A1ACS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C29 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | N28 | sing | 1.32Å | 1.32Å | Aromatic |
| C30 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| C01 | C02 | sing | 1.53Å | 1.61Å | |
| N28 | C27 | doub | 1.32Å | 1.32Å | Aromatic |
| C25 | C02 | sing | 1.51Å | 1.60Å | |
| C25 | C26 | doub | 1.39Å | 1.39Å | Aromatic |
| C04 | N03 | sing | 1.47Å | 1.43Å | |
| C04 | C05 | sing | 1.53Å | 1.52Å | |
| C02 | N03 | sing | 1.47Å | 1.28Å | |
| C27 | C26 | sing | 1.38Å | 1.38Å | Aromatic |
| N03 | C24 | sing | 1.47Å | 1.43Å | |
| C05 | C06 | sing | 1.53Å | 1.43Å | |
| O22 | C08 | doub | 1.22Å | 1.18Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C06 | C23 | sing | 1.53Å | 1.43Å | |
| C06 | N07 | sing | 1.47Å | 1.47Å | |
| C11 | C12 | sing | 1.55Å | 1.58Å | |
| C11 | C10 | sing | 1.54Å | 1.62Å | |
| C08 | N07 | sing | 1.35Å | 1.46Å | |
| C08 | N09 | sing | 1.35Å | 1.45Å | |
| C12 | C13 | sing | 1.55Å | 1.38Å | |
| C10 | N09 | sing | 1.47Å | 1.47Å | |
| C10 | C14 | sing | 1.54Å | 1.37Å | |
| C13 | C14 | sing | 1.54Å | 1.68Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C15 | C16 | sing | 1.51Å | 1.53Å | |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C16 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C13 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C15 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.09Å | 1.10Å | |
| C17 | H6 | sing | 1.08Å | 1.08Å | |
| C20 | H7 | sing | 1.08Å | 1.08Å | |
| C21 | H8 | sing | 1.08Å | 1.08Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C24 | H10 | sing | 1.09Å | 1.10Å | |
| C26 | H11 | sing | 1.08Å | 1.08Å | |
| C01 | H12 | sing | 1.09Å | 1.10Å | |
| C01 | H13 | sing | 1.09Å | 1.10Å | |
| C01 | H14 | sing | 1.09Å | 1.10Å | |
| C02 | H15 | sing | 1.09Å | 1.10Å | |
| C04 | H16 | sing | 1.09Å | 1.10Å | |
| C04 | H17 | sing | 1.09Å | 1.10Å | |
| C05 | H18 | sing | 1.09Å | 1.10Å | |
| C05 | H19 | sing | 1.09Å | 1.10Å | |
| C06 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C12 | H24 | sing | 1.09Å | 1.10Å | |
| C14 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.08Å | 1.08Å | |
| C19 | H27 | sing | 1.08Å | 1.08Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.08Å | 1.08Å | |
| C29 | H31 | sing | 1.08Å | 1.08Å | |
| C30 | H32 | sing | 1.08Å | 1.08Å | |
| N07 | H34 | sing | 0.97Å | 1.00Å | |
| N09 | H35 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C30 | C29 | N28 | 120.3° | 120.7° |
| C29 | C30 | C25 | 119.4° | 119.2° |
| C30 | C29 | H31 | 119.8° | 119.6° |
| C29 | C30 | H32 | 120.3° | 120.4° |
| C29 | N28 | C27 | 121.8° | 121.8° |
