NW8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | C15 | doub | 1.38Å | 1.36Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.37Å | Aromatic |
| C15 | C10 | sing | 1.39Å | 1.35Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.36Å | Aromatic |
| C03 | C02 | doub | 1.36Å | 1.37Å | Aromatic |
| C03 | N04 | sing | 1.37Å | 1.36Å | Aromatic |
| C10 | C02 | sing | 1.48Å | 1.35Å | |
| C10 | C11 | doub | 1.39Å | 1.36Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.35Å | Aromatic |
| C02 | N01 | sing | 1.34Å | 1.33Å | Aromatic |
| C05 | N04 | sing | 1.36Å | 1.36Å | Aromatic |
| C05 | C06 | doub | 1.35Å | 1.39Å | Aromatic |
| N04 | C09 | sing | 1.37Å | 1.32Å | Aromatic |
| C06 | C07 | sing | 1.40Å | 1.40Å | Aromatic |
| N01 | C09 | doub | 1.32Å | 1.36Å | Aromatic |
| C09 | C08 | sing | 1.42Å | 1.45Å | Aromatic |
| C07 | C08 | doub | 1.38Å | 1.41Å | Aromatic |
| C08 | C16 | sing | 1.48Å | 1.41Å | |
| C16 | C17 | doub | 1.39Å | 1.39Å | Aromatic |
| C16 | C21 | sing | 1.39Å | 1.37Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C19 | sing | 1.39Å | 1.37Å | Aromatic |
| C19 | CL1 | sing | 1.74Å | 1.81Å | |
| C12 | H1 | sing | 1.08Å | 1.08Å | |
| C11 | H2 | sing | 1.08Å | 1.08Å | |
| C03 | H3 | sing | 1.08Å | 1.08Å | |
| C05 | H4 | sing | 1.08Å | 1.08Å | |
| C06 | H5 | sing | 1.08Å | 1.08Å | |
| C07 | H6 | sing | 1.08Å | 1.08Å | |
| C13 | H7 | sing | 1.08Å | 1.08Å | |
| C14 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C17 | H10 | sing | 1.08Å | 1.08Å | |
| C18 | H11 | sing | 1.08Å | 1.08Å | |
| C20 | H12 | sing | 1.08Å | 1.08Å | |
| C21 | H13 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C15 | C14 | C13 | 119.0° | 120.1° |
| C14 | C15 | C10 | 117.2° | 119.9° |
| C15 | C14 | H8 | 120.5° | 120.0° |
| C14 | C15 | H9 | 121.4° | 120.0° |
| C14 | C13 | C12 | 123.1° | 120.3° |
| C14 | C13 | H7 | 118.4° | 119.9° |
| C13 | C14 | H8 | 120.5° | 119.9° |
| C15 | C10 | C02 | 116.6° | 120.1° |
| C15 | C10 | C11 | 123.7° | 119.8° |
| C10 | C15 | H9 | 121.4° | 120.1° |
| C13 | C12 | C11 | 117.4° | 120.1° |
| C13 | C12 | H1 | 121.3° | 120.0° |
| C12 | C13 | H7 | 118.5° | 119.9° |
| C02 | C03 | N04 | 105.3° | 107.1° |
| C03 | C02 | C10 | 125.9° | 125.9° |
| C03 | C02 | N01 | 108.7° | 108.2° |
| C02 | C03 | H3 | 127.4° | 126.4° |
| C03 | N04 | C05 | 128.8° | 132.3° |
| C03 | N04 | C09 | 110.3° | 107.1° |
| N04 | C03 | H3 | 127.3° | 126.5° |
| C02 | C10 | C11 | 119.6° | 120.2° |
| C10 | C02 | N01 | 125.4° | 125.8° |
| C10 | C11 | C12 | 119.5° | 119.9° |
| C10 | C11 | H2 | 120.3° | 120.0° |
