KTF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C22 | C23 | sing | 1.53Å | 1.52Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| C23 | C18 | sing | 1.53Å | 1.53Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C18 | C2 | sing | 1.51Å | 1.52Å | |
| C2 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | C | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.39Å | Aromatic |
| C | C5 | sing | 1.40Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.48Å | 1.47Å | |
| N4 | C17 | trip | 1.14Å | 1.14Å | |
| C7 | C6 | doub | 1.37Å | 1.37Å | |
| C7 | C8 | sing | 1.41Å | 1.43Å | |
| C6 | N1 | sing | 1.37Å | 1.39Å | |
| C17 | C15 | sing | 1.47Å | 1.47Å | |
| C8 | O | doub | 1.22Å | 1.23Å | |
| C8 | N | sing | 1.35Å | 1.41Å | |
| N1 | C9 | sing | 1.37Å | 1.37Å | |
| C15 | C16 | sing | 1.55Å | 1.55Å | |
| C15 | C14 | sing | 1.55Å | 1.54Å | |
| C16 | N3 | sing | 1.47Å | 1.46Å | |
| N | C9 | sing | 1.36Å | 1.36Å | Aromatic |
| N | N2 | sing | 1.40Å | 1.37Å | Aromatic |
| C9 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.54Å | 1.52Å | |
| N2 | C11 | doub | 1.30Å | 1.32Å | Aromatic |
| C10 | C11 | sing | 1.41Å | 1.41Å | Aromatic |
| C10 | C12 | sing | 1.47Å | 1.50Å | |
| N3 | C12 | sing | 1.35Å | 1.34Å | |
| N3 | C13 | sing | 1.47Å | 1.46Å | |
| C12 | O1 | doub | 1.22Å | 1.23Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C7 | H2 | sing | 1.08Å | 1.08Å | |
| C1 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| C | H6 | sing | 1.08Å | 1.08Å | |
| C11 | H7 | sing | 1.08Å | 1.08Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.09Å | 1.10Å | |
| C15 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C22 | C23 | 111.2° | 109.5° |
| C22 | C21 | C20 | 111.3° | 109.5° |
| C22 | C21 | H20 | 109.0° | 109.5° |
| C22 | C21 | H21 | 109.0° | 109.5° |
| C21 | C22 | H22 | 109.0° | 109.5° |
| C21 | C22 | H23 | 109.0° | 109.5° |
| C22 | C23 | C18 | 111.1° | 109.4° |
| C23 | C22 | H22 | 109.0° | 109.5° |
| C23 | C22 | H23 | 109.0° | 109.4° |
| C22 | C23 | H24 | 109.1° | 109.5° |
| C22 | C23 | H25 | 109.1° | 109.4° |
| C21 | C20 | C19 | 111.3° | 109.5° |
| C21 | C20 | H18 | 109.0° | 109.5° |
| C21 | C20 | H19 | 109.0° | 109.4° |
| C20 | C21 | H20 | 109.0° | 109.4° |
| C20 | C21 | H21 | 109.0° | 109.5° |
| C20 | C19 | C18 | 111.1° | 109.5° |
| C20 | C19 | H16 | 109.0° | 109.5° |
| C20 | C19 | H17 | 109.0° | 109.4° |
| C19 | C20 | H18 | 109.0° | 109.5° |
| C19 | C20 | H19 | 109.0° | 109.5° |
| C23 | C18 | C19 | 109.2° | 109.5° |
| C23 | C18 | C2 | 114.5° | 109.4° |