| N28 | C29 | H31 | 119.9° | 119.7° |
| C30 | C25 | C02 | 121.5° | 120.8° |
| C30 | C25 | C26 | 118.7° | 118.4° |
| C25 | C30 | H32 | 120.3° | 120.4° |
| C01 | C02 | C25 | 109.5° | 109.5° |
| C01 | C02 | N03 | 114.9° | 109.5° |
| C02 | C01 | H12 | 109.5° | 109.5° |
| C02 | C01 | H13 | 109.4° | 109.5° |
| C02 | C01 | H14 | 109.5° | 109.5° |
| C01 | C02 | H15 | 106.6° | 109.5° |
| N28 | C27 | C26 | 121.4° | 120.8° |
| N28 | C27 | H30 | 119.3° | 119.7° |
| C02 | C25 | C26 | 119.8° | 120.8° |
| C25 | C02 | N03 | 107.9° | 109.4° |
| C25 | C02 | H15 | 106.6° | 109.5° |
| C25 | C26 | C27 | 118.5° | 119.2° |
| C25 | C26 | H11 | 120.8° | 120.4° |
| N03 | C04 | C05 | 110.7° | 109.5° |
| C04 | N03 | C02 | 117.7° | 111.0° |
| C04 | N03 | C24 | 114.6° | 111.2° |
| N03 | C04 | H16 | 109.1° | 109.5° |
| N03 | C04 | H17 | 109.2° | 109.4° |
| C04 | C05 | C06 | 109.8° | 109.3° |
| C05 | C04 | H16 | 109.2° | 109.5° |
| C05 | C04 | H17 | 109.2° | 109.5° |
| C04 | C05 | H18 | 109.4° | 109.5° |
| C04 | C05 | H19 | 109.4° | 109.5° |
| C02 | N03 | C24 | 113.5° | 111.0° |
| N03 | C02 | H15 | 111.0° | 109.4° |
| C27 | C26 | H11 | 120.7° | 120.4° |
| C26 | C27 | H30 | 119.3° | 119.6° |
| N03 | C24 | C23 | 112.6° | 109.5° |
| N03 | C24 | H9 | 108.7° | 109.5° |
| N03 | C24 | H10 | 108.7° | 109.4° |
| C05 | C06 | C23 | 109.9° | 109.2° |
| C05 | C06 | N07 | 113.9° | 109.5° |
| C06 | C05 | H18 | 109.4° | 109.5° |
| C06 | C05 | H19 | 109.4° | 109.5° |
| C05 | C06 | H20 | 107.6° | 109.6° |
| O22 | C08 | N07 | 122.9° | 120.0° |
| O22 | C08 | N09 | 118.4° | 120.0° |
| C24 | C23 | C06 | 110.7° | 109.2° |
| C23 | C24 | H9 | 108.7° | 109.4° |
| C23 | C24 | H10 | 108.7° | 109.5° |
| C24 | C23 | H28 | 109.2° | 109.5° |
| C24 | C23 | H29 | 109.2° | 109.5° |
| C23 | C06 | N07 | 110.4° | 109.4° |
| C23 | C06 | H20 | 107.7° | 109.5° |
| C06 | C23 | H28 | 109.2° | 109.5° |
| C06 | C23 | H29 | 109.2° | 109.5° |
| C06 | N07 | C08 | 125.1° | 120.0° |
| N07 | C06 | H20 | 107.1° | 109.6° |
| C06 | N07 | H34 | 117.4° | 120.0° |
| C12 | C11 | C10 | 103.3° | 104.2° |
| C11 | C12 | C13 | 104.4° | 102.8° |
| C12 | C11 | H21 | 111.0° | 110.5° |
| C12 | C11 | H22 | 111.0° | 110.5° |
| C11 | C12 | H23 | 110.7° | 110.8° |
| C11 | C12 | H24 | 110.7° | 110.7° |
| C11 | C10 | N09 | 109.6° | 110.0° |
| C11 | C10 | C14 | 105.6° | 106.6° |
| C11 | C10 | H1 | 108.3° | 110.1° |
| C10 | C11 | H21 | 111.0° | 110.5° |
| C10 | C11 | H22 | 111.0° | 110.5° |
| N07 | C08 | N09 | 118.7° | 120.0° |
| C08 | N07 | H34 | 117.4° | 120.0° |
| C08 | N09 | C10 | 119.5° | 120.0° |
| C08 | N09 | H35 | 120.3° | 120.0° |
