N9T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C19 | doub | 1.38Å | 1.37Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.37Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.36Å | Aromatic |
| C18 | C17 | doub | 1.38Å | 1.36Å | Aromatic |
| C22 | C17 | sing | 1.38Å | 1.37Å | Aromatic |
| C17 | C16 | sing | 1.51Å | 1.52Å | |
| C16 | N02 | sing | 1.47Å | 1.45Å | |
| N02 | C14 | sing | 1.47Å | 1.43Å | |
| C14 | C13 | sing | 1.53Å | 1.51Å | |
| C14 | C15 | sing | 1.53Å | 1.51Å | |
| C13 | C12 | sing | 1.53Å | 1.50Å | |
| C15 | C10 | sing | 1.53Å | 1.50Å | |
| C12 | C11 | sing | 1.53Å | 1.50Å | |
| C10 | C11 | sing | 1.53Å | 1.49Å | |
| C10 | C09 | sing | 1.51Å | 1.51Å | |
| C09 | O03 | doub | 1.21Å | 1.15Å | |
| C09 | N01 | sing | 1.35Å | 1.42Å | |
| N01 | C08 | sing | 1.40Å | 1.43Å | |
| C08 | C07 | doub | 1.36Å | 1.37Å | |
| C08 | C23 | sing | 1.42Å | 1.33Å | |
| C07 | C06 | sing | 1.46Å | 1.55Å | |
| O04 | C23 | doub | 1.22Å | 1.37Å | |
| C23 | O05 | sing | 1.34Å | 1.19Å | |
| C06 | C05 | doub | 1.40Å | 1.33Å | Aromatic |
| C06 | C24 | sing | 1.41Å | 1.56Å | Aromatic |
| O05 | C24 | sing | 1.35Å | 1.30Å | |
| C05 | C03 | sing | 1.38Å | 1.36Å | Aromatic |
| C24 | C25 | doub | 1.39Å | 1.35Å | Aromatic |
| C03 | O02 | sing | 1.36Å | 1.38Å | |
| C03 | C02 | doub | 1.40Å | 1.38Å | Aromatic |
| C25 | C02 | sing | 1.38Å | 1.38Å | Aromatic |
| O02 | C04 | sing | 1.43Å | 1.38Å | |
| C02 | O01 | sing | 1.36Å | 1.39Å | |
| O01 | C01 | sing | 1.43Å | 1.39Å | |
| 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 | |
| C20 | H6 | sing | 1.08Å | 1.08Å | |
| C21 | H7 | sing | 1.08Å | 1.08Å | |
| C22 | H8 | sing | 1.08Å | 1.08Å | |
| C01 | H9 | sing | 1.09Å | 1.10Å | |
| C01 | H10 | sing | 1.09Å | 1.10Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C04 | H12 | sing | 1.09Å | 1.10Å | |
| C04 | H13 | sing | 1.09Å | 1.10Å | |
| C04 | H14 | sing | 1.09Å | 1.10Å | |
| C05 | H15 | sing | 1.08Å | 1.08Å | |
| C07 | H16 | sing | 1.08Å | 1.08Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.08Å | 1.08Å | |
| C19 | H25 | sing | 1.08Å | 1.08Å | |
| C25 | H26 | sing | 1.08Å | 1.08Å | |
| N01 | H27 | sing | 0.97Å | 1.00Å | |
| N02 | H28 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C20 | C21 | 119.5° | 120.0° |
| C20 | C19 | C18 | 120.5° | 120.0° |
| C19 | C20 | H6 | 120.3° | 120.0° |
| C20 | C19 | H25 | 119.7° | 120.0° |
| C20 | C21 | C22 | 119.5° | 120.0° |
| C21 | C20 | H6 | 120.3° | 120.0° |
| C20 | C21 | H7 | 120.3° | 120.0° |
| C19 | C18 | C17 | 119.9° | 120.0° |
| C19 | C18 | H24 | 120.0° | 120.0° |
| C18 | C19 | H25 | 119.8° | 120.0° |