| C23 | C18 | H15 | 105.7° | 109.5° |
| C18 | C23 | H24 | 109.1° | 109.5° |
| C18 | C23 | H25 | 109.1° | 109.5° |
| C19 | C18 | C2 | 115.1° | 109.5° |
| C19 | C18 | H15 | 105.7° | 109.5° |
| C18 | C19 | H16 | 109.1° | 109.5° |
| C18 | C19 | H17 | 109.1° | 109.5° |
| C18 | C2 | C3 | 118.6° | 119.8° |
| C18 | C2 | C1 | 122.9° | 119.8° |
| C2 | C18 | H15 | 105.7° | 109.5° |
| C3 | C2 | C1 | 118.2° | 120.3° |
| C2 | C3 | C4 | 121.2° | 120.1° |
| C2 | C3 | H5 | 119.4° | 119.9° |
| C2 | C1 | C | 121.0° | 120.1° |
| C2 | C1 | H3 | 119.5° | 119.9° |
| C3 | C4 | C5 | 120.8° | 119.9° |
| C3 | C4 | H4 | 119.6° | 120.1° |
| C4 | C3 | H5 | 119.4° | 119.9° |
| C1 | C | C5 | 120.4° | 119.9° |
| C | C1 | H3 | 119.5° | 119.9° |
| C1 | C | H6 | 119.8° | 120.1° |
| C4 | C5 | C | 118.3° | 119.7° |
| C4 | C5 | C6 | 119.6° | 120.2° |
| C5 | C4 | H4 | 119.6° | 120.1° |
| C | C5 | C6 | 121.8° | 120.2° |
| C5 | C | H6 | 119.8° | 120.1° |
| C5 | C6 | C7 | 122.5° | 120.2° |
| C5 | C6 | N1 | 117.5° | 120.2° |
| N4 | C17 | C15 | 178.3° | 180.0° |
| C6 | C7 | C8 | 121.3° | 119.5° |
| C7 | C6 | N1 | 119.9° | 119.6° |
| C6 | C7 | H2 | 119.3° | 120.2° |
| C7 | C8 | O | 124.6° | 120.0° |
| C7 | C8 | N | 115.3° | 120.0° |
| C8 | C7 | H2 | 119.3° | 120.2° |
| C6 | N1 | C9 | 120.4° | 120.0° |
| C6 | N1 | H1 | 119.8° | 120.0° |
| C17 | C15 | C16 | 112.4° | 111.0° |
| C17 | C15 | C14 | 112.0° | 110.8° |
| C17 | C15 | H12 | 110.3° | 110.9° |
| O | C8 | N | 120.1° | 120.0° |
| C8 | N | C9 | 123.0° | 120.2° |
| C8 | N | N2 | 125.2° | 131.7° |
| N1 | C9 | N | 119.4° | 120.7° |
| N1 | C9 | C10 | 133.5° | 132.2° |
| C9 | N1 | H1 | 119.8° | 119.9° |
| C16 | C15 | C14 | 103.2° | 101.5° |
| C15 | C16 | N3 | 104.0° | 104.8° |
| C16 | C15 | H12 | 109.3° | 111.0° |
| C15 | C16 | H13 | 110.8° | 110.4° |
| C15 | C16 | H14 | 110.8° | 110.4° |
| C15 | C14 | C13 | 103.5° | 102.9° |
| C15 | C14 | H10 | 111.0° | 110.7° |
| C15 | C14 | H11 | 110.9° | 110.9° |
| C14 | C15 | H12 | 109.4° | 111.3° |
| C16 | N3 | C12 | 128.7° | 125.6° |
| C16 | N3 | C13 | 112.5° | 108.7° |
| N3 | C16 | H13 | 110.8° | 110.6° |
| N3 | C16 | H14 | 110.8° | 110.2° |
| C9 | N | N2 | 111.8° | 108.2° |
| N | C9 | C10 | 107.1° | 107.1° |
| N | N2 | C11 | 104.2° | 109.3° |
| C9 | C10 | C11 | 103.7° | 107.0° |
| C9 | C10 | C12 | 134.5° | 126.5° |
| C14 | C13 | N3 | 102.9° | 107.3° |
| C14 | C13 | H8 | 111.1° | 109.9° |
| C14 | C13 | H9 | 111.1° | 110.0° |
| C13 | C14 | H10 | 111.0° | 110.7° |
| C13 | C14 | H11 | 110.9° | 110.7° |
| N2 | C11 | C10 | 113.3° | 108.5° |