| C12 | C13 | C14 | 107.6° | 104.2° |
| C12 | C13 | H2 | 110.0° | 110.5° |
| C12 | C13 | H3 | 110.0° | 110.6° |
| C13 | C12 | H23 | 110.8° | 110.8° |
| C13 | C12 | H24 | 110.7° | 110.8° |
| N09 | C10 | C14 | 111.0° | 110.0° |
| N09 | C10 | H1 | 110.2° | 110.0° |
| C10 | N09 | H35 | 120.3° | 120.0° |
| C10 | C14 | C13 | 107.6° | 106.6° |
| C10 | C14 | C15 | 109.2° | 110.0° |
| C14 | C10 | H1 | 111.9° | 110.0° |
| C10 | C14 | H25 | 112.3° | 110.1° |
| C13 | C14 | C15 | 109.9° | 110.0° |
| C14 | C13 | H2 | 109.9° | 110.5° |
| C14 | C13 | H3 | 109.9° | 110.5° |
| C13 | C14 | H25 | 107.9° | 110.0° |
| C14 | C15 | C16 | 110.2° | 109.5° |
| C14 | C15 | H4 | 109.3° | 109.5° |
| C14 | C15 | H5 | 109.3° | 109.4° |
| C15 | C14 | H25 | 109.8° | 110.0° |
| C15 | C16 | C17 | 120.0° | 120.0° |
| C15 | C16 | C21 | 120.2° | 120.0° |
| C16 | C15 | H4 | 109.3° | 109.5° |
| C16 | C15 | H5 | 109.3° | 109.5° |
| C17 | C16 | C21 | 119.8° | 120.0° |
| C16 | C17 | C18 | 120.0° | 120.0° |
| C16 | C17 | H6 | 120.0° | 120.0° |
| C16 | C21 | C20 | 120.1° | 120.0° |
| C16 | C21 | H8 | 119.9° | 120.0° |
| C17 | C18 | C19 | 120.0° | 120.0° |
| C18 | C17 | H6 | 120.0° | 120.0° |
| C17 | C18 | H26 | 120.0° | 120.0° |
| C21 | C20 | C19 | 119.9° | 119.9° |
| C21 | C20 | H7 | 120.0° | 120.1° |
| C20 | C21 | H8 | 120.0° | 120.0° |
| C18 | C19 | C20 | 120.0° | 120.1° |
| C19 | C18 | H26 | 120.0° | 120.0° |
| C18 | C19 | H27 | 120.0° | 120.0° |
| C19 | C20 | H7 | 120.0° | 120.0° |
| C20 | C19 | H27 | 120.0° | 120.0° |
| H2 | C13 | H3 | 109.4° | 110.5° |
| H4 | C15 | H5 | 109.5° | 109.4° |
| H9 | C24 | H10 | 109.5° | 109.5° |
| H12 | C01 | H13 | 109.5° | 109.5° |
| H12 | C01 | H14 | 109.4° | 109.4° |
| H13 | C01 | H14 | 109.5° | 109.5° |
| H16 | C04 | H17 | 109.5° | 109.5° |
| H18 | C05 | H19 | 109.4° | 109.6° |
| H21 | C11 | H22 | 109.5° | 110.6° |
| H23 | C12 | H24 | 109.5° | 110.8° |
| H28 | C23 | H29 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C30 | C29 | N28 | H31 | 180.0° | 179.7° |
| C29 | C30 | C25 | H32 | 180.0° | 179.7° |
| C30 | C29 | N28 | C27 | 0.0° | 0.3° |
| C29 | C30 | C25 | C02 | 179.8° | 180.0° |
| C29 | C30 | C25 | C26 | 0.1° | 0.1° |
| N28 | C29 | C30 | C25 | 0.0° | 0.3° |
| C29 | N28 | C27 | C26 | 0.0° | 0.1° |
| C29 | N28 | C27 | H30 | 180.0° | 180.0° |
| N28 | C29 | C30 | H32 | 179.9° | 180.0° |
| C30 | C25 | C02 | C01 | 35.9° | 80.0° |
| C30 | C25 | C02 | C26 | 179.7° | 180.0° |
| C30 | C25 | C02 | N03 | 89.9° | 40.0° |
| C30 | C25 | C26 | C27 | 0.1° | 0.3° |
| C30 | C25 | C26 | H11 | 179.9° | 180.0° |
| C30 | C25 | C02 | H15 | 150.8° | 160.0° |
| C25 | C30 | C29 | H31 | 179.9° | 180.0° |
