CZT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | O03 | sing | 1.43Å | 1.25Å | |
| C17 | C18 | doub | 1.38Å | 1.36Å | Aromatic |
| C17 | C15 | sing | 1.39Å | 1.31Å | Aromatic |
| C18 | C07 | sing | 1.40Å | 1.30Å | Aromatic |
| O03 | C15 | sing | 1.36Å | 1.35Å | |
| C15 | C09 | doub | 1.39Å | 1.41Å | Aromatic |
| C07 | C06 | sing | 1.48Å | 1.52Å | |
| C07 | C08 | doub | 1.40Å | 1.30Å | Aromatic |
| C06 | N02 | doub | 1.29Å | 1.28Å | |
| C09 | C08 | sing | 1.38Å | 1.40Å | Aromatic |
| C09 | O02 | sing | 1.36Å | 1.41Å | |
| N02 | O01 | sing | 1.42Å | 1.37Å | |
| O01 | C05 | sing | 1.43Å | 1.49Å | |
| O02 | C10 | sing | 1.43Å | 1.39Å | |
| O04 | C04 | sing | 1.43Å | 1.44Å | |
| C05 | C04 | sing | 1.53Å | 1.54Å | |
| C04 | C22 | sing | 1.53Å | 1.58Å | |
| C10 | C14 | sing | 1.54Å | 1.21Å | |
| C10 | C11 | sing | 1.55Å | 1.59Å | |
| C14 | C13 | sing | 1.54Å | 1.46Å | |
| C13 | C12 | sing | 1.54Å | 1.51Å | |
| C22 | N01 | sing | 1.47Å | 1.48Å | |
| C11 | C12 | sing | 1.55Å | 1.29Å | |
| N01 | C03 | sing | 1.47Å | 1.49Å | |
| N01 | C19 | sing | 1.47Å | 1.49Å | |
| C03 | C02 | sing | 1.53Å | 1.53Å | |
| C19 | C20 | sing | 1.53Å | 1.55Å | |
| C02 | C01 | sing | 1.53Å | 1.52Å | |
| C02 | O05 | sing | 1.43Å | 1.43Å | |
| C20 | O05 | sing | 1.43Å | 1.44Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H17 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.08Å | 1.08Å | |
| C20 | H34 | sing | 1.09Å | 1.10Å | |
| C21 | H32 | sing | 1.09Å | 1.10Å | |
| C21 | H33 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| C22 | H30 | sing | 1.09Å | 1.10Å | |
| C01 | H03 | sing | 1.09Å | 1.10Å | |
| C01 | H02 | sing | 1.09Å | 1.10Å | |
| C01 | H01 | sing | 1.09Å | 1.10Å | |
| C02 | H04 | sing | 1.09Å | 1.10Å | |
| C03 | H06 | sing | 1.09Å | 1.10Å | |
| C03 | H05 | sing | 1.09Å | 1.10Å | |
| C04 | H28 | sing | 1.09Å | 1.10Å | |
| C05 | H07 | sing | 1.09Å | 1.10Å | |
| C05 | H08 | sing | 1.09Å | 1.10Å | |
| C06 | H09 | sing | 1.08Å | 1.08Å | |
| C08 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.08Å | 1.08Å | |
| O04 | H27 | sing | 0.97Å | 0.95Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | O03 | C15 | 129.1° | 117.0° |
| O03 | C16 | H20 | 109.5° | 109.5° |
| O03 | C16 | H21 | 109.5° | 109.5° |
| O03 | C16 | H22 | 109.5° | 109.5° |
| C18 | C17 | C15 | 122.4° | 120.2° |
| C17 | C18 | C07 | 121.7° | 120.0° |
| C18 | C17 | H23 | 118.8° | 119.9° |
| C17 | C18 | H24 | 119.1° | 120.0° |