| C21 | C22 | C17 | 121.5° | 120.0° |
| C22 | C21 | H7 | 120.2° | 120.0° |
| C21 | C22 | H8 | 119.2° | 120.0° |
| C18 | C17 | C22 | 119.0° | 120.0° |
| C18 | C17 | C16 | 121.8° | 120.0° |
| C17 | C18 | H24 | 120.0° | 120.0° |
| C22 | C17 | C16 | 119.2° | 119.9° |
| C17 | C22 | H8 | 119.3° | 120.0° |
| C17 | C16 | N02 | 115.3° | 109.5° |
| C17 | C16 | H22 | 108.0° | 109.4° |
| C17 | C16 | H23 | 108.0° | 109.5° |
| C16 | N02 | C14 | 111.7° | 111.0° |
| N02 | C16 | H22 | 108.0° | 109.5° |
| N02 | C16 | H23 | 108.0° | 109.5° |
| C16 | N02 | H28 | 108.9° | 111.0° |
| N02 | C14 | C13 | 111.7° | 109.5° |
| N02 | C14 | C15 | 111.4° | 109.5° |
| N02 | C14 | H21 | 110.3° | 109.5° |
| C14 | N02 | H28 | 108.9° | 111.1° |
| C13 | C14 | C15 | 104.7° | 109.5° |
| C14 | C13 | C12 | 107.8° | 109.5° |
| C14 | C13 | H2 | 109.9° | 109.4° |
| C14 | C13 | H3 | 109.9° | 109.4° |
| C13 | C14 | H21 | 109.3° | 109.5° |
| C14 | C15 | C10 | 109.0° | 109.5° |
| C14 | C15 | H4 | 109.6° | 109.5° |
| C14 | C15 | H5 | 109.6° | 109.4° |
| C15 | C14 | H21 | 109.2° | 109.5° |
| C13 | C12 | C11 | 109.3° | 109.5° |
| C12 | C13 | H2 | 109.9° | 109.5° |
| C12 | C13 | H3 | 109.9° | 109.5° |
| C13 | C12 | H19 | 109.5° | 109.5° |
| C13 | C12 | H20 | 109.5° | 109.5° |
| C15 | C10 | C11 | 106.8° | 109.5° |
| C15 | C10 | C09 | 112.7° | 109.5° |
| C15 | C10 | H1 | 109.7° | 109.5° |
| C10 | C15 | H4 | 109.6° | 109.5° |
| C10 | C15 | H5 | 109.6° | 109.4° |
| C12 | C11 | C10 | 111.7° | 109.4° |
| C12 | C11 | H17 | 108.9° | 109.5° |
| C12 | C11 | H18 | 108.9° | 109.5° |
| C11 | C12 | H19 | 109.5° | 109.5° |
| C11 | C12 | H20 | 109.5° | 109.5° |
| C11 | C10 | C09 | 108.2° | 109.4° |
| C11 | C10 | H1 | 109.9° | 109.5° |
| C10 | C11 | H17 | 108.9° | 109.5° |
| C10 | C11 | H18 | 108.9° | 109.5° |
| C10 | C09 | O03 | 117.5° | 120.0° |
| C10 | C09 | N01 | 122.3° | 120.0° |
| C09 | C10 | H1 | 109.6° | 109.5° |
| O03 | C09 | N01 | 120.2° | 120.0° |
| C09 | N01 | C08 | 123.7° | 120.0° |
| C09 | N01 | H27 | 118.2° | 120.0° |
| N01 | C08 | C07 | 123.3° | 120.2° |
| N01 | C08 | C23 | 115.2° | 120.2° |
| C08 | N01 | H27 | 118.1° | 120.0° |
| C07 | C08 | C23 | 121.5° | 119.6° |
| C08 | C07 | C06 | 121.2° | 118.2° |
| C08 | C07 | H16 | 119.4° | 120.9° |
| C08 | C23 | O04 | 120.2° | 119.2° |
| C08 | C23 | O05 | 122.0° | 121.6° |
| C07 | C06 | C05 | 142.5° | 120.8° |
| C07 | C06 | C24 | 105.8° | 119.0° |
| C06 | C07 | H16 | 119.4° | 120.9° |
| O04 | C23 | O05 | 117.8° | 119.2° |
| C23 | O05 | C24 | 128.4° | 121.6° |
| C05 | C06 | C24 | 111.7° | 120.1° |
| C06 | C05 | C03 | 126.9° | 119.6° |