| C01 | C02 | C25 | N03 | 125.7° | 120.0° |
| C01 | C02 | C25 | H15 | 114.9° | 120.0° |
| C01 | C02 | C25 | C26 | 144.5° | 100.0° |
| C01 | C02 | N03 | C04 | 23.5° | 60.0° |
| C01 | C02 | N03 | H15 | 121.0° | 120.0° |
| C01 | C02 | N03 | C24 | 114.3° | 175.8° |
| C02 | C01 | H12 | H13 | 120.0° | 120.0° |
| C02 | C01 | H12 | H14 | 120.0° | 120.0° |
| C02 | C01 | H13 | H14 | 120.0° | 120.1° |
| N28 | C27 | C26 | C25 | 0.1° | 0.2° |
| N28 | C27 | C26 | H30 | 180.0° | 179.9° |
| N28 | C27 | C26 | H11 | 179.9° | 179.9° |
| C27 | N28 | C29 | H31 | 180.0° | 179.9° |
| C25 | C02 | N03 | C04 | 98.9° | 180.0° |
| C25 | C02 | N03 | H15 | 116.5° | 120.0° |
| C02 | C25 | C26 | C27 | 179.8° | 179.8° |
| C25 | C02 | N03 | C24 | 123.2° | 55.8° |
| C02 | C25 | C26 | H11 | 0.2° | 0.0° |
| C25 | C02 | C01 | H12 | 180.0° | 60.0° |
| C25 | C02 | C01 | H13 | 60.0° | 60.0° |
| C25 | C02 | C01 | H14 | 60.0° | 179.9° |
| C02 | C25 | C30 | H32 | 0.2° | 0.3° |
| C26 | C25 | C02 | N03 | 89.8° | 140.0° |
| C25 | C26 | C27 | H11 | 180.0° | 179.7° |
| C26 | C25 | C02 | H15 | 29.5° | 20.1° |
| C25 | C26 | C27 | H30 | 179.9° | 179.7° |
| C26 | C25 | C30 | H32 | 179.9° | 179.7° |
| N03 | C04 | C05 | H16 | 120.2° | 120.0° |
| N03 | C04 | C05 | H17 | 120.2° | 120.0° |
| C04 | N03 | C02 | C24 | 137.9° | 124.2° |
| N03 | C04 | C05 | C06 | 57.0° | 59.2° |
| C04 | N03 | C24 | C23 | 46.8° | 61.8° |
| C04 | N03 | C24 | H9 | 73.6° | 178.2° |
| C04 | N03 | C24 | H10 | 167.3° | 58.2° |
| C04 | N03 | C02 | H15 | 144.6° | 60.0° |
| N03 | C04 | H16 | H17 | 119.4° | 120.0° |
| N03 | C04 | C05 | H18 | 63.0° | 60.8° |
| N03 | C04 | C05 | H19 | 177.1° | 179.1° |
| C05 | C04 | N03 | C02 | 172.9° | 174.1° |
| C05 | C04 | N03 | C24 | 49.6° | 61.8° |
| C04 | C05 | C06 | H18 | 120.1° | 119.9° |
| C04 | C05 | C06 | H19 | 120.1° | 119.9° |
| C04 | C05 | C06 | C23 | 62.7° | 57.7° |
| C04 | C05 | C06 | N07 | 172.8° | 177.5° |
| C05 | C04 | H16 | H17 | 119.4° | 120.0° |
| C04 | C05 | H18 | H19 | 119.8° | 120.1° |
| C04 | C05 | C06 | H20 | 54.2° | 62.3° |
| C02 | N03 | C24 | C23 | 174.0° | 174.1° |
| C02 | N03 | C24 | H9 | 65.6° | 54.2° |
| C02 | N03 | C24 | H10 | 53.5° | 65.8° |
| N03 | C02 | C01 | H12 | 58.4° | 60.0° |
| N03 | C02 | C01 | H13 | 61.6° | 180.0° |
| N03 | C02 | C01 | H14 | 178.4° | 59.9° |
| C02 | N03 | C04 | H16 | 52.8° | 65.9° |
| C02 | N03 | C04 | H17 | 66.9° | 54.2° |
| N03 | C24 | C23 | H9 | 120.4° | 120.0° |
| N03 | C24 | C23 | H10 | 120.5° | 120.0° |
| N03 | C24 | C23 | C06 | 50.8° | 59.2° |
| N03 | C24 | H9 | H10 | 118.5° | 120.0° |
| C24 | N03 | C02 | H15 | 6.7° | 64.2° |
