | C06 | 1.2° | 0.1° |
| C03 | C02 | C01 | H18 | 178.8° | 179.8° |
| C04 | C05 | N10 | C09 | 0.3° | 18.1° |
| C04 | C05 | N10 | C06 | 179.3° | 179.9° |
| C04 | C05 | N10 | C11 | 157.0° | 162.0° |
| C04 | C05 | C06 | C01 | 0.1° | 0.1° |
| C05 | C04 | C03 | H19 | 178.9° | 179.9° |
| C04 | C05 | C06 | H20 | 180.0° | 179.8° |
| C09 | C08 | C12 | H21 | 120.7° | 119.7° |
| C08 | C09 | O13 | N10 | 133.1° | 180.0° |
| C08 | C09 | N10 | C05 | 31.0° | 0.7° |
| C08 | C09 | N10 | C11 | 172.4° | 179.2° |
| C09 | C08 | C12 | H1 | 56.0° | 173.9° |
| C09 | C08 | C12 | H2 | 63.9° | 66.1° |
| C09 | C08 | C12 | H3 | 176.1° | 54.0° |
| C12 | C08 | C09 | O13 | 73.9° | 24.9° |
| C12 | C08 | C09 | N10 | 59.7° | 155.0° |
| C08 | C12 | H1 | H2 | 120.0° | 120.0° |
| C08 | C12 | H1 | H3 | 120.0° | 120.0° |
| C08 | C12 | H2 | H3 | 120.0° | 120.0° |
| O13 | C09 | N10 | C05 | 163.1° | 179.3° |
| O13 | C09 | N10 | C11 | 40.3° | 0.8° |
| O13 | C09 | C08 | H21 | 47.0° | 94.7° |
| C09 | N10 | C05 | C11 | 156.6° | 179.9° |
| C09 | N10 | C05 | C06 | 179.7° | 161.9° |
| N10 | C09 | C08 | H21 | 179.4° | 85.3° |
| C09 | N10 | C11 | H23 | 180.0° | 90.1° |
| C09 | N10 | C11 | H24 | 60.0° | 29.9° |
| C09 | N10 | C11 | H25 | 60.0° | 150.0° |
| C02 | C19 | N20 | C21 | 178.3° | 180.0° |
| C19 | C02 | C01 | C06 | 179.5° | 180.0° |
| C19 | C02 | C01 | H18 | 0.5° | 0.2° |
| C19 | C02 | C03 | H19 | 0.7° | 0.0° |
| N20 | C19 | C02 | C01 | 49.0° | 149.8° |
| C19 | N20 | C21 | C32 | 178.4° | 180.0° |
| C02 | C01 | C06 | C05 | 1.2° | 0.0° |
| C02 | C01 | C06 | H18 | 180.0° | 179.8° |
| C01 | C02 | C03 | H19 | 180.0° | 180.0° |
| C02 | C01 | C06 | H20 | 178.9° | 179.7° |
| N20 | C21 | C32 | O33 | 92.5° | 172.6° |
| N20 | C21 | C32 | N34 | 85.0° | 7.5° |
| C21 | C32 | O33 | N34 | 177.3° | 179.9° |
| C21 | C32 | N34 | C35 | 0.1° | 176.0° |
| C21 | C32 | N34 | C39 | 177.3° | 3.8° |
| N10 | C05 | C06 | C01 | 179.2° | 179.8° |
| N10 | C05 | C06 | H20 | 0.7° | 0.2° |
| C05 | N10 | C11 | H23 | 24.1° | 90.0° |
| C05 | N10 | C11 | H24 | 144.1° | 150.0° |
| C05 | N10 | C11 | H25 | 95.9° | 29.9° |
| C06 | C05 | N10 | C11 | 23.7° | 18.0° |
| C05 | C06 | C01 | H20 | 180.0° | 179.6° |
| C05 | C06 | C01 | H18 | 178.8° | 179.7° |
| N10 | C11 | H23 | H24 | 120.0° | 120.0° |
| N10 | C11 | H23 | H25 | 120.0° | 120.0° |
| N10 | C11 | H24 | H25 | 120.0° | 120.0° |
| O33 | C32 | N34 | C35 | 177.3° | 3.9° |
| O33 | C32 | N34 | C39 | 0.1° | 176.3° |
| C32 | N34 | C35 | C36 | 139.6° | 128.9° |
| C32 | N34 | C35 | C39 | 177.5° | 179.8° |
| C32 | N34 | C39 | C38 | 130.8° | 128.9° |
| C32 | N34 | C35 | H31 | 19.0° | 111.4° |
| C32 | N34 | C35 | H32 | 99.8° | 8.9° |
| C32 | N34 | C39 | H38 | 10.2° | 9.2° |
| C32 | N34 | C39 | H39 | 108.6° | 111.4° |
| C35 | C36 | N37 | H33 | 120.8° | 120.0° |
| C35 | C36 | N37 | H34 | 120.8° | 119.9° |
| C36 | C35 | N34 | H31 | 120.6° | 119.7° |
| C36 | C35 | N34 | H32 | 120.6° | 120.0° |
| C35 | C36 | N37 | C40 | 177.3° | 172.8° |
| C36 | C35 | N34 | C39 | 43.0° | 50.9° |
| C35 | C36 | N37 | C38 | 51.5° | 63.1° |
| C36 | C35 | H31 | H32 | 118.2° | 120.6° |
| C35 | C36 | H33 | H34 | 117.5° | 120.1° |
| N37 | C36 | C35 | N34 | 43.3° | 53.8° |
| C36 | N37 | C40 | C38 | 129.8° | 124.3° |
| C36 | N37 | C38 | C39 | 56.8° | 63.0° |