| C17 | C15 | O03 | 121.1° | 119.9° |
| C17 | C15 | C09 | 117.7° | 120.1° |
| C15 | C17 | H23 | 118.8° | 119.9° |
| C18 | C07 | C06 | 118.8° | 120.1° |
| C18 | C07 | C08 | 118.4° | 119.8° |
| C07 | C18 | H24 | 119.1° | 120.0° |
| O03 | C15 | C09 | 121.2° | 119.9° |
| C15 | C09 | C08 | 116.2° | 120.0° |
| C15 | C09 | O02 | 118.8° | 120.0° |
| C06 | C07 | C08 | 122.8° | 120.1° |
| C07 | C06 | N02 | 124.9° | 120.0° |
| C07 | C06 | H09 | 117.5° | 120.0° |
| C07 | C08 | C09 | 123.5° | 119.9° |
| C07 | C08 | H10 | 118.2° | 120.0° |
| C06 | N02 | O01 | 125.6° | 120.0° |
| N02 | C06 | H09 | 117.5° | 120.0° |
| C08 | C09 | O02 | 125.0° | 120.0° |
| C09 | C08 | H10 | 118.2° | 120.1° |
| C09 | O02 | C10 | 117.9° | 117.0° |
| N02 | O01 | C05 | 110.8° | 114.0° |
| O01 | C05 | C04 | 122.6° | 109.5° |
| O01 | C05 | H07 | 106.1° | 109.5° |
| O01 | C05 | H08 | 106.1° | 109.5° |
| O02 | C10 | C14 | 107.1° | 110.5° |
| O02 | C10 | C11 | 123.3° | 110.5° |
| O02 | C10 | H11 | 107.7° | 110.6° |
| O04 | C04 | C05 | 112.6° | 109.5° |
| O04 | C04 | C22 | 108.7° | 109.5° |
| O04 | C04 | H28 | 110.7° | 109.4° |
| C04 | O04 | H27 | 109.5° | 114.0° |
| C05 | C04 | C22 | 106.7° | 109.5° |
| C05 | C04 | H28 | 109.2° | 109.5° |
| C04 | C05 | H07 | 106.1° | 109.5° |
| C04 | C05 | H08 | 106.1° | 109.5° |
| C04 | C22 | N01 | 123.1° | 109.5° |
| C04 | C22 | H29 | 106.0° | 109.4° |
| C04 | C22 | H30 | 105.9° | 109.5° |
| C22 | C04 | H28 | 108.8° | 109.5° |
| C14 | C10 | C11 | 102.5° | 104.2° |
| C10 | C14 | C13 | 103.2° | 106.6° |
| C14 | C10 | H11 | 110.5° | 110.5° |
| C10 | C14 | H18 | 111.0° | 110.0° |
| C10 | C14 | H19 | 111.0° | 110.1° |
| C10 | C11 | C12 | 96.0° | 102.8° |
| C11 | C10 | H11 | 105.4° | 110.4° |
| C10 | C11 | H13 | 112.7° | 110.8° |
| C10 | C11 | H12 | 112.7° | 110.7° |
| C14 | C13 | C12 | 101.6° | 106.6° |
| C14 | C13 | H17 | 111.4° | 110.0° |
| C14 | C13 | H16 | 111.4° | 110.1° |
| C13 | C14 | H18 | 111.0° | 110.0° |
| C13 | C14 | H19 | 111.0° | 110.0° |
| C13 | C12 | C11 | 106.5° | 104.2° |
| C12 | C13 | H17 | 111.4° | 110.0° |
| C12 | C13 | H16 | 111.4° | 110.1° |
| C13 | C12 | H14 | 110.2° | 110.5° |
| C13 | C12 | H15 | 110.2° | 110.5° |
| C22 | N01 | C03 | 108.5° | 111.1° |
| C22 | N01 | C19 | 111.1° | 111.0° |
| N01 | C22 | H29 | 106.0° | 109.5° |
| N01 | C22 | H30 | 106.0° | 109.4° |
| C12 | C11 | H13 | 112.7° | 110.8° |
| C12 | C11 | H12 | 112.7° | 110.8° |
| C11 | C12 | H14 | 110.2° | 110.5° |