| C24 | N03 | C04 | H16 | 169.8° | 58.2° |
| C24 | N03 | C04 | H17 | 70.6° | 178.3° |
| N03 | C24 | C23 | H28 | 171.0° | 179.1° |
| N03 | C24 | C23 | H29 | 69.4° | 60.8° |
| C05 | C06 | C23 | C24 | 59.3° | 57.7° |
| C05 | C06 | C23 | N07 | 126.4° | 119.8° |
| C05 | C06 | C23 | H20 | 117.0° | 120.0° |
| C05 | C06 | N07 | H20 | 118.9° | 120.2° |
| C05 | C06 | N07 | C08 | 12.8° | 155.0° |
| C06 | C05 | C04 | H16 | 177.2° | 60.8° |
| C06 | C05 | C04 | H17 | 63.2° | 179.2° |
| C06 | C05 | H18 | H19 | 119.9° | 120.1° |
| C05 | C06 | C23 | H28 | 179.5° | 177.6° |
| C05 | C06 | C23 | H29 | 60.9° | 62.2° |
| C05 | C06 | N07 | H34 | 167.2° | 24.9° |
| O22 | C08 | N07 | C06 | 0.7° | 0.1° |
| O22 | C08 | N07 | N09 | 179.8° | 179.9° |
| O22 | C08 | N09 | C10 | 0.3° | 0.0° |
| O22 | C08 | N07 | H34 | 179.2° | 180.0° |
| O22 | C08 | N09 | H35 | 179.7° | 180.0° |
| C24 | C23 | C06 | H28 | 120.2° | 119.9° |
| C24 | C23 | C06 | H29 | 120.2° | 120.0° |
| C24 | C23 | C06 | N07 | 174.3° | 177.6° |
| C23 | C24 | H9 | H10 | 118.6° | 120.0° |
| C24 | C23 | C06 | H20 | 57.7° | 62.3° |
| C24 | C23 | H28 | H29 | 119.4° | 120.1° |
| C23 | C06 | N07 | H20 | 117.0° | 120.1° |
| C23 | C06 | N07 | C08 | 111.4° | 85.4° |
| C06 | C23 | C24 | H9 | 69.7° | 179.2° |
| C06 | C23 | C24 | H10 | 171.2° | 60.8° |
| C23 | C06 | C05 | H18 | 57.3° | 62.2° |
| C23 | C06 | C05 | H19 | 177.2° | 177.6° |
| C06 | C23 | H28 | H29 | 119.4° | 120.1° |
| C23 | C06 | N07 | H34 | 68.6° | 94.7° |
| C06 | N07 | C08 | H34 | 180.0° | 179.9° |
| C06 | N07 | C08 | N09 | 179.5° | 180.0° |
| N07 | C06 | C05 | H18 | 67.1° | 57.6° |
| N07 | C06 | C05 | H19 | 52.8° | 62.6° |
| N07 | C06 | C23 | H28 | 54.1° | 62.6° |
| N07 | C06 | C23 | H29 | 65.6° | 57.6° |
| C12 | C11 | C10 | H21 | 119.0° | 118.7° |
| C12 | C11 | C10 | H22 | 119.0° | 118.7° |
| C11 | C12 | C13 | H23 | 119.2° | 118.3° |
| C11 | C12 | C13 | H24 | 119.2° | 118.3° |
| C12 | C11 | C10 | N09 | 149.7° | 95.7° |
| C12 | C11 | C10 | C14 | 30.1° | 23.6° |
| C11 | C12 | C13 | C14 | 25.2° | 38.0° |
| C12 | C11 | C10 | H1 | 90.0° | 142.9° |
| C11 | C12 | C13 | H2 | 144.9° | 80.7° |
| C11 | C12 | C13 | H3 | 94.5° | 156.7° |
| C12 | C11 | H21 | H22 | 122.8° | 122.6° |
| C11 | C12 | H23 | H24 | 122.3° | 123.3° |
| C11 | C10 | N09 | C08 | 87.7° | 87.8° |
| C10 | C11 | C12 | C13 | 33.9° | 38.0° |
| C11 | C10 | N09 | C14 | 116.3° | 117.2° |
| C11 | C10 | N09 | H1 | 119.1° | 121.4° |
| C11 | C10 | C14 | H1 | 117.6° | 119.3° |
| C11 | C10 | C14 | C13 | 15.2° | 0.0° |
| C11 | C10 | C14 | C15 | 134.4° | 119.3° |
| C10 | C11 | H21 | H22 | 122.9° | 122.6° |
| C10 | C11 | C12 | H23 | 85.3° | 80.4° |