| N2 | C11 | H7 | 123.3° | 125.7° |
| C11 | C10 | C12 | 121.8° | 126.5° |
| C10 | C11 | H7 | 123.4° | 125.8° |
| C10 | C12 | N3 | 119.4° | 120.0° |
| C10 | C12 | O1 | 119.0° | 119.9° |
| C12 | N3 | C13 | 118.9° | 125.7° |
| N3 | C12 | O1 | 121.6° | 120.1° |
| N3 | C13 | H8 | 111.1° | 109.9° |
| N3 | C13 | H9 | 111.1° | 109.8° |
| H8 | C13 | H9 | 109.5° | 109.9° |
| H10 | C14 | H11 | 109.5° | 110.6° |
| H13 | C16 | H14 | 109.5° | 110.4° |
| H16 | C19 | H17 | 109.5° | 109.5° |
| H18 | C20 | H19 | 109.5° | 109.5° |
| H20 | C21 | H21 | 109.5° | 109.5° |
| H22 | C22 | H23 | 109.5° | 109.4° |
| H24 | C23 | H25 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C22 | C23 | H22 | 120.2° | 120.1° |
| C21 | C22 | C23 | H23 | 120.2° | 120.0° |
| C22 | C21 | C20 | H20 | 120.3° | 120.0° |
| C22 | C21 | C20 | H21 | 120.3° | 120.0° |
| C22 | C21 | C20 | C19 | 54.0° | 60.0° |
| C21 | C22 | C23 | C18 | 57.1° | 60.0° |
| C22 | C21 | C20 | H18 | 66.3° | 180.0° |
| C22 | C21 | C20 | H19 | 174.2° | 60.0° |
| C22 | C21 | H20 | H21 | 119.2° | 120.0° |
| C21 | C22 | H22 | H23 | 119.2° | 120.0° |
| C21 | C22 | C23 | H24 | 63.1° | 180.0° |
| C21 | C22 | C23 | H25 | 177.4° | 60.0° |
| C23 | C22 | C21 | C20 | 54.3° | 59.9° |
| C22 | C23 | C18 | H24 | 120.3° | 120.0° |
| C22 | C23 | C18 | H25 | 120.3° | 119.9° |
| C22 | C23 | C18 | C19 | 58.5° | 60.0° |
| C22 | C23 | C18 | C2 | 170.7° | 180.0° |
| C22 | C23 | C18 | H15 | 54.8° | 60.0° |
| C23 | C22 | C21 | H20 | 174.5° | 60.0° |
| C23 | C22 | C21 | H21 | 66.0° | 180.0° |
| C23 | C22 | H22 | H23 | 119.2° | 120.0° |
| C22 | C23 | H24 | H25 | 119.3° | 120.0° |
| C21 | C20 | C19 | H18 | 120.3° | 120.0° |
| C21 | C20 | C19 | H19 | 120.3° | 120.0° |
| C21 | C20 | C19 | C18 | 56.4° | 60.0° |
| C21 | C20 | C19 | H16 | 176.6° | 60.0° |
| C21 | C20 | C19 | H17 | 63.9° | 180.0° |
| C21 | C20 | H18 | H19 | 119.2° | 120.0° |
| C20 | C21 | H20 | H21 | 119.2° | 120.0° |
| C20 | C21 | C22 | H22 | 174.5° | 180.0° |
| C20 | C21 | C22 | H23 | 65.9° | 60.0° |
| C20 | C19 | C18 | C23 | 58.1° | 60.1° |
| C20 | C19 | C18 | H16 | 120.2° | 120.0° |
| C20 | C19 | C18 | H17 | 120.2° | 119.9° |
| C20 | C19 | C18 | C2 | 171.4° | 180.0° |
| C20 | C19 | C18 | H15 | 55.1° | 60.0° |
| C20 | C19 | H16 | H17 | 119.2° | 120.0° |
| C19 | C20 | H18 | H19 | 119.2° | 120.0° |
| C19 | C20 | C21 | H20 | 174.2° | 60.0° |
| C19 | C20 | C21 | H21 | 66.3° | 180.0° |
| C23 | C18 | C19 | C2 | 130.5° | 120.0° |
| C23 | C18 | C19 | H15 | 113.3° | 120.0° |
| C23 | C18 | C2 | H15 | 115.9° | 120.0° |