| C11 | C12 | H15 | 110.2° | 110.5° |
| C03 | N01 | C19 | 110.6° | 110.7° |
| N01 | C03 | C02 | 115.1° | 109.3° |
| N01 | C03 | H06 | 108.1° | 109.5° |
| N01 | C03 | H05 | 108.1° | 109.5° |
| N01 | C19 | C20 | 118.4° | 109.2° |
| N01 | C19 | H25 | 107.2° | 109.5° |
| N01 | C19 | H26 | 107.2° | 109.5° |
| C03 | C02 | C01 | 112.1° | 109.5° |
| C03 | C02 | O05 | 111.0° | 109.3° |
| C03 | C02 | H04 | 107.2° | 109.5° |
| C02 | C03 | H06 | 108.1° | 109.5° |
| C02 | C03 | H05 | 108.0° | 109.5° |
| C19 | C20 | O05 | 114.9° | 109.3° |
| C19 | C20 | C21 | 109.9° | 109.5° |
| C19 | C20 | H34 | 108.0° | 109.6° |
| C20 | C19 | H25 | 107.2° | 109.5° |
| C20 | C19 | H26 | 107.2° | 109.5° |
| C01 | C02 | O05 | 110.7° | 109.5° |
| C02 | C01 | H03 | 109.5° | 109.5° |
| C02 | C01 | H02 | 109.5° | 109.5° |
| C02 | C01 | H01 | 109.4° | 109.4° |
| C01 | C02 | H04 | 107.3° | 109.5° |
| C02 | O05 | C20 | 113.1° | 113.8° |
| O05 | C02 | H04 | 108.4° | 109.5° |
| O05 | C20 | C21 | 105.9° | 109.5° |
| O05 | C20 | H34 | 109.5° | 109.5° |
| C21 | C20 | H34 | 108.4° | 109.5° |
| C20 | C21 | H32 | 109.5° | 109.4° |
| C20 | C21 | H33 | 109.5° | 109.5° |
| C20 | C21 | H31 | 109.5° | 109.5° |
| H17 | C13 | H16 | 109.4° | 110.1° |
| H32 | C21 | H33 | 109.5° | 109.4° |
| H32 | C21 | H31 | 109.5° | 109.5° |
| H33 | C21 | H31 | 109.5° | 109.5° |
| H29 | C22 | H30 | 109.5° | 109.5° |
| H03 | C01 | H02 | 109.4° | 109.5° |
| H03 | C01 | H01 | 109.5° | 109.5° |
| H02 | C01 | H01 | 109.5° | 109.5° |
| H06 | C03 | H05 | 109.5° | 109.5° |
| H07 | C05 | H08 | 109.5° | 109.5° |
| H13 | C11 | H12 | 109.5° | 110.8° |
| H14 | C12 | H15 | 109.5° | 110.5° |
| H18 | C14 | H19 | 109.5° | 110.1° |
| H20 | C16 | H21 | 109.5° | 109.5° |
| H20 | C16 | H22 | 109.5° | 109.4° |
| H21 | C16 | H22 | 109.5° | 109.5° |
| H25 | C19 | H26 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | O03 | C15 | C17 | 19.8° | 0.3° |
| C16 | O03 | C15 | C09 | 160.5° | 180.0° |
| O03 | C16 | H20 | H21 | 120.0° | 120.1° |
| O03 | C16 | H20 | H22 | 120.0° | 119.9° |
| O03 | C16 | H21 | H22 | 120.0° | 120.0° |
| C18 | C17 | C15 | H23 | 180.0° | 179.9° |
| C17 | C18 | C07 | H24 | 180.0° | 180.0° |
| C18 | C17 | C15 | O03 | 179.9° | 179.7° |
| C18 | C17 | C15 | C09 | 0.1° | 0.1° |
| C17 | C18 | C07 | C06 | 179.7° | 179.9° |
| C17 | C18 | C07 | C08 | 0.5° | 0.1° |
| C15 | C17 | C18 | C07 | 0.1° | 0.1° |
| C17 | C15 | O03 | C09 | 179.8° | 179.6° |