| C06 | C05 | H15 | 116.5° | 120.2° |
| C06 | C24 | O05 | 121.1° | 119.9° |
| C06 | C24 | C25 | 121.7° | 119.5° |
| O05 | C24 | C25 | 117.2° | 120.5° |
| C05 | C03 | O02 | 115.3° | 119.9° |
| C05 | C03 | C02 | 119.8° | 120.2° |
| C03 | C05 | H15 | 116.5° | 120.2° |
| C24 | C25 | C02 | 119.3° | 120.1° |
| C24 | C25 | H26 | 120.4° | 120.0° |
| O02 | C03 | C02 | 124.9° | 119.9° |
| C03 | O02 | C04 | 119.3° | 117.0° |
| C03 | C02 | C25 | 120.6° | 120.5° |
| C03 | C02 | O01 | 119.9° | 119.8° |
| C25 | C02 | O01 | 119.4° | 119.8° |
| C02 | C25 | H26 | 120.4° | 119.9° |
| O02 | C04 | H12 | 109.5° | 109.5° |
| O02 | C04 | H13 | 109.5° | 109.4° |
| O02 | C04 | H14 | 109.5° | 109.4° |
| C02 | O01 | C01 | 119.2° | 117.0° |
| O01 | C01 | H9 | 109.5° | 109.5° |
| O01 | C01 | H10 | 109.5° | 109.5° |
| O01 | C01 | H11 | 109.5° | 109.4° |
| H2 | C13 | H3 | 109.4° | 109.5° |
| H4 | C15 | H5 | 109.5° | 109.5° |
| H9 | C01 | H10 | 109.5° | 109.5° |
| H9 | C01 | H11 | 109.4° | 109.5° |
| H10 | C01 | H11 | 109.5° | 109.4° |
| H12 | C04 | H13 | 109.5° | 109.5° |
| H12 | C04 | H14 | 109.4° | 109.5° |
| H13 | C04 | H14 | 109.5° | 109.4° |
| H17 | C11 | H18 | 109.5° | 109.5° |
| H19 | C12 | H20 | 109.5° | 109.5° |
| H22 | C16 | H23 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C20 | C21 | H6 | 180.0° | 179.7° |
| C20 | C19 | C18 | H25 | 180.0° | 179.7° |
| C19 | C20 | C21 | C22 | 0.2° | 0.4° |
| C20 | C19 | C18 | C17 | 0.8° | 0.0° |
| C19 | C20 | C21 | H7 | 179.8° | 180.0° |
| C20 | C19 | C18 | H24 | 179.2° | 180.0° |
| C21 | C20 | C19 | C18 | 0.1° | 0.3° |
| C20 | C21 | C22 | H7 | 180.0° | 179.7° |
| C20 | C21 | C22 | C17 | 1.0° | 0.1° |
| C20 | C21 | C22 | H8 | 179.0° | 180.0° |
| C21 | C20 | C19 | H25 | 179.9° | 180.0° |
| C19 | C18 | C17 | H24 | 180.0° | 180.0° |
| C19 | C18 | C17 | C22 | 1.6° | 0.3° |
| C19 | C18 | C17 | C16 | 179.7° | 180.0° |
| C18 | C19 | C20 | H6 | 179.9° | 180.0° |
| C21 | C22 | C17 | C18 | 1.7° | 0.2° |
| C21 | C22 | C17 | H8 | 180.0° | 179.9° |
| C21 | C22 | C17 | C16 | 179.9° | 180.0° |
| C22 | C21 | C20 | H6 | 179.8° | 180.0° |
| C18 | C17 | C22 | C16 | 178.1° | 179.7° |
| C18 | C17 | C16 | N02 | 50.0° | 89.7° |
| C18 | C17 | C22 | H8 | 178.2° | 179.7° |
| C18 | C17 | C16 | H22 | 170.8° | 30.3° |
| C18 | C17 | C16 | H23 | 70.9° | 150.2° |
| C17 | C18 | C19 | H25 | 179.2° | 179.7° |
| C22 | C17 | C16 | N02 | 131.9° | 90.0° |
| C17 | C22 | C21 | H7 | 178.9° | 179.8° |
| C22 | C17 | C16 | H22 | 11.1° | 150.0° |
| C22 | C17 | C16 | H23 | 107.2° | 30.0° |
| C22 | C17 | C18 | H24 | 178.4° | 179.7° |
| C17 | C16 | N02 | H22 | 120.9° | 120.0° |