| C10 | C11 | C12 | H24 | 153.1° | 156.3° |
| C11 | C10 | C14 | H25 | 103.4° | 119.3° |
| C11 | C10 | N09 | H35 | 92.3° | 92.1° |
| N07 | C08 | N09 | C10 | 179.9° | 180.0° |
| C08 | N07 | C06 | H20 | 131.6° | 34.7° |
| N07 | C08 | N09 | H35 | 0.1° | 0.0° |
| C08 | N09 | C10 | H35 | 180.0° | 180.0° |
| C08 | N09 | C10 | C14 | 156.0° | 155.0° |
| C08 | N09 | C10 | H1 | 31.4° | 33.6° |
| N09 | C08 | N07 | H34 | 0.5° | 0.1° |
| C12 | C13 | C14 | C10 | 6.5° | 23.6° |
| C12 | C13 | C14 | H2 | 119.7° | 118.7° |
| C12 | C13 | C14 | H3 | 119.7° | 118.8° |
| C12 | C13 | C14 | C15 | 112.3° | 142.9° |
| C12 | C13 | H2 | H3 | 120.9° | 122.7° |
| C13 | C12 | C11 | H21 | 85.1° | 80.7° |
| C13 | C12 | C11 | H22 | 152.9° | 156.6° |
| C13 | C12 | H23 | H24 | 122.4° | 123.4° |
| C12 | C13 | C14 | H25 | 127.9° | 95.7° |
| N09 | C10 | C14 | H1 | 123.6° | 121.4° |
| N09 | C10 | C14 | C13 | 133.9° | 119.3° |
| N09 | C10 | C14 | C15 | 106.8° | 121.4° |
| N09 | C10 | C11 | H21 | 30.7° | 145.7° |
| N09 | C10 | C11 | H22 | 91.3° | 23.0° |
| N09 | C10 | C14 | H25 | 15.3° | 0.0° |
| C10 | C14 | C13 | C15 | 118.8° | 119.3° |
| C10 | C14 | C13 | H25 | 121.4° | 119.3° |
| C10 | C14 | C15 | H25 | 123.6° | 121.5° |
| C10 | C14 | C15 | C16 | 163.6° | 175.0° |
| C10 | C14 | C13 | H2 | 126.2° | 95.0° |
| C10 | C14 | C13 | H3 | 113.2° | 142.4° |
| C10 | C14 | C15 | H4 | 43.5° | 55.0° |
| C10 | C14 | C15 | H5 | 76.3° | 65.0° |
| C14 | C10 | C11 | H21 | 88.9° | 95.1° |
| C14 | C10 | C11 | H22 | 149.0° | 142.3° |
| C14 | C10 | N09 | H35 | 24.0° | 25.0° |
| C13 | C14 | C15 | H25 | 118.6° | 121.4° |
| C13 | C14 | C15 | C16 | 78.6° | 67.8° |
| C13 | C14 | C10 | H1 | 102.4° | 119.3° |
| C14 | C13 | H2 | H3 | 120.8° | 122.5° |
| C13 | C14 | C15 | H4 | 161.3° | 172.1° |
| C13 | C14 | C15 | H5 | 41.5° | 52.2° |
| C14 | C13 | C12 | H23 | 94.0° | 80.4° |
| C14 | C13 | C12 | H24 | 144.4° | 156.2° |
| C14 | C15 | C16 | H4 | 120.1° | 120.0° |
| C14 | C15 | C16 | H5 | 120.1° | 120.0° |
| C14 | C15 | C16 | C17 | 101.1° | 90.0° |
| C14 | C15 | C16 | C21 | 79.3° | 90.1° |
| C15 | C14 | C10 | H1 | 16.8° | 0.0° |
| C15 | C14 | C13 | H2 | 7.4° | 24.2° |
| C15 | C14 | C13 | H3 | 127.9° | 98.3° |
| C14 | C15 | H4 | H5 | 119.7° | 119.9° |
| C15 | C16 | C17 | C21 | 179.6° | 180.0° |
| C15 | C16 | C17 | C18 | 179.9° | 180.0° |
| C15 | C16 | C21 | C20 | 179.8° | 179.5° |
| C16 | C15 | H4 | H5 | 119.7° | 120.1° |
| C15 | C16 | C17 | H6 | 0.1° | 0.3° |
| C15 | C16 | C21 | H8 | 0.2° | 0.2° |
| C16 | C15 | C14 | H25 | 40.0° | 53.5° |
| C16 | C17 | C18 | H6 | 180.0° | 179.7° |
| C17 | C16 | C21 | C20 | 0.2° | 0.5° |