| C23 | C18 | C2 | C3 | 124.3° | 120.0° |
| C23 | C18 | C2 | C1 | 48.9° | 60.0° |
| C23 | C18 | C19 | H16 | 178.3° | 60.0° |
| C23 | C18 | C19 | H17 | 62.1° | 180.0° |
| C18 | C23 | C22 | H22 | 177.4° | 180.0° |
| C18 | C23 | C22 | H23 | 63.1° | 60.0° |
| C18 | C23 | H24 | H25 | 119.2° | 120.1° |
| C19 | C18 | C2 | H15 | 116.2° | 120.0° |
| C19 | C18 | C2 | C3 | 107.8° | 120.0° |
| C19 | C18 | C2 | C1 | 78.9° | 60.0° |
| C18 | C19 | H16 | H17 | 119.3° | 120.0° |
| C18 | C19 | C20 | H18 | 63.9° | 180.0° |
| C18 | C19 | C20 | H19 | 176.6° | 59.9° |
| C19 | C18 | C23 | H24 | 61.8° | 180.0° |
| C19 | C18 | C23 | H25 | 178.8° | 59.9° |
| C18 | C2 | C3 | C1 | 173.6° | 180.0° |
| C18 | C2 | C3 | C4 | 170.4° | 179.5° |
| C18 | C2 | C1 | C | 170.0° | 179.9° |
| C18 | C2 | C1 | H3 | 10.0° | 0.3° |
| C18 | C2 | C3 | H5 | 9.6° | 0.2° |
| C2 | C18 | C19 | H16 | 51.2° | 60.0° |
| C2 | C18 | C19 | H17 | 68.3° | 60.0° |
| C2 | C18 | C23 | H24 | 69.0° | 60.0° |
| C2 | C18 | C23 | H25 | 50.4° | 60.1° |
| C2 | C3 | C4 | H5 | 180.0° | 179.3° |
| C3 | C2 | C1 | C | 3.3° | 0.1° |
| C2 | C3 | C4 | C5 | 0.0° | 0.8° |
| C3 | C2 | C1 | H3 | 176.7° | 179.7° |
| C2 | C3 | C4 | H4 | 180.0° | 179.8° |
| C3 | C2 | C18 | H15 | 8.4° | 0.0° |
| C1 | C2 | C3 | C4 | 3.2° | 0.5° |
| C2 | C1 | C | H3 | 180.0° | 179.6° |
| C2 | C1 | C | C5 | 0.3° | 0.4° |
| C1 | C2 | C3 | H5 | 176.8° | 179.7° |
| C2 | C1 | C | H6 | 179.7° | 179.7° |
| C1 | C2 | C18 | H15 | 164.8° | 180.0° |
| C3 | C4 | C5 | H4 | 180.0° | 179.5° |
| C3 | C4 | C5 | C | 3.1° | 0.5° |
| C3 | C4 | C5 | C6 | 170.3° | 179.5° |
| C1 | C | C5 | C4 | 2.9° | 0.1° |
| C1 | C | C5 | H6 | 180.0° | 179.9° |
| C1 | C | C5 | C6 | 170.3° | 179.9° |
| C4 | C5 | C | C6 | 173.2° | 180.0° |
| C4 | C5 | C6 | C7 | 31.2° | 0.1° |
| C4 | C5 | C6 | N1 | 145.0° | 180.0° |
| C5 | C4 | C3 | H5 | 180.0° | 180.0° |
| C4 | C5 | C | H6 | 177.1° | 180.0° |
| C | C5 | C6 | C7 | 142.0° | 180.0° |
| C | C5 | C6 | N1 | 41.8° | 0.0° |
| C5 | C | C1 | H3 | 179.7° | 180.0° |
| C | C5 | C4 | H4 | 176.9° | 179.9° |
| C5 | C6 | C7 | N1 | 176.1° | 180.0° |
| C5 | C6 | C7 | C8 | 170.8° | 179.5° |
| C5 | C6 | N1 | C9 | 177.9° | 180.0° |
| C5 | C6 | N1 | H1 | 2.1° | 0.2° |
| C5 | C6 | C7 | H2 | 9.2° | 0.1° |
| C6 | C5 | C4 | H4 | 9.7° | 0.0° |
| C6 | C5 | C | H6 | 9.7° | 0.0° |
| N4 | C17 | C15 | C16 | 96.8° | 83.6° |
| N4 | C17 | C15 | C14 | 147.6° | 164.4° |
| N4 | C17 | C15 | H12 | 25.5° | 40.3° |
| C6 | C7 | C8 | H2 | 180.0° | 179.5° |
| C6 | C7 | C8 | O | 169.0° | 180.0° |
| C6 | C7 | C8 | N | 9.7° | 0.7° |