| C17 | C16 | N02 | H23 | 120.9° | 120.1° |
| C17 | C16 | N02 | C14 | 76.7° | 179.9° |
| C16 | C17 | C22 | H8 | 0.1° | 0.0° |
| C17 | C16 | H22 | H23 | 117.4° | 120.0° |
| C16 | C17 | C18 | H24 | 0.3° | 0.0° |
| C17 | C16 | N02 | H28 | 163.0° | 56.1° |
| C16 | N02 | C14 | H28 | 120.3° | 123.9° |
| C16 | N02 | C14 | C13 | 56.9° | 85.0° |
| C16 | N02 | C14 | C15 | 173.7° | 155.0° |
| C16 | N02 | C14 | H21 | 64.8° | 35.0° |
| N02 | C16 | H22 | H23 | 117.3° | 120.0° |
| N02 | C14 | C13 | C15 | 120.7° | 120.0° |
| N02 | C14 | C13 | H21 | 122.4° | 120.0° |
| N02 | C14 | C15 | H21 | 122.1° | 120.0° |
| N02 | C14 | C13 | C12 | 173.0° | 180.0° |
| N02 | C14 | C15 | C10 | 170.1° | 180.0° |
| N02 | C14 | C13 | H2 | 53.3° | 60.0° |
| N02 | C14 | C13 | H3 | 67.2° | 60.0° |
| N02 | C14 | C15 | H4 | 69.9° | 60.0° |
| N02 | C14 | C15 | H5 | 50.2° | 60.0° |
| C14 | N02 | C16 | H22 | 44.2° | 60.0° |
| C14 | N02 | C16 | H23 | 162.5° | 60.0° |
| C13 | C14 | C15 | H21 | 116.9° | 120.0° |
| C14 | C13 | C12 | H2 | 119.8° | 119.9° |
| C14 | C13 | C12 | H3 | 119.7° | 120.0° |
| C13 | C14 | C15 | C10 | 68.9° | 60.0° |
| C14 | C13 | C12 | C11 | 61.3° | 60.0° |
| C14 | C13 | H2 | H3 | 120.8° | 119.9° |
| C13 | C14 | C15 | H4 | 51.0° | 180.0° |
| C13 | C14 | C15 | H5 | 171.1° | 60.0° |
| C14 | C13 | C12 | H19 | 58.7° | 60.0° |
| C14 | C13 | C12 | H20 | 178.8° | 180.0° |
| C13 | C14 | N02 | H28 | 63.4° | 38.9° |
| C15 | C14 | C13 | C12 | 66.2° | 60.0° |
| C14 | C15 | C10 | H4 | 119.9° | 120.0° |
| C14 | C15 | C10 | H5 | 119.9° | 119.9° |
| C14 | C15 | C10 | C11 | 64.1° | 60.0° |
| C14 | C15 | C10 | C09 | 177.3° | 180.0° |
| C14 | C15 | C10 | H1 | 54.9° | 60.0° |
| C15 | C14 | C13 | H2 | 174.0° | 60.0° |
| C15 | C14 | C13 | H3 | 53.5° | 180.0° |
| C14 | C15 | H4 | H5 | 120.2° | 120.0° |
| C15 | C14 | N02 | H28 | 53.4° | 81.1° |
| C13 | C12 | C11 | H19 | 120.0° | 120.0° |
| C13 | C12 | C11 | H20 | 120.0° | 120.0° |
| C13 | C12 | C11 | C10 | 57.5° | 60.0° |
| C12 | C13 | H2 | H3 | 120.8° | 120.1° |
| C13 | C12 | C11 | H17 | 177.9° | 60.0° |
| C13 | C12 | C11 | H18 | 62.8° | 180.0° |
| C13 | C12 | H19 | H20 | 120.1° | 120.0° |
| C12 | C13 | C14 | H21 | 50.7° | 60.0° |
| C15 | C10 | C11 | C12 | 57.8° | 60.0° |
| C15 | C10 | C11 | C09 | 121.5° | 120.0° |
| C15 | C10 | C11 | H1 | 118.9° | 120.0° |
| C15 | C10 | C09 | H1 | 122.4° | 120.0° |
| C15 | C10 | C09 | O03 | 171.8° | 0.0° |
| C15 | C10 | C09 | N01 | 7.3° | 180.0° |
| C10 | C15 | H4 | H5 | 120.2° | 120.0° |
| C15 | C10 | C11 | H17 | 178.1° | 60.0° |
| C15 | C10 | C11 | H18 | 62.6° | 180.0° |
| C10 | C15 | C14 | H21 | 48.0° | 60.0° |