| C16 | C17 | C18 | C19 | 0.1° | 0.3° |
| C17 | C16 | C15 | H4 | 138.8° | 30.0° |
| C17 | C16 | C15 | H5 | 19.0° | 150.0° |
| C17 | C16 | C21 | H8 | 179.8° | 179.7° |
| C16 | C17 | C18 | H26 | 179.9° | 179.7° |
| C21 | C16 | C17 | C18 | 0.3° | 0.0° |
| C16 | C21 | C20 | H8 | 180.0° | 179.2° |
| C16 | C21 | C20 | C19 | 0.1° | 0.8° |
| C21 | C16 | C15 | H4 | 40.8° | 149.9° |
| C21 | C16 | C15 | H5 | 160.6° | 29.9° |
| C21 | C16 | C17 | H6 | 179.7° | 179.8° |
| C16 | C21 | C20 | H7 | 179.9° | 179.7° |
| C17 | C18 | C19 | H26 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.1° | 0.0° |
| C17 | C18 | C19 | H27 | 179.9° | 179.4° |
| C21 | C20 | C19 | C18 | 0.2° | 0.5° |
| C21 | C20 | C19 | H7 | 180.0° | 179.5° |
| C21 | C20 | C19 | H27 | 179.8° | 180.0° |
| C18 | C19 | C20 | H27 | 180.0° | 179.4° |
| C19 | C18 | C17 | H6 | 179.8° | 180.0° |
| C18 | C19 | C20 | H7 | 179.8° | 180.0° |
| C19 | C20 | C21 | H8 | 180.0° | 180.0° |
| C20 | C19 | C18 | H26 | 179.9° | 180.0° |
| H1 | C10 | C11 | H21 | 151.0° | 24.2° |
| H1 | C10 | C11 | H22 | 29.0° | 98.4° |
| H1 | C10 | C14 | H25 | 138.9° | 121.4° |
| H1 | C10 | N09 | H35 | 148.6° | 146.4° |
| H2 | C13 | C12 | H23 | 25.7° | 161.0° |
| H2 | C13 | C12 | H24 | 95.9° | 37.6° |
| H2 | C13 | C14 | H25 | 112.4° | 145.6° |
| H3 | C13 | C12 | H23 | 146.3° | 38.3° |
| H3 | C13 | C12 | H24 | 24.7° | 85.1° |
| H3 | C13 | C14 | H25 | 8.2° | 23.1° |
| H4 | C15 | C14 | H25 | 80.1° | 66.5° |
| H5 | C15 | C14 | H25 | 160.1° | 173.6° |
| H6 | C17 | C18 | H26 | 0.1° | 0.0° |
| H7 | C20 | C21 | H8 | 0.1° | 0.5° |
| H7 | C20 | C19 | H27 | 0.2° | 0.5° |
| H9 | C24 | C23 | H28 | 50.5° | 60.9° |
| H9 | C24 | C23 | H29 | 170.1° | 59.2° |
| H10 | C24 | C23 | H28 | 68.6° | 59.1° |
| H10 | C24 | C23 | H29 | 51.1° | 179.3° |
| H11 | C26 | C27 | H30 | 0.1° | 0.0° |
| H12 | C01 | H13 | H14 | 120.0° | 120.0° |
| H12 | C01 | C02 | H15 | 65.0° | 179.9° |
| H13 | C01 | C02 | H15 | 175.0° | 60.0° |
| H14 | C01 | C02 | H15 | 55.0° | 60.0° |
| H16 | C04 | C05 | H18 | 57.1° | 179.2° |
| H16 | C04 | C05 | H19 | 62.7° | 59.1° |
| H17 | C04 | C05 | H18 | 176.8° | 59.2° |
| H17 | C04 | C05 | H19 | 56.9° | 60.9° |
| H18 | C05 | C06 | H20 | 174.3° | 177.8° |
| H19 | C05 | C06 | H20 | 65.8° | 57.6° |
| H20 | C06 | C23 | H28 | 62.6° | 57.6° |
| H20 | C06 | C23 | H29 | 177.8° | 177.8° |
| H20 | C06 | N07 | H34 | 48.4° | 145.1° |
| H21 | C11 | C12 | H23 | 155.7° | 161.0° |
| H21 | C11 | C12 | H24 | 34.1° | 37.6° |
| H22 | C11 | C12 | H23 | 33.7° | 38.3° |
| H22 | C11 | C12 | H24 | 87.9° | 85.0° |
| H26 | C18 | C19 | H27 | 0.1° | 0.5° |
| H31 | C29 | C30 | H32 | 0.1° | 0.3° |
