K4A
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C34 | C33 | sing | 1.53Å | 1.49Å | |
| C33 | N29 | sing | 1.47Å | 1.48Å | |
| N30 | N29 | sing | 1.40Å | 1.37Å | Aromatic |
| N30 | C31 | doub | 1.31Å | 1.32Å | Aromatic |
| N29 | C28 | sing | 1.35Å | 1.35Å | Aromatic |
| C31 | C11 | sing | 1.41Å | 1.41Å | Aromatic |
| C28 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C32 | sing | 1.51Å | 1.49Å | |
| C11 | C02 | sing | 1.48Å | 1.45Å | |
| C02 | N01 | sing | 1.37Å | 1.42Å | Aromatic |
| C02 | N03 | doub | 1.31Å | 1.31Å | Aromatic |
| C10 | N01 | sing | 1.46Å | 1.46Å | |
| N01 | C09 | sing | 1.37Å | 1.38Å | Aromatic |
| N03 | C04 | sing | 1.35Å | 1.39Å | Aromatic |
| C04 | C09 | doub | 1.40Å | 1.39Å | Aromatic |
| C04 | C05 | sing | 1.41Å | 1.42Å | Aromatic |
| C09 | N08 | sing | 1.33Å | 1.34Å | Aromatic |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | N12 | sing | 1.47Å | 1.47Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| N08 | C07 | doub | 1.32Å | 1.34Å | Aromatic |
| C05 | N12 | sing | 1.38Å | 1.40Å | |
| C05 | N06 | doub | 1.33Å | 1.34Å | Aromatic |
| N12 | C17 | sing | 1.47Å | 1.47Å | |
| O27 | C19 | doub | 1.22Å | 1.22Å | |
| C15 | N18 | sing | 1.47Å | 1.46Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C19 | N18 | sing | 1.35Å | 1.46Å | |
| C19 | N20 | sing | 1.35Å | 1.37Å | |
| N18 | C26 | sing | 1.39Å | 1.39Å | |
| C07 | N06 | sing | 1.32Å | 1.34Å | Aromatic |
| N20 | C21 | sing | 1.39Å | 1.38Å | |
| C26 | C25 | doub | 1.39Å | 1.39Å | Aromatic |
| C26 | C21 | sing | 1.40Å | 1.39Å | Aromatic |
| C25 | C24 | sing | 1.39Å | 1.39Å | Aromatic |
| C21 | N22 | doub | 1.32Å | 1.35Å | Aromatic |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| N22 | C23 | sing | 1.32Å | 1.35Å | Aromatic |
| C24 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C07 | H1 | sing | 1.08Å | 1.08Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C14 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| N20 | H14 | sing | 0.97Å | 1.00Å | |
| C23 | H15 | sing | 1.08Å | 1.08Å | |
| C24 | H16 | sing | 1.08Å | 1.08Å | |
| C25 | H17 | sing | 1.08Å | 1.08Å | |
| C31 | H18 | sing | 1.08Å | 1.08Å | |
| C32 | H19 | sing | 1.09Å | 1.10Å | |
| C32 | H20 | sing | 1.09Å | 1.10Å | |
| C32 | H21 | sing | 1.09Å | 1.10Å | |
| C33 | H22 | sing | 1.09Å | 1.10Å | |
| C33 | H23 | sing | 1.09Å | 1.10Å | |