| C12 | C11 | C10 | H17 | 120.3° | 120.0° |
| C12 | C11 | C10 | H18 | 120.3° | 120.0° |
| C12 | C11 | C10 | C09 | 179.2° | 180.0° |
| C12 | C11 | C10 | H1 | 61.2° | 60.0° |
| C11 | C12 | C13 | H2 | 179.0° | 59.9° |
| C11 | C12 | C13 | H3 | 58.5° | 180.0° |
| C12 | C11 | H17 | H18 | 119.0° | 120.0° |
| C11 | C12 | H19 | H20 | 120.1° | 120.0° |
| C11 | C10 | C09 | H1 | 119.8° | 120.0° |
| C11 | C10 | C09 | O03 | 70.4° | 120.0° |
| C11 | C10 | C09 | N01 | 110.5° | 59.9° |
| C11 | C10 | C15 | H4 | 55.8° | 180.0° |
| C11 | C10 | C15 | H5 | 175.9° | 60.0° |
| C10 | C11 | H17 | H18 | 119.0° | 120.0° |
| C10 | C11 | C12 | H19 | 62.4° | 60.0° |
| C10 | C11 | C12 | H20 | 177.5° | 180.0° |
| C10 | C09 | O03 | N01 | 179.1° | 180.0° |
| C10 | C09 | N01 | C08 | 179.3° | 175.0° |
| C09 | C10 | C15 | H4 | 62.8° | 60.0° |
| C09 | C10 | C15 | H5 | 57.3° | 60.0° |
| C09 | C10 | C11 | H17 | 60.4° | 60.0° |
| C09 | C10 | C11 | H18 | 58.9° | 60.0° |
| C10 | C09 | N01 | H27 | 0.7° | 4.9° |
| O03 | C09 | N01 | C08 | 0.2° | 5.0° |
| O03 | C09 | C10 | H1 | 49.3° | 120.0° |
| O03 | C09 | N01 | H27 | 179.8° | 175.0° |
| C09 | N01 | C08 | H27 | 180.0° | 179.9° |
| C09 | N01 | C08 | C07 | 0.2° | 121.4° |
| C09 | N01 | C08 | C23 | 179.2° | 58.6° |
| N01 | C09 | C10 | H1 | 129.8° | 60.0° |
| N01 | C08 | C07 | C23 | 179.0° | 180.0° |
| N01 | C08 | C07 | C06 | 179.8° | 180.0° |
| N01 | C08 | C23 | O04 | 0.2° | 0.0° |
| N01 | C08 | C23 | O05 | 179.9° | 179.7° |
| N01 | C08 | C07 | H16 | 0.2° | 0.0° |
| C08 | C07 | C06 | H16 | 180.0° | 180.0° |
| C07 | C08 | C23 | O04 | 179.2° | 180.0° |
| C07 | C08 | C23 | O05 | 0.8° | 0.3° |
| C08 | C07 | C06 | C05 | 180.0° | 180.0° |
| C08 | C07 | C06 | C24 | 0.5° | 0.0° |
| C07 | C08 | N01 | H27 | 179.8° | 58.7° |
| C23 | C08 | C07 | C06 | 0.8° | 0.0° |
| C08 | C23 | O04 | O05 | 179.9° | 179.7° |
| C08 | C23 | O05 | C24 | 0.7° | 0.6° |
| C23 | C08 | C07 | H16 | 179.2° | 180.0° |
| C23 | C08 | N01 | H27 | 0.8° | 121.3° |
| C07 | C06 | C05 | C24 | 179.5° | 180.0° |
| C07 | C06 | C24 | O05 | 0.4° | 0.2° |
| C07 | C06 | C05 | C03 | 179.9° | 180.0° |
| C07 | C06 | C24 | C25 | 179.9° | 179.9° |
| C07 | C06 | C05 | H15 | 0.1° | 0.0° |
| O04 | C23 | O05 | C24 | 179.3° | 179.7° |
| C23 | O05 | C24 | C06 | 0.6° | 0.6° |
| C23 | O05 | C24 | C25 | 179.7° | 179.6° |
| C05 | C06 | C24 | O05 | 179.9° | 179.7° |
| C06 | C05 | C03 | H15 | 180.0° | 180.0° |
| C05 | C06 | C24 | C25 | 0.2° | 0.1° |
| C06 | C05 | C03 | O02 | 179.7° | 180.0° |
| C06 | C05 | C03 | C02 | 0.6° | 0.0° |
| C05 | C06 | C07 | H16 | 0.0° | 0.0° |
| C06 | C24 | O05 | C25 | 179.7° | 179.8° |