| C7 | C6 | N1 | C9 | 1.6° | 0.0° |
| C7 | C6 | N1 | H1 | 178.4° | 179.7° |
| C8 | C7 | C6 | N1 | 5.3° | 0.5° |
| C7 | C8 | O | N | 178.6° | 179.3° |
| C7 | C8 | N | C9 | 7.9° | 0.5° |
| C7 | C8 | N | N2 | 172.9° | 180.0° |
| C6 | N1 | C9 | H1 | 180.0° | 179.7° |
| C6 | N1 | C9 | N | 3.4° | 0.3° |
| C6 | N1 | C9 | C10 | 175.6° | 179.8° |
| N1 | C6 | C7 | H2 | 174.7° | 180.0° |
| C17 | C15 | C16 | C14 | 120.8° | 117.8° |
| C17 | C15 | C16 | H12 | 122.8° | 123.8° |
| C17 | C15 | C14 | H12 | 122.6° | 123.9° |
| C17 | C15 | C16 | N3 | 144.0° | 155.1° |
| C17 | C15 | C14 | C13 | 157.2° | 153.6° |
| C17 | C15 | C14 | H10 | 38.2° | 88.0° |
| C17 | C15 | C14 | H11 | 83.7° | 35.2° |
| C17 | C15 | C16 | H13 | 96.9° | 36.0° |
| C17 | C15 | C16 | H14 | 24.8° | 86.3° |
| O | C8 | N | C9 | 170.8° | 179.7° |
| O | C8 | N | N2 | 8.3° | 0.7° |
| O | C8 | C7 | H2 | 11.0° | 0.5° |
| C8 | N | C9 | N1 | 1.6° | 0.0° |
| C8 | N | C9 | N2 | 179.2° | 179.7° |
| C8 | N | C9 | C10 | 179.1° | 180.0° |
| C8 | N | N2 | C11 | 179.1° | 179.8° |
| N | C8 | C7 | H2 | 170.3° | 179.8° |
| N1 | C9 | N | C10 | 179.3° | 180.0° |
| N1 | C9 | N | N2 | 179.1° | 179.6° |
| N1 | C9 | C10 | C11 | 179.0° | 180.0° |
| N1 | C9 | C10 | C12 | 2.9° | 0.0° |
| C16 | C15 | C14 | H12 | 116.3° | 118.1° |
| C15 | C16 | N3 | H13 | 119.1° | 118.9° |
| C15 | C16 | N3 | H14 | 119.1° | 118.8° |
| C16 | C15 | C14 | C13 | 36.1° | 35.7° |
| C15 | C16 | N3 | C12 | 178.8° | 155.8° |
| C15 | C16 | N3 | C13 | 1.4° | 24.4° |
| C16 | C15 | C14 | H10 | 82.9° | 154.0° |
| C16 | C15 | C14 | H11 | 155.2° | 82.8° |
| C15 | C16 | H13 | H14 | 122.5° | 122.3° |
| C14 | C15 | C16 | N3 | 23.2° | 37.2° |
| C15 | C14 | C13 | H10 | 119.1° | 118.4° |
| C15 | C14 | C13 | H11 | 119.0° | 118.5° |
| C15 | C14 | C13 | N3 | 34.9° | 22.2° |
| C15 | C14 | C13 | H8 | 153.9° | 97.3° |
| C15 | C14 | C13 | H9 | 84.0° | 141.6° |
| C15 | C14 | H10 | H11 | 122.8° | 123.3° |
| C14 | C15 | C16 | H13 | 142.3° | 81.9° |
| C14 | C15 | C16 | H14 | 96.0° | 155.9° |
| C16 | N3 | C13 | C14 | 21.3° | 1.2° |
| C16 | N3 | C12 | C10 | 7.4° | 179.7° |
| C16 | N3 | C12 | C13 | 179.7° | 179.8° |
| C16 | N3 | C12 | O1 | 171.6° | 0.3° |
| C16 | N3 | C13 | H8 | 140.2° | 120.7° |
| C16 | N3 | C13 | H9 | 97.7° | 118.3° |
| N3 | C16 | C15 | H12 | 93.2° | 81.1° |
| N3 | C16 | H13 | H14 | 122.5° | 122.2° |
| C9 | N | N2 | C11 | 0.1° | 0.6° |
| N | C9 | C10 | C11 | 0.2° | 0.0° |
| N | C9 | C10 | C12 | 177.9° | 180.0° |
| N | C9 | N1 | H1 | 176.6° | 180.0° |
| N2 | N | C9 | C10 | 0.2° | 0.3° |