| C34 | H24 | sing | 1.09Å | 1.10Å | |
| C34 | H25 | sing | 1.09Å | 1.10Å | |
| C34 | H26 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C34 | C33 | N29 | 111.4° | 109.4° |
| C34 | C33 | H22 | 109.0° | 109.5° |
| C34 | C33 | H23 | 109.0° | 109.4° |
| C33 | C34 | H24 | 109.5° | 109.4° |
| C33 | C34 | H25 | 109.5° | 109.4° |
| C33 | C34 | H26 | 109.4° | 109.5° |
| C33 | N29 | N30 | 121.9° | 125.8° |
| C33 | N29 | C28 | 126.2° | 125.8° |
| N29 | C33 | H22 | 109.0° | 109.5° |
| N29 | C33 | H23 | 109.0° | 109.5° |
| N29 | N30 | C31 | 104.9° | 108.8° |
| N30 | N29 | C28 | 111.7° | 108.4° |
| N30 | C31 | C11 | 112.0° | 108.1° |
| N30 | C31 | H18 | 124.0° | 125.9° |
| N29 | C28 | C11 | 106.8° | 107.4° |
| N29 | C28 | C32 | 123.4° | 126.3° |
| C31 | C11 | C28 | 104.6° | 107.3° |
| C31 | C11 | C02 | 128.7° | 126.4° |
| C11 | C31 | H18 | 124.0° | 125.9° |
| C11 | C28 | C32 | 129.7° | 126.3° |
| C28 | C11 | C02 | 126.7° | 126.3° |
| C28 | C32 | H19 | 109.5° | 109.5° |
| C28 | C32 | H20 | 109.5° | 109.5° |
| C28 | C32 | H21 | 109.5° | 109.5° |
| C11 | C02 | N01 | 124.9° | 125.1° |
| C11 | C02 | N03 | 122.3° | 125.2° |
| N01 | C02 | N03 | 112.8° | 109.7° |
| C02 | N01 | C10 | 128.5° | 126.3° |
| C02 | N01 | C09 | 105.2° | 107.3° |
| C02 | N03 | C04 | 104.5° | 109.4° |
| C10 | N01 | C09 | 126.2° | 126.3° |
| N01 | C10 | H2 | 109.5° | 109.5° |
| N01 | C10 | H3 | 109.5° | 109.5° |
| N01 | C10 | H4 | 109.4° | 109.5° |
| N01 | C09 | C04 | 106.3° | 106.2° |
| N01 | C09 | N08 | 127.1° | 134.7° |
| N03 | C04 | C09 | 111.2° | 107.4° |
| N03 | C04 | C05 | 136.3° | 134.5° |
| C09 | C04 | C05 | 112.5° | 118.1° |
| C04 | C09 | N08 | 126.6° | 119.1° |
| C04 | C05 | N12 | 120.0° | 120.8° |
| C04 | C05 | N06 | 124.5° | 118.4° |
| C09 | N08 | C07 | 112.9° | 120.6° |
| C14 | C13 | N12 | 109.7° | 109.5° |
| C13 | C14 | C15 | 110.1° | 109.3° |
| C14 | C13 | H5 | 109.4° | 109.5° |
| C14 | C13 | H6 | 109.4° | 109.4° |
| C13 | C14 | H7 | 109.3° | 109.5° |
| C13 | C14 | H8 | 109.3° | 109.6° |
| C13 | N12 | C05 | 123.0° | 111.0° |
| C13 | N12 | C17 | 110.3° | 111.2° |
| N12 | C13 | H5 | 109.4° | 109.5° |
| N12 | C13 | H6 | 109.4° | 109.5° |
| C14 | C15 | N18 | 112.1° | 109.5° |
| C14 | C15 | C16 | 112.1° | 109.1° |
| C15 | C14 | H7 | 109.3° | 109.5° |
| C15 | C14 | H8 | 109.3° | 109.5° |
| C14 | C15 | H9 | 106.5° | 109.6° |