| C17 | C15 | C09 | C08 | 0.0° | 0.1° |
| C17 | C15 | C09 | O02 | 179.9° | 180.0° |
| C15 | C17 | C18 | H24 | 179.9° | 179.9° |
| C18 | C07 | C06 | C08 | 179.8° | 180.0° |
| C18 | C07 | C06 | N02 | 154.9° | 0.1° |
| C18 | C07 | C08 | C09 | 0.6° | 0.1° |
| C07 | C18 | C17 | H23 | 179.9° | 180.0° |
| C18 | C07 | C06 | H09 | 25.1° | 180.0° |
| C18 | C07 | C08 | H10 | 179.4° | 180.0° |
| O03 | C15 | C09 | C08 | 179.8° | 179.7° |
| O03 | C15 | C09 | O02 | 0.4° | 0.3° |
| O03 | C15 | C17 | H23 | 0.1° | 0.4° |
| C15 | O03 | C16 | H20 | 180.0° | 60.1° |
| C15 | O03 | C16 | H21 | 60.0° | 60.0° |
| C15 | O03 | C16 | H22 | 60.0° | 180.0° |
| C15 | C09 | C08 | C07 | 0.3° | 0.1° |
| C15 | C09 | C08 | O02 | 179.8° | 179.9° |
| C15 | C09 | O02 | C10 | 174.7° | 174.5° |
| C09 | C15 | C17 | H23 | 179.9° | 180.0° |
| C15 | C09 | C08 | H10 | 179.7° | 180.0° |
| C07 | C06 | N02 | H09 | 180.0° | 180.0° |
| C06 | C07 | C08 | C09 | 179.7° | 179.9° |
| C07 | C06 | N02 | O01 | 179.4° | 180.0° |
| C06 | C07 | C08 | H10 | 0.3° | 0.0° |
| C06 | C07 | C18 | H24 | 0.2° | 0.1° |
| C08 | C07 | C06 | N02 | 25.4° | 179.9° |
| C07 | C08 | C09 | H10 | 180.0° | 179.9° |
| C07 | C08 | C09 | O02 | 179.5° | 180.0° |
| C08 | C07 | C06 | H09 | 154.6° | 0.0° |
| C08 | C07 | C18 | H24 | 179.5° | 179.9° |
| C06 | N02 | O01 | C05 | 165.4° | 179.9° |
| C08 | C09 | O02 | C10 | 5.5° | 5.4° |
| C09 | O02 | C10 | C14 | 111.5° | 155.8° |
| C09 | O02 | C10 | C11 | 130.2° | 89.4° |
| C09 | O02 | C10 | H11 | 7.3° | 33.2° |
| O02 | C09 | C08 | H10 | 0.5° | 0.1° |
| N02 | O01 | C05 | C04 | 138.5° | 180.0° |
| N02 | O01 | C05 | H07 | 99.7° | 60.0° |
| N02 | O01 | C05 | H08 | 16.6° | 60.0° |
| O01 | N02 | C06 | H09 | 0.7° | 0.1° |
| O01 | C05 | C04 | O04 | 59.6° | 65.0° |
| O01 | C05 | C04 | H07 | 121.8° | 120.0° |
| O01 | C05 | C04 | H08 | 121.8° | 120.0° |
| O01 | C05 | C04 | C22 | 178.8° | 175.0° |
| O01 | C05 | C04 | H28 | 63.8° | 55.0° |
| O01 | C05 | H07 | H08 | 114.1° | 120.0° |
| O02 | C10 | C14 | C11 | 131.1° | 118.7° |
| O02 | C10 | C14 | H11 | 117.1° | 122.7° |
| O02 | C10 | C11 | H11 | 124.0° | 122.7° |
| O02 | C10 | C14 | C13 | 82.8° | 142.3° |
| O02 | C10 | C11 | C12 | 64.3° | 156.6° |
| O02 | C10 | C11 | H13 | 178.0° | 85.0° |
| O02 | C10 | C11 | H12 | 53.4° | 38.3° |
| O02 | C10 | C14 | H18 | 36.3° | 23.0° |
| O02 | C10 | C14 | H19 | 158.3° | 98.4° |
| O04 | C04 | C05 | C22 | 119.2° | 120.0° |