| N | N2 | C11 | C10 | 0.0° | 0.6° |
| N | N2 | C11 | H7 | 180.0° | 180.0° |
| C9 | C10 | C11 | N2 | 0.1° | 0.4° |
| C9 | C10 | C11 | C12 | 178.4° | 180.0° |
| C9 | C10 | C12 | N3 | 41.3° | 180.0° |
| C9 | C10 | C12 | O1 | 139.7° | 0.0° |
| C10 | C9 | N1 | H1 | 4.4° | 0.0° |
| C9 | C10 | C11 | H7 | 179.9° | 179.8° |
| C14 | C13 | N3 | C12 | 158.5° | 179.0° |
| C14 | C13 | N3 | H8 | 118.9° | 119.5° |
| C14 | C13 | N3 | H9 | 118.9° | 119.5° |
| C14 | C13 | H8 | H9 | 123.1° | 121.2° |
| C13 | C14 | H10 | H11 | 122.8° | 123.2° |
| C13 | C14 | C15 | H12 | 80.2° | 82.5° |
| N2 | C11 | C10 | H7 | 180.0° | 179.4° |
| N2 | C11 | C10 | C12 | 178.3° | 179.6° |
| C11 | C10 | C12 | N3 | 140.8° | 0.0° |
| C11 | C10 | C12 | O1 | 38.1° | 180.0° |
| C10 | C12 | N3 | O1 | 178.9° | 180.0° |
| C10 | C12 | N3 | C13 | 172.3° | 0.0° |
| C12 | C10 | C11 | H7 | 1.7° | 0.2° |
| C12 | N3 | C13 | H8 | 39.6° | 59.5° |
| C12 | N3 | C13 | H9 | 82.5° | 61.5° |
| C12 | N3 | C16 | H13 | 59.7° | 85.3° |
| C12 | N3 | C16 | H14 | 62.0° | 37.1° |
| C13 | N3 | C12 | O1 | 8.7° | 180.0° |
| N3 | C13 | H8 | H9 | 123.0° | 121.0° |
| N3 | C13 | C14 | H10 | 84.1° | 140.6° |
| N3 | C13 | C14 | H11 | 154.0° | 96.3° |
| C13 | N3 | C16 | H13 | 120.6° | 94.5° |
| C13 | N3 | C16 | H14 | 117.7° | 143.1° |
| H3 | C1 | C | H6 | 0.3° | 0.1° |
| H4 | C4 | C3 | H5 | 0.0° | 0.5° |
| H8 | C13 | C14 | H10 | 34.8° | 21.1° |
| H8 | C13 | C14 | H11 | 87.1° | 144.2° |
| H9 | C13 | C14 | H10 | 157.0° | 100.0° |
| H9 | C13 | C14 | H11 | 35.1° | 23.1° |
| H10 | C14 | C15 | H12 | 160.8° | 35.9° |
| H11 | C14 | C15 | H12 | 38.9° | 159.1° |
| H12 | C15 | C16 | H13 | 25.9° | 159.8° |
| H12 | C15 | C16 | H14 | 147.7° | 37.5° |
| H15 | C18 | C19 | H16 | 65.1° | 180.0° |
| H15 | C18 | C19 | H17 | 175.4° | 60.0° |
| H15 | C18 | C23 | H24 | 175.0° | 59.9° |
| H15 | C18 | C23 | H25 | 65.5° | 180.0° |
| H16 | C19 | C20 | H18 | 56.3° | 60.0° |
| H16 | C19 | C20 | H19 | 63.1° | 180.0° |
| H17 | C19 | C20 | H18 | 175.8° | 60.0° |
| H17 | C19 | C20 | H19 | 56.3° | 60.0° |
| H18 | C20 | C21 | H20 | 54.0° | 60.0° |
| H18 | C20 | C21 | H21 | 173.5° | 60.0° |
| H19 | C20 | C21 | H20 | 65.5° | 180.0° |
| H19 | C20 | C21 | H21 | 54.0° | 60.0° |
| H20 | C21 | C22 | H22 | 65.2° | 60.0° |
| H20 | C21 | C22 | H23 | 54.3° | 180.0° |
| H21 | C21 | C22 | H22 | 54.3° | 60.0° |
| H21 | C21 | C22 | H23 | 173.8° | 60.0° |
| H22 | C22 | C23 | H24 | 57.1° | 60.0° |
| H22 | C22 | C23 | H25 | 62.4° | 60.0° |
| H23 | C22 | C23 | H24 | 176.7° | 60.0° |
| H23 | C22 | C23 | H25 | 57.2° | 180.0° |