| C24 | C06 | C05 | C03 | 0.6° | 0.0° |
| C06 | C24 | C25 | C02 | 0.1° | 0.1° |
| C24 | C06 | C05 | H15 | 179.4° | 180.0° |
| C24 | C06 | C07 | H16 | 179.5° | 179.9° |
| C06 | C24 | C25 | H26 | 179.9° | 180.0° |
| O05 | C24 | C25 | C02 | 179.6° | 179.7° |
| O05 | C24 | C25 | H26 | 0.4° | 0.2° |
| C05 | C03 | O02 | C02 | 179.0° | 179.9° |
| C05 | C03 | C02 | C25 | 0.2° | 0.1° |
| C05 | C03 | O02 | C04 | 151.3° | 0.0° |
| C05 | C03 | C02 | O01 | 179.6° | 180.0° |
| C24 | C25 | C02 | C03 | 0.2° | 0.1° |
| C24 | C25 | C02 | H26 | 180.0° | 179.9° |
| C24 | C25 | C02 | O01 | 180.0° | 180.0° |
| O02 | C03 | C02 | C25 | 179.2° | 180.0° |
| O02 | C03 | C02 | O01 | 0.6° | 0.1° |
| C03 | O02 | C04 | H12 | 180.0° | 180.0° |
| C03 | O02 | C04 | H13 | 60.0° | 60.0° |
| C03 | O02 | C04 | H14 | 60.0° | 60.0° |
| O02 | C03 | C05 | H15 | 0.3° | 0.0° |
| C03 | C02 | C25 | O01 | 179.8° | 179.9° |
| C02 | C03 | O02 | C04 | 29.7° | 180.0° |
| C03 | C02 | O01 | C01 | 175.2° | 180.0° |
| C02 | C03 | C05 | H15 | 179.4° | 180.0° |
| C03 | C02 | C25 | H26 | 179.9° | 180.0° |
| C25 | C02 | O01 | C01 | 4.6° | 0.1° |
| O02 | C04 | H12 | H13 | 120.0° | 120.0° |
| O02 | C04 | H12 | H14 | 120.0° | 120.0° |
| O02 | C04 | H13 | H14 | 120.0° | 119.9° |
| C02 | O01 | C01 | H9 | 180.0° | 180.0° |
| C02 | O01 | C01 | H10 | 60.0° | 60.0° |
| C02 | O01 | C01 | H11 | 60.0° | 60.0° |
| O01 | C02 | C25 | H26 | 0.1° | 0.1° |
| O01 | C01 | H9 | H10 | 120.0° | 120.0° |
| O01 | C01 | H9 | H11 | 120.0° | 120.0° |
| O01 | C01 | H10 | H11 | 120.0° | 119.9° |
| H1 | C10 | C15 | H4 | 174.8° | 60.0° |
| H1 | C10 | C15 | H5 | 65.0° | 180.0° |
| H1 | C10 | C11 | H17 | 59.2° | 180.0° |
| H1 | C10 | C11 | H18 | 178.5° | 60.0° |
| H2 | C13 | C12 | H19 | 61.1° | 180.0° |
| H2 | C13 | C12 | H20 | 59.0° | 60.1° |
| H2 | C13 | C14 | H21 | 69.1° | 180.0° |
| H3 | C13 | C12 | H19 | 178.4° | 60.0° |
| H3 | C13 | C12 | H20 | 61.5° | 60.0° |
| H3 | C13 | C14 | H21 | 170.4° | 60.0° |
| H4 | C15 | C14 | H21 | 167.9° | 60.0° |
| H5 | C15 | C14 | H21 | 71.9° | 179.9° |
| H6 | C20 | C21 | H7 | 0.2° | 0.3° |
| H6 | C20 | C19 | H25 | 0.1° | 0.3° |
| H7 | C21 | C22 | H8 | 1.1° | 0.3° |
| H9 | C01 | H10 | H11 | 120.0° | 120.0° |
| H12 | C04 | H13 | H14 | 120.0° | 120.0° |
| H17 | C11 | C12 | H19 | 57.9° | 180.0° |
| H17 | C11 | C12 | H20 | 62.1° | 60.0° |
| H18 | C11 | C12 | H19 | 177.3° | 60.0° |
| H18 | C11 | C12 | H20 | 57.2° | 60.0° |
| H21 | C14 | N02 | H28 | 174.9° | 158.9° |
| H22 | C16 | N02 | H28 | 76.2° | 176.1° |
| H23 | C16 | N02 | H28 | 42.1° | 64.0° |
| H24 | C18 | C19 | H25 | 0.8° | 0.3° |