| N08 | C07 | N06 | 129.4° | 122.4° |
| N08 | C07 | H1 | 115.3° | 118.8° |
| N12 | C05 | N06 | 115.4° | 120.8° |
| C05 | N12 | C17 | 121.2° | 111.0° |
| C05 | N06 | C07 | 114.0° | 121.2° |
| N12 | C17 | C16 | 109.7° | 109.5° |
| N12 | C17 | H12 | 109.4° | 109.5° |
| N12 | C17 | H13 | 109.4° | 109.5° |
| O27 | C19 | N18 | 122.6° | 125.2° |
| O27 | C19 | N20 | 127.5° | 125.2° |
| N18 | C15 | C16 | 111.9° | 109.5° |
| C15 | N18 | C19 | 126.3° | 125.9° |
| C15 | N18 | C26 | 129.5° | 125.9° |
| N18 | C15 | H9 | 107.2° | 109.5° |
| C15 | C16 | C17 | 110.8° | 109.3° |
| C16 | C15 | H9 | 106.5° | 109.5° |
| C15 | C16 | H10 | 109.1° | 109.5° |
| C15 | C16 | H11 | 109.1° | 109.5° |
| N18 | C19 | N20 | 109.9° | 109.6° |
| C19 | N18 | C26 | 104.1° | 108.2° |
| C19 | N20 | C21 | 107.2° | 108.6° |
| C19 | N20 | H14 | 126.4° | 125.7° |
| N18 | C26 | C25 | 130.8° | 133.7° |
| N18 | C26 | C21 | 109.1° | 106.9° |
| N06 | C07 | H1 | 115.3° | 118.7° |
| N20 | C21 | C26 | 109.6° | 106.6° |
| N20 | C21 | N22 | 128.3° | 133.1° |
| C21 | N20 | H14 | 126.4° | 125.7° |
| C25 | C26 | C21 | 120.0° | 119.4° |
| C26 | C25 | C24 | 117.9° | 118.2° |
| C26 | C25 | H17 | 121.0° | 120.9° |
| C26 | C21 | N22 | 122.1° | 120.3° |
| C25 | C24 | C23 | 118.8° | 119.4° |
| C25 | C24 | H16 | 120.6° | 120.4° |
| C24 | C25 | H17 | 121.0° | 120.9° |
| C21 | N22 | C23 | 117.2° | 121.6° |
| C17 | C16 | H10 | 109.2° | 109.5° |
| C17 | C16 | H11 | 109.1° | 109.5° |
| C16 | C17 | H12 | 109.4° | 109.4° |
| C16 | C17 | H13 | 109.4° | 109.5° |
| N22 | C23 | C24 | 123.9° | 121.1° |
| N22 | C23 | H15 | 118.1° | 119.4° |
| C24 | C23 | H15 | 118.0° | 119.5° |
| C23 | C24 | H16 | 120.6° | 120.3° |
| H2 | C10 | H3 | 109.5° | 109.4° |
| H2 | C10 | H4 | 109.5° | 109.4° |
| H3 | C10 | H4 | 109.5° | 109.5° |
| H5 | C13 | H6 | 109.4° | 109.5° |
| H7 | C14 | H8 | 109.5° | 109.6° |
| H10 | C16 | H11 | 109.5° | 109.5° |
| H12 | C17 | H13 | 109.5° | 109.5° |
| H19 | C32 | H20 | 109.5° | 109.5° |
| H19 | C32 | H21 | 109.5° | 109.4° |
| H20 | C32 | H21 | 109.5° | 109.5° |
| H22 | C33 | H23 | 109.5° | 109.5° |
| H24 | C34 | H25 | 109.5° | 109.5° |
| H24 | C34 | H26 | 109.5° | 109.5° |
| H25 | C34 | H26 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C34 | C33 | N29 | H22 | 120.3° | 120.0° |
| C34 | C33 | N29 | H23 | 120.3° | 119.9° |
| C34 | C33 | N29 | N30 | 13.4° | 90.1° |