| O04 | C04 | C05 | H28 | 123.4° | 120.0° |
| O04 | C04 | C22 | H28 | 120.6° | 120.0° |
| O04 | C04 | C22 | N01 | 98.3° | 62.5° |
| O04 | C04 | C22 | H29 | 23.5° | 57.6° |
| O04 | C04 | C22 | H30 | 139.8° | 177.6° |
| O04 | C04 | C05 | H07 | 178.6° | 55.0° |
| O04 | C04 | C05 | H08 | 62.2° | 175.0° |
| C05 | C04 | C22 | H28 | 117.7° | 120.0° |
| C05 | C04 | C22 | N01 | 23.3° | 177.5° |
| C05 | C04 | C22 | H29 | 145.2° | 62.5° |
| C05 | C04 | C22 | H30 | 98.6° | 57.6° |
| C04 | C05 | H07 | H08 | 114.1° | 120.0° |
| C05 | C04 | O04 | H27 | 180.0° | 60.0° |
| C04 | C22 | N01 | H29 | 121.9° | 120.0° |
| C04 | C22 | N01 | H30 | 121.8° | 120.0° |
| C04 | C22 | N01 | C03 | 106.0° | 75.6° |
| C04 | C22 | N01 | C19 | 132.2° | 160.7° |
| C04 | C22 | H29 | H30 | 113.8° | 120.0° |
| C22 | C04 | C05 | H07 | 59.4° | 65.0° |
| C22 | C04 | C05 | H08 | 56.9° | 55.0° |
| C22 | C04 | O04 | H27 | 62.0° | 60.0° |
| C14 | C10 | C11 | H11 | 115.6° | 118.7° |
| C10 | C14 | C13 | H18 | 119.0° | 119.2° |
| C10 | C14 | C13 | H19 | 119.0° | 119.3° |
| C10 | C14 | C13 | C12 | 26.7° | 0.1° |
| C14 | C10 | C11 | C12 | 56.2° | 37.9° |
| C10 | C14 | C13 | H17 | 92.0° | 119.3° |
| C10 | C14 | C13 | H16 | 145.4° | 119.3° |
| C14 | C10 | C11 | H13 | 61.6° | 156.3° |
| C14 | C10 | C11 | H12 | 173.9° | 80.4° |
| C10 | C14 | H18 | H19 | 122.9° | 121.5° |
| C11 | C10 | C14 | C13 | 48.3° | 23.5° |
| C10 | C11 | C12 | C13 | 34.9° | 37.9° |
| C10 | C11 | C12 | H13 | 117.7° | 118.4° |
| C10 | C11 | C12 | H12 | 117.7° | 118.3° |
| C10 | C11 | H13 | H12 | 126.3° | 123.3° |
| C10 | C11 | C12 | H14 | 84.6° | 156.6° |
| C10 | C11 | C12 | H15 | 154.5° | 80.8° |
| C11 | C10 | C14 | H18 | 167.3° | 95.7° |
| C11 | C10 | C14 | H19 | 70.7° | 142.9° |
| C14 | C13 | C12 | H17 | 118.7° | 119.2° |
| C14 | C13 | C12 | H16 | 118.7° | 119.4° |
| C14 | C13 | C12 | C11 | 11.7° | 23.6° |
| C13 | C14 | C10 | H11 | 160.2° | 95.1° |
| C14 | C13 | H17 | H16 | 123.7° | 121.5° |
| C14 | C13 | C12 | H14 | 107.8° | 142.3° |
| C14 | C13 | C12 | H15 | 131.3° | 95.1° |
| C13 | C14 | H18 | H19 | 122.9° | 121.5° |
| C13 | C12 | C11 | H14 | 119.5° | 118.7° |
| C13 | C12 | C11 | H15 | 119.6° | 118.7° |
| C12 | C13 | H17 | H16 | 123.7° | 121.4° |
| C13 | C12 | C11 | H13 | 82.8° | 156.3° |
| C13 | C12 | C11 | H12 | 152.6° | 80.3° |
| C13 | C12 | H14 | H15 | 121.4° | 122.6° |
| C12 | C13 | C14 | H18 | 145.7° | 119.3° |
| C12 | C13 | C14 | H19 | 92.3° | 119.3° |