| C11 | C12 | H1 | 121.3° | 119.9° |
| C12 | C11 | H2 | 120.2° | 120.1° |
| C02 | N01 | C09 | 108.5° | 109.1° |
| N04 | C05 | C06 | 120.9° | 121.1° |
| C05 | N04 | C09 | 120.8° | 120.6° |
| N04 | C05 | H4 | 119.6° | 119.5° |
| C05 | C06 | C07 | 119.6° | 120.4° |
| C06 | C05 | H4 | 119.6° | 119.4° |
| C05 | C06 | H5 | 120.2° | 119.8° |
| N04 | C09 | N01 | 107.2° | 108.4° |
| N04 | C09 | C08 | 122.3° | 119.5° |
| C06 | C07 | C08 | 120.0° | 119.4° |
| C07 | C06 | H5 | 120.2° | 119.8° |
| C06 | C07 | H6 | 120.0° | 120.3° |
| N01 | C09 | C08 | 130.6° | 132.1° |
| C09 | C08 | C07 | 116.4° | 119.0° |
| C09 | C08 | C16 | 123.2° | 120.5° |
| C07 | C08 | C16 | 120.3° | 120.5° |
| C08 | C07 | H6 | 120.0° | 120.3° |
| C08 | C16 | C17 | 121.4° | 120.1° |
| C08 | C16 | C21 | 123.4° | 120.1° |
| C17 | C16 | C21 | 115.1° | 119.8° |
| C16 | C17 | C18 | 123.0° | 119.9° |
| C16 | C17 | H10 | 118.5° | 120.1° |
| C16 | C21 | C20 | 121.2° | 119.8° |
| C16 | C21 | H13 | 119.4° | 120.0° |
| C17 | C18 | C19 | 122.1° | 120.2° |
| C18 | C17 | H10 | 118.5° | 120.0° |
| C17 | C18 | H11 | 119.0° | 120.0° |
| C21 | C20 | C19 | 124.2° | 120.2° |
| C21 | C20 | H12 | 117.9° | 119.9° |
| C20 | C21 | H13 | 119.4° | 120.1° |
| C18 | C19 | C20 | 114.3° | 120.2° |
| C18 | C19 | CL1 | 122.0° | 119.9° |
| C19 | C18 | H11 | 119.0° | 119.9° |
| C20 | C19 | CL1 | 123.6° | 119.9° |
| C19 | C20 | H12 | 117.9° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C15 | C14 | C13 | H8 | 180.0° | 179.2° |
| C14 | C15 | C10 | H9 | 180.0° | 179.2° |
| C15 | C14 | C13 | C12 | 0.1° | 0.5° |
| C14 | C15 | C10 | C02 | 179.3° | 179.4° |
| C14 | C15 | C10 | C11 | 1.0° | 0.5° |
| C15 | C14 | C13 | H7 | 179.9° | 179.5° |
| C13 | C14 | C15 | C10 | 0.4° | 0.8° |
| C14 | C13 | C12 | H7 | 180.0° | 180.0° |
| C14 | C13 | C12 | C11 | 0.0° | 0.1° |
| C14 | C13 | C12 | H1 | 180.0° | 179.7° |
| C13 | C14 | C15 | H9 | 179.6° | 180.0° |
| C15 | C10 | C02 | C03 | 15.2° | 0.3° |
| C15 | C10 | C02 | C11 | 178.4° | 179.9° |
| C15 | C10 | C11 | C12 | 1.1° | 0.1° |
| C15 | C10 | C02 | N01 | 163.3° | 180.0° |
| C15 | C10 | C11 | H2 | 178.9° | 180.0° |
| C10 | C15 | C14 | H8 | 179.6° | 180.0° |
| C13 | C12 | C11 | C10 | 0.6° | 0.3° |
| C13 | C12 | C11 | H1 | 180.0° | 179.6° |
| C13 | C12 | C11 | H2 | 179.5° | 179.8° |
| C12 | C13 | C14 | H8 | 179.9° | 179.8° |
| C02 | C03 | N04 | H3 | 180.0° | 180.0° |
| C03 | C02 | C10 | N01 | 178.4° | 179.7° |
| C03 | C02 | C10 | C11 | 166.5° | 179.8° |
| C02 | C03 | N04 | C05 | 179.6° | 180.0° |
| C02 | C03 | N04 | C09 | 0.2° | 0.2° |