| C34 | C33 | N29 | C28 | 172.2° | 90.0° |
| C34 | C33 | H22 | H23 | 119.1° | 120.0° |
| C33 | C34 | H24 | H25 | 120.0° | 119.9° |
| C33 | C34 | H24 | H26 | 120.0° | 120.0° |
| C33 | C34 | H25 | H26 | 120.0° | 120.0° |
| C33 | N29 | N30 | C28 | 175.2° | 179.9° |
| C33 | N29 | N30 | C31 | 175.4° | 179.8° |
| C33 | N29 | C28 | C11 | 174.7° | 179.9° |
| C33 | N29 | C28 | C32 | 3.0° | 0.1° |
| N29 | C33 | H22 | H23 | 119.1° | 120.1° |
| N29 | C33 | C34 | H24 | 180.0° | 60.0° |
| N29 | C33 | C34 | H25 | 60.0° | 180.0° |
| N29 | C33 | C34 | H26 | 60.0° | 60.0° |
| N29 | N30 | C31 | C11 | 0.6° | 0.5° |
| N30 | N29 | C28 | C11 | 0.2° | 0.0° |
| N30 | N29 | C28 | C32 | 177.9° | 180.0° |
| N29 | N30 | C31 | H18 | 179.4° | 180.0° |
| N30 | N29 | C33 | H22 | 133.7° | 29.9° |
| N30 | N29 | C33 | H23 | 106.9° | 150.0° |
| C31 | N30 | N29 | C28 | 0.3° | 0.3° |
| N30 | C31 | C11 | H18 | 180.0° | 179.5° |
| N30 | C31 | C11 | C28 | 0.7° | 0.4° |
| N30 | C31 | C11 | C02 | 178.8° | 179.8° |
| N29 | C28 | C11 | C31 | 0.5° | 0.2° |
| N29 | C28 | C11 | C32 | 177.5° | 180.0° |
| N29 | C28 | C11 | C02 | 178.7° | 180.0° |
| N29 | C28 | C32 | H19 | 88.8° | 90.0° |
| N29 | C28 | C32 | H20 | 151.2° | 30.0° |
| N29 | C28 | C32 | H21 | 31.2° | 150.0° |
| C28 | N29 | C33 | H22 | 51.9° | 150.0° |
| C28 | N29 | C33 | H23 | 67.5° | 29.9° |
| C31 | C11 | C28 | C02 | 178.1° | 179.7° |
| C31 | C11 | C28 | C32 | 178.1° | 179.8° |
| C31 | C11 | C02 | N01 | 25.1° | 46.4° |
| C31 | C11 | C02 | N03 | 155.8° | 133.6° |
| C28 | C11 | C02 | N01 | 157.3° | 133.3° |
| C28 | C11 | C02 | N03 | 21.9° | 46.7° |
| C28 | C11 | C31 | H18 | 179.3° | 180.0° |
| C11 | C28 | C32 | H19 | 88.4° | 90.0° |
| C11 | C28 | C32 | H20 | 31.6° | 150.0° |
| C11 | C28 | C32 | H21 | 151.6° | 30.0° |
| C32 | C28 | C11 | C02 | 3.8° | 0.0° |
| C28 | C32 | H19 | H20 | 120.0° | 120.0° |
| C28 | C32 | H19 | H21 | 120.0° | 120.0° |
| C28 | C32 | H20 | H21 | 120.0° | 120.1° |
| C11 | C02 | N01 | N03 | 179.2° | 180.0° |
| C11 | C02 | N01 | C10 | 1.2° | 0.2° |
| C11 | C02 | N01 | C09 | 179.0° | 180.0° |
| C11 | C02 | N03 | C04 | 179.8° | 180.0° |
| C02 | C11 | C31 | H18 | 1.2° | 0.3° |
| C02 | N01 | C10 | C09 | 177.4° | 179.8° |
| N01 | C02 | N03 | C04 | 0.6° | 0.0° |
| C02 | N01 | C09 | C04 | 1.0° | 0.1° |
| C02 | N01 | C09 | N08 | 180.0° | 180.0° |
| C02 | N01 | C10 | H2 | 180.0° | 84.5° |