| C22 | N01 | C03 | C19 | 122.1° | 123.8° |
| C22 | N01 | C03 | C02 | 166.4° | 177.6° |
| C22 | N01 | C19 | C20 | 153.6° | 177.6° |
| N01 | C22 | H29 | H30 | 113.9° | 120.0° |
| C22 | N01 | C03 | H06 | 72.8° | 62.4° |
| C22 | N01 | C03 | H05 | 45.6° | 57.6° |
| N01 | C22 | C04 | H28 | 141.1° | 57.5° |
| C22 | N01 | C19 | H25 | 32.3° | 57.7° |
| C22 | N01 | C19 | H26 | 85.1° | 62.5° |
| C12 | C11 | C10 | H11 | 171.8° | 80.8° |
| C11 | C12 | C13 | H17 | 130.4° | 142.9° |
| C11 | C12 | C13 | H16 | 107.0° | 95.7° |
| C12 | C11 | H13 | H12 | 126.3° | 123.3° |
| C11 | C12 | H14 | H15 | 121.4° | 122.6° |
| N01 | C03 | C02 | H06 | 120.8° | 120.0° |
| N01 | C03 | C02 | H05 | 120.8° | 120.0° |
| C03 | N01 | C19 | C20 | 33.0° | 58.6° |
| N01 | C03 | C02 | C01 | 177.7° | 176.8° |
| N01 | C03 | C02 | O05 | 58.0° | 56.8° |
| C03 | N01 | C22 | H29 | 15.9° | 164.3° |
| C03 | N01 | C22 | H30 | 132.2° | 44.3° |
| N01 | C03 | C02 | H04 | 60.2° | 63.1° |
| N01 | C03 | H06 | H05 | 117.5° | 120.1° |
| C03 | N01 | C19 | H25 | 88.2° | 178.5° |
| C03 | N01 | C19 | H26 | 154.3° | 61.3° |
| C19 | N01 | C03 | C02 | 44.3° | 58.6° |
| N01 | C19 | C20 | H25 | 121.3° | 120.0° |
| N01 | C19 | C20 | H26 | 121.3° | 119.9° |
| N01 | C19 | C20 | O05 | 34.7° | 56.8° |
| N01 | C19 | C20 | C21 | 154.1° | 176.8° |
| N01 | C19 | C20 | H34 | 87.9° | 63.1° |
| C19 | N01 | C22 | H29 | 105.9° | 40.7° |
| C19 | N01 | C22 | H30 | 10.4° | 79.4° |
| C19 | N01 | C03 | H06 | 165.1° | 61.4° |
| C19 | N01 | C03 | H05 | 76.5° | 178.6° |
| N01 | C19 | H25 | H26 | 116.0° | 120.1° |
| C03 | C02 | C01 | O05 | 124.5° | 119.8° |
| C03 | C02 | C01 | H04 | 117.4° | 120.1° |
| C03 | C02 | O05 | H04 | 117.4° | 119.9° |
| C03 | C02 | O05 | C20 | 57.3° | 58.6° |
| C03 | C02 | C01 | H03 | 180.0° | 179.8° |
| C03 | C02 | C01 | H02 | 60.0° | 60.2° |
| C03 | C02 | C01 | H01 | 60.0° | 59.8° |
| C02 | C03 | H06 | H05 | 117.4° | 120.1° |
| C19 | C20 | O05 | C02 | 46.3° | 58.6° |
| C19 | C20 | O05 | C21 | 121.5° | 120.0° |
| C19 | C20 | O05 | H34 | 121.8° | 120.0° |
| C19 | C20 | C21 | H34 | 117.8° | 120.1° |
| C19 | C20 | C21 | H32 | 180.0° | 59.8° |
| C19 | C20 | C21 | H33 | 60.0° | 60.2° |
| C19 | C20 | C21 | H31 | 60.0° | 179.8° |
| C20 | C19 | H25 | H26 | 115.9° | 120.1° |
| C01 | C02 | O05 | H04 | 117.4° | 120.1° |
| C01 | C02 | O05 | C20 | 177.6° | 178.6° |
| C02 | C01 | H03 | H02 | 120.0° | 120.0° |
| C02 | C01 | H03 | H01 | 120.0° | 119.9° |