| N37 | C36 | C35 | H31 | 163.9° | 65.9° |
| N37 | C36 | C35 | H32 | 77.3° | 173.7° |
| N37 | C36 | H33 | H34 | 117.4° | 120.0° |
| C36 | N37 | C38 | H36 | 176.7° | 176.9° |
| C36 | N37 | C38 | H37 | 63.1° | 56.9° |
| C36 | N37 | C40 | H40 | 180.0° | 60.0° |
| C36 | N37 | C40 | H41 | 60.0° | 180.0° |
| C36 | N37 | C40 | H42 | 60.0° | 60.0° |
| C35 | N34 | C39 | C38 | 51.7° | 50.9° |
| N34 | C35 | H31 | H32 | 118.2° | 120.4° |
| N34 | C35 | C36 | H33 | 164.1° | 173.8° |
| N34 | C35 | C36 | H34 | 77.5° | 66.1° |
| C35 | N34 | C39 | H38 | 172.4° | 170.6° |
| C35 | N34 | C39 | H39 | 68.9° | 68.8° |
| C40 | N37 | C38 | C39 | 173.4° | 172.9° |
| C40 | N37 | C36 | H33 | 56.4° | 52.8° |
| C40 | N37 | C36 | H34 | 61.9° | 67.3° |
| C40 | N37 | C38 | H36 | 53.6° | 52.8° |
| C40 | N37 | C38 | H37 | 66.7° | 67.3° |
| N37 | C40 | H40 | H41 | 120.0° | 120.0° |
| N37 | C40 | H40 | H42 | 120.0° | 120.0° |
| N37 | C40 | H41 | H42 | 120.0° | 120.0° |
| N34 | C39 | C38 | N37 | 58.6° | 53.7° |
| N34 | C39 | C38 | H38 | 120.7° | 119.7° |
| N34 | C39 | C38 | H39 | 120.6° | 119.8° |
| C39 | N34 | C35 | H31 | 163.6° | 68.8° |
| C39 | N34 | C35 | H32 | 77.7° | 170.9° |
| N34 | C39 | C38 | H36 | 178.5° | 173.7° |
| N34 | C39 | C38 | H37 | 61.2° | 66.3° |
| N34 | C39 | H38 | H39 | 118.1° | 120.5° |
| N37 | C38 | C39 | H36 | 119.8° | 120.1° |
| N37 | C38 | C39 | H37 | 119.8° | 120.0° |
| C38 | N37 | C36 | H33 | 172.3° | 176.9° |
| C38 | N37 | C36 | H34 | 69.3° | 56.9° |
| N37 | C38 | H36 | H37 | 120.4° | 120.1° |
| N37 | C38 | C39 | H38 | 179.3° | 173.4° |
| N37 | C38 | C39 | H39 | 62.0° | 66.1° |
| C38 | N37 | C40 | H40 | 50.1° | 64.3° |
| C38 | N37 | C40 | H41 | 170.1° | 55.7° |
| C38 | N37 | C40 | H42 | 69.9° | 175.8° |
| C39 | C38 | H36 | H37 | 120.5° | 119.9° |
| C38 | C39 | H38 | H39 | 118.0° | 120.3° |
| H1 | C12 | H2 | H3 | 120.0° | 120.0° |
| H1 | C12 | C08 | H21 | 64.7° | 66.4° |
| H2 | C12 | C08 | H21 | 175.3° | 53.6° |
| H3 | C12 | C08 | H21 | 55.3° | 173.6° |
| H4 | C14 | C15 | H5 | 159.3° | 0.0° |
| H4 | C14 | C15 | H6 | 38.7° | 121.4° |
| H4 | C14 | C18 | H11 | 19.9° | 145.6° |
| H4 | C14 | C18 | H12 | 140.8° | 23.0° |
| H5 | C15 | C16 | H7 | 39.6° | 23.1° |
| H5 | C15 | C16 | H8 | 161.1° | 145.5° |
| H6 | C15 | C16 | H7 | 81.0° | 98.4° |
| H6 | C15 | C16 | H8 | 40.5° | 24.0° |
| H7 | C16 | C17 | H9 | 28.5° | 38.3° |
| H7 | C16 | C17 | H10 | 93.2° | 85.1° |
| H8 | C16 | C17 | H9 | 150.0° | 160.9° |
| H8 | C16 | C17 | H10 | 28.3° | 37.5° |
| H9 | C17 | C18 | H11 | 135.1° | 161.0° |
| H9 | C17 | C18 | H12 | 14.2° | 38.3° |
| H10 | C17 | C18 | H11 | 13.3° | 37.6° |
| H10 | C17 | C18 | H12 | 107.6° | 85.1° |
| H13 | C28 | C29 | H14 | 2.2° | 0.0° |
| H15 | C31 | H16 | H17 | 120.0° | 120.0° |
| H18 | C01 | C06 | H20 | 1.2° | 0.1° |
| H23 | C11 | H24 | H25 | 120.0° | 120.0° |
| H28 | C30 | H29 | H30 | 120.0° | 119.9° |
| H31 | C35 | C36 | H33 | 75.3° | 54.0° |
| H31 | C35 | C36 | H34 | 43.1° | 174.2° |
| H32 | C35 | C36 | H33 | 43.5° | 66.4° |
| H32 | C35 | C36 | H34 | 161.9° | 53.8° |
| H36 | C38 | C39 | H38 | 60.9° | 66.6° |
| H36 | C38 | C39 | H39 | 57.8° | 53.9° |
| H37 | C38 | C39 | H38 | 59.4° | 53.4° |
| H37 | C38 | C39 | H39 | 178.2° | 173.9° |
| H40 | C40 | H41 | H42 | 120.0° | 119.9° |