| C02 | N01 | C10 | H3 | 60.0° | 35.4° |
| C02 | N01 | C10 | H4 | 60.0° | 155.5° |
| N03 | C02 | N01 | C10 | 178.0° | 179.8° |
| N03 | C02 | N01 | C09 | 0.2° | 0.1° |
| C02 | N03 | C04 | C09 | 1.2° | 0.0° |
| C02 | N03 | C04 | C05 | 176.8° | 180.0° |
| C10 | N01 | C09 | C04 | 178.8° | 179.8° |
| C10 | N01 | C09 | N08 | 2.2° | 0.2° |
| N01 | C10 | H2 | H3 | 120.0° | 120.0° |
| N01 | C10 | H2 | H4 | 120.0° | 120.0° |
| N01 | C10 | H3 | H4 | 120.0° | 120.1° |
| N01 | C09 | C04 | N03 | 1.4° | 0.0° |
| N01 | C09 | C04 | N08 | 179.0° | 180.0° |
| N01 | C09 | C04 | C05 | 177.2° | 180.0° |
| N01 | C09 | N08 | C07 | 177.2° | 179.9° |
| C09 | N01 | C10 | H2 | 2.6° | 95.2° |
| C09 | N01 | C10 | H3 | 117.4° | 144.8° |
| C09 | N01 | C10 | H4 | 122.6° | 24.7° |
| N03 | C04 | C09 | C05 | 178.6° | 180.0° |
| N03 | C04 | C09 | N08 | 179.6° | 180.0° |
| N03 | C04 | C05 | N12 | 0.3° | 0.0° |
| N03 | C04 | C05 | N06 | 179.4° | 180.0° |
| C04 | C09 | N08 | C07 | 1.6° | 0.0° |
| C09 | C04 | C05 | N12 | 177.8° | 180.0° |
| C09 | C04 | C05 | N06 | 1.4° | 0.0° |
| C05 | C04 | C09 | N08 | 1.8° | 0.0° |
| C04 | C05 | N12 | C13 | 29.9° | 55.8° |
| C04 | C05 | N12 | N06 | 179.2° | 180.0° |
| C04 | C05 | N12 | C17 | 178.9° | 180.0° |
| C04 | C05 | N06 | C07 | 0.8° | 0.0° |
| C09 | N08 | C07 | N06 | 1.0° | 0.1° |
| C09 | N08 | C07 | H1 | 179.0° | 180.0° |
| C14 | C13 | N12 | H5 | 120.1° | 120.0° |
| C14 | C13 | N12 | H6 | 120.1° | 120.0° |
| C13 | C14 | C15 | H7 | 120.1° | 119.8° |
| C13 | C14 | C15 | H8 | 120.1° | 120.0° |
| C14 | C13 | N12 | C05 | 141.8° | 174.1° |
| C14 | C13 | N12 | C17 | 64.2° | 61.8° |
| C13 | C14 | C15 | N18 | 178.6° | 177.6° |
| C13 | C14 | C15 | C16 | 51.7° | 57.7° |
| C14 | C13 | H5 | H6 | 119.9° | 120.0° |
| C13 | C14 | H7 | H8 | 119.7° | 120.1° |
| C13 | C14 | C15 | H9 | 64.4° | 62.2° |
| N12 | C13 | C14 | C15 | 57.7° | 59.2° |
| C13 | N12 | C05 | C17 | 151.3° | 124.2° |
| C13 | N12 | C05 | N06 | 149.3° | 124.2° |
| C13 | N12 | C17 | C16 | 62.9° | 61.8° |
| N12 | C13 | H5 | H6 | 119.8° | 120.0° |
| N12 | C13 | C14 | H7 | 177.8° | 179.1° |
| N12 | C13 | C14 | H8 | 62.4° | 60.8° |
| C13 | N12 | C17 | H12 | 177.1° | 178.3° |
| C13 | N12 | C17 | H13 | 57.1° | 58.3° |
| C14 | C15 | N18 | C16 | 127.0° | 119.6° |
| C14 | C15 | N18 | H9 | 116.6° | 120.2° |
| C14 | C15 | C16 | H9 | 116.1° | 120.0° |