| C02 | C01 | H02 | H01 | 120.0° | 120.0° |
| C01 | C02 | C03 | H06 | 56.8° | 56.8° |
| C01 | C02 | C03 | H05 | 61.5° | 63.2° |
| C02 | O05 | C20 | C21 | 167.8° | 178.6° |
| C02 | O05 | C20 | H34 | 75.5° | 61.4° |
| O05 | C02 | C01 | H03 | 55.5° | 60.0° |
| O05 | C02 | C01 | H02 | 175.5° | 180.0° |
| O05 | C02 | C01 | H01 | 64.5° | 60.0° |
| O05 | C02 | C03 | H06 | 178.8° | 63.2° |
| O05 | C02 | C03 | H05 | 62.8° | 176.8° |
| O05 | C20 | C21 | H34 | 117.4° | 120.0° |
| O05 | C20 | C21 | H32 | 55.3° | 60.0° |
| O05 | C20 | C21 | H33 | 64.7° | 180.0° |
| O05 | C20 | C21 | H31 | 175.2° | 60.0° |
| C20 | O05 | C02 | H04 | 60.2° | 61.3° |
| O05 | C20 | C19 | H25 | 86.6° | 176.8° |
| O05 | C20 | C19 | H26 | 156.0° | 63.1° |
| C20 | C21 | H32 | H33 | 120.0° | 120.0° |
| C20 | C21 | H32 | H31 | 120.0° | 120.0° |
| C20 | C21 | H33 | H31 | 120.0° | 120.1° |
| C21 | C20 | C19 | H25 | 32.8° | 63.3° |
| C21 | C20 | C19 | H26 | 84.6° | 56.9° |
| H11 | C10 | C11 | H13 | 54.0° | 37.6° |
| H11 | C10 | C11 | H12 | 70.5° | 160.9° |
| H11 | C10 | C14 | H18 | 80.8° | 145.7° |
| H11 | C10 | C14 | H19 | 41.2° | 24.2° |
| H17 | C13 | C12 | H14 | 10.9° | 98.5° |
| H17 | C13 | C12 | H15 | 110.0° | 24.2° |
| H17 | C13 | C14 | H18 | 27.0° | 121.5° |
| H17 | C13 | C14 | H19 | 149.0° | 0.0° |
| H16 | C13 | C12 | H14 | 133.4° | 23.0° |
| H16 | C13 | C12 | H15 | 12.5° | 145.6° |
| H16 | C13 | C14 | H18 | 95.6° | 0.1° |
| H16 | C13 | C14 | H19 | 26.5° | 121.4° |
| H23 | C17 | C18 | H24 | 0.1° | 0.0° |
| H34 | C20 | C21 | H32 | 62.2° | 179.9° |
| H34 | C20 | C21 | H33 | 177.8° | 60.0° |
| H34 | C20 | C21 | H31 | 57.8° | 60.1° |
| H34 | C20 | C19 | H25 | 150.9° | 56.8° |
| H34 | C20 | C19 | H26 | 33.4° | 177.0° |
| H32 | C21 | H33 | H31 | 120.0° | 120.0° |
| H29 | C22 | C04 | H28 | 97.1° | 177.5° |
| H30 | C22 | C04 | H28 | 19.2° | 62.4° |
| H03 | C01 | H02 | H01 | 120.0° | 120.0° |
| H03 | C01 | C02 | H04 | 62.6° | 60.1° |
| H02 | C01 | C02 | H04 | 57.4° | 59.9° |
| H01 | C01 | C02 | H04 | 177.4° | 179.9° |
| H04 | C02 | C03 | H06 | 60.6° | 176.9° |
| H04 | C02 | C03 | H05 | 179.0° | 56.9° |
| H28 | C04 | C05 | H07 | 58.0° | 175.0° |
| H28 | C04 | C05 | H08 | 174.4° | 65.0° |
| H28 | C04 | O04 | H27 | 57.4° | 180.0° |
| H13 | C11 | C12 | H14 | 157.7° | 85.0° |
| H13 | C11 | C12 | H15 | 36.8° | 37.6° |
| H12 | C11 | C12 | H14 | 33.1° | 38.3° |
| H12 | C11 | C12 | H15 | 87.8° | 160.9° |
| H20 | C16 | H21 | H22 | 120.0° | 120.0° |