| C14 | C15 | N18 | C19 | 110.8° | 60.3° |
| C14 | C15 | N18 | C26 | 71.8° | 120.1° |
| C14 | C15 | C16 | C17 | 50.9° | 57.7° |
| C15 | C14 | C13 | H5 | 177.7° | 60.8° |
| C15 | C14 | C13 | H6 | 62.3° | 179.2° |
| C15 | C14 | H7 | H8 | 119.7° | 120.1° |
| C14 | C15 | C16 | H10 | 171.1° | 177.6° |
| C14 | C15 | C16 | H11 | 69.3° | 62.3° |
| N08 | C07 | N06 | C05 | 0.6° | 0.1° |
| N08 | C07 | N06 | H1 | 180.0° | 179.9° |
| N12 | C05 | N06 | C07 | 178.3° | 180.0° |
| C05 | N12 | C17 | C16 | 142.6° | 174.2° |
| C05 | N12 | C13 | H5 | 21.8° | 65.8° |
| C05 | N12 | C13 | H6 | 98.1° | 54.2° |
| C05 | N12 | C17 | H12 | 22.5° | 54.2° |
| C05 | N12 | C17 | H13 | 97.4° | 65.8° |
| N06 | C05 | N12 | C17 | 1.9° | 0.0° |
| C05 | N06 | C07 | H1 | 179.4° | 180.0° |
| N12 | C17 | C16 | C15 | 55.6° | 59.2° |
| N12 | C17 | C16 | H12 | 120.1° | 120.0° |
| N12 | C17 | C16 | H13 | 120.0° | 120.0° |
| C17 | N12 | C13 | H5 | 175.8° | 58.2° |
| C17 | N12 | C13 | H6 | 55.9° | 178.3° |
| N12 | C17 | C16 | H10 | 175.8° | 179.1° |
| N12 | C17 | C16 | H11 | 64.6° | 60.8° |
| N12 | C17 | H12 | H13 | 119.9° | 120.0° |
| O27 | C19 | N18 | C15 | 2.0° | 0.0° |
| O27 | C19 | N18 | N20 | 179.7° | 180.0° |
| O27 | C19 | N18 | C26 | 180.0° | 179.7° |
| O27 | C19 | N20 | C21 | 178.9° | 180.0° |
| O27 | C19 | N20 | H14 | 1.2° | 0.0° |
| N18 | C15 | C16 | H9 | 116.8° | 120.1° |
| C15 | N18 | C19 | C26 | 178.0° | 179.7° |
| C15 | N18 | C19 | N20 | 178.3° | 180.0° |
| C15 | N18 | C26 | C25 | 3.2° | 0.8° |
| C15 | N18 | C26 | C21 | 179.2° | 179.8° |
| N18 | C15 | C16 | C17 | 177.9° | 177.6° |
| N18 | C15 | C14 | H7 | 61.3° | 62.6° |
| N18 | C15 | C14 | H8 | 58.6° | 57.6° |
| N18 | C15 | C16 | H10 | 61.9° | 62.5° |
| N18 | C15 | C16 | H11 | 57.7° | 57.6° |
| C16 | C15 | N18 | C19 | 122.2° | 59.4° |
| C16 | C15 | N18 | C26 | 55.3° | 120.3° |
| C15 | C16 | C17 | H10 | 120.2° | 119.9° |
| C15 | C16 | C17 | H11 | 120.2° | 120.0° |
| C16 | C15 | C14 | H7 | 171.8° | 177.6° |
| C16 | C15 | C14 | H8 | 68.4° | 62.3° |
| C15 | C16 | H10 | H11 | 119.4° | 120.1° |
| C15 | C16 | C17 | H12 | 175.7° | 179.2° |
| C15 | C16 | C17 | H13 | 64.4° | 60.8° |
| N18 | C19 | N20 | C21 | 0.9° | 0.0° |
| C19 | N18 | C26 | C25 | 179.0° | 179.5° |
| C19 | N18 | C26 | C21 | 1.3° | 0.5° |
| C19 | N18 | C15 | H9 | 5.8° | 179.5° |
| N18 | C19 | N20 | H14 | 179.1° | 180.0° |
| N20 | C19 | N18 | C26 | 0.3° | 0.3° |
| C19 | N20 | C21 | H14 | 180.0° | 180.0° |
| C19 | N20 | C21 | C26 | 1.7° | 0.3° |
| C19 | N20 | C21 | N22 | 178.7° | 179.9° |
| N18 | C26 | C21 | N20 | 1.9° | 0.5° |
| N18 | C26 | C25 | C21 | 177.4° | 178.9° |
| N18 | C26 | C25 | C24 | 178.1° | 179.5° |
| N18 | C26 | C21 | N22 | 178.5° | 179.8° |
| C26 | N18 | C15 | H9 | 171.7° | 0.2° |
| N18 | C26 | C25 | H17 | 1.9° | 0.7° |
| N20 | C21 | C26 | C25 | 179.9° | 179.6° |
| N20 | C21 | C26 | N22 | 179.6° | 179.7° |
| N20 | C21 | N22 | C23 | 179.7° | 180.0° |
| C26 | C25 | C24 | H17 | 180.0° | 179.8° |
| C25 | C26 | C21 | N22 | 0.5° | 0.7° |
| C26 | C25 | C24 | C23 | 0.6° | 0.3° |
| C26 | C25 | C24 | H16 | 179.4° | 179.7° |
| C21 | C26 | C25 | C24 | 0.7° | 0.6° |
| C26 | C21 | N22 | C23 | 0.2° | 0.4° |
| C26 | C21 | N20 | H14 | 178.3° | 179.7° |
| C21 | C26 | C25 | H17 | 179.3° | 179.6° |
| C25 | C24 | C23 | N22 | 0.3° | 0.0° |
| C25 | C24 | C23 | H16 | 180.0° | 180.0° |
| C25 | C24 | C23 | H15 | 179.7° | 180.0° |
| C21 | N22 | C23 | C24 | 0.1° | 0.0° |
| N22 | C21 | N20 | H14 | 1.3° | 0.0° |
| C21 | N22 | C23 | H15 | 179.9° | 180.0° |
| C17 | C16 | C15 | H9 | 65.2° | 62.3° |
| C17 | C16 | H10 | H11 | 119.4° | 120.1° |
| C16 | C17 | H12 | H13 | 119.9° | 120.0° |
| N22 | C23 | C24 | H15 | 180.0° | 180.0° |
| N22 | C23 | C24 | H16 | 179.7° | 180.0° |
| C23 | C24 | C25 | H17 | 179.4° | 179.9° |
| H2 | C10 | H3 | H4 | 120.0° | 119.9° |
| H5 | C13 | C14 | H7 | 62.2° | 59.1° |
| H5 | C13 | C14 | H8 | 57.6° | 179.2° |
| H6 | C13 | C14 | H7 | 57.7° | 61.0° |
| H6 | C13 | C14 | H8 | 177.6° | 59.2° |
| H7 | C14 | C15 | H9 | 55.7° | 57.6° |
| H8 | C14 | C15 | H9 | 175.5° | 177.8° |
| H9 | C15 | C16 | H10 | 55.0° | 57.6° |
| H9 | C15 | C16 | H11 | 174.6° | 177.7° |
| H10 | C16 | C17 | H12 | 64.2° | 60.9° |
| H10 | C16 | C17 | H13 | 55.8° | 59.1° |
| H11 | C16 | C17 | H12 | 55.5° | 59.2° |
| H11 | C16 | C17 | H13 | 175.4° | 179.2° |
| H15 | C23 | C24 | H16 | 0.3° | 0.0° |
| H16 | C24 | C25 | H17 | 0.6° | 0.1° |
| H19 | C32 | H20 | H21 | 120.0° | 119.9° |
| H22 | C33 | C34 | H24 | 59.7° | 60.0° |
| H22 | C33 | C34 | H25 | 60.3° | 59.9° |
| H22 | C33 | C34 | H26 | 179.7° | NaN° |
| H23 | C33 | C34 | H24 | 59.7° | 180.0° |
| H23 | C33 | C34 | H25 | 179.7° | 60.0° |
| H23 | C33 | C34 | H26 | 60.3° | 60.0° |
| H24 | C34 | H25 | H26 | 120.0° | 120.0° |