| C03 | C02 | N01 | C09 | 0.2° | 0.3° |
| N04 | C03 | C02 | C10 | 178.9° | 180.0° |
| N04 | C03 | C02 | N01 | 0.2° | 0.3° |
| C03 | N04 | C05 | C09 | 179.8° | 179.8° |
| C03 | N04 | C05 | C06 | 180.0° | 180.0° |
| C03 | N04 | C09 | N01 | 0.0° | 0.0° |
| C03 | N04 | C09 | C08 | 179.6° | 179.8° |
| C03 | N04 | C05 | H4 | 0.1° | 0.0° |
| C02 | C10 | C11 | C12 | 179.4° | 180.0° |
| C10 | C02 | N01 | C09 | 178.9° | 180.0° |
| C02 | C10 | C11 | H2 | 0.6° | 0.1° |
| C10 | C02 | C03 | H3 | 1.1° | 0.0° |
| C02 | C10 | C15 | H9 | 0.7° | 0.2° |
| C10 | C11 | C12 | H2 | 180.0° | 179.9° |
| C11 | C10 | C02 | N01 | 15.1° | 0.1° |
| C10 | C11 | C12 | H1 | 179.4° | 180.0° |
| C11 | C10 | C15 | H9 | 179.0° | 179.7° |
| C11 | C12 | C13 | H7 | 180.0° | 179.9° |
| C02 | N01 | C09 | N04 | 0.1° | 0.2° |
| C02 | N01 | C09 | C08 | 179.4° | 179.6° |
| N01 | C02 | C03 | H3 | 179.8° | 179.7° |
| N04 | C05 | C06 | H4 | 180.0° | 180.0° |
| N04 | C05 | C06 | C07 | 0.2° | 0.0° |
| C05 | N04 | C09 | N01 | 179.8° | 179.9° |
| C05 | N04 | C09 | C08 | 0.2° | 0.4° |
| C05 | N04 | C03 | H3 | 0.4° | 0.1° |
| N04 | C05 | C06 | H5 | 179.8° | 180.0° |
| C06 | C05 | N04 | C09 | 0.2° | 0.2° |
| C05 | C06 | C07 | H5 | 180.0° | 179.9° |
| C05 | C06 | C07 | C08 | 0.2° | 0.0° |
| C05 | C06 | C07 | H6 | 179.7° | 179.9° |
| N04 | C09 | N01 | C08 | 179.5° | 179.7° |
| N04 | C09 | C08 | C07 | 0.6° | 0.4° |
| N04 | C09 | C08 | C16 | 179.7° | 179.7° |
| C09 | N04 | C03 | H3 | 179.9° | 179.8° |
| C09 | N04 | C05 | H4 | 179.8° | 179.8° |
| C06 | C07 | C08 | C09 | 0.6° | 0.2° |
| C06 | C07 | C08 | H6 | 180.0° | 179.9° |
| C06 | C07 | C08 | C16 | 179.7° | 179.9° |
| C07 | C06 | C05 | H4 | 179.8° | 180.0° |
| N01 | C09 | C08 | C07 | 179.9° | 179.9° |
| N01 | C09 | C08 | C16 | 0.9° | 0.1° |
| C09 | C08 | C07 | C16 | 179.1° | 179.9° |
| C09 | C08 | C16 | C17 | 135.7° | 114.8° |
| C09 | C08 | C16 | C21 | 42.2° | 64.8° |
| C09 | C08 | C07 | H6 | 179.4° | 179.9° |
| C07 | C08 | C16 | C17 | 43.4° | 65.1° |
| C07 | C08 | C16 | C21 | 138.7° | 115.3° |
| C08 | C07 | C06 | H5 | 179.8° | 180.0° |
| C08 | C16 | C17 | C21 | 178.1° | 179.7° |
| C08 | C16 | C17 | C18 | 178.9° | 180.0° |
| C08 | C16 | C21 | C20 | 179.0° | 179.7° |
| C16 | C08 | C07 | H6 | 0.3° | 0.0° |
| C08 | C16 | C17 | H10 | 1.1° | 0.1° |
| C08 | C16 | C21 | H13 | 1.0° | 0.0° |
| C16 | C17 | C18 | H10 | 180.0° | 179.9° |
| C17 | C16 | C21 | C20 | 0.9° | 0.6° |
| C16 | C17 | C18 | C19 | 0.4° | 0.0° |
| C16 | C17 | C18 | H11 | 179.6° | 180.0° |
| C17 | C16 | C21 | H13 | 179.1° | 179.7° |
| C21 | C16 | C17 | C18 | 0.8° | 0.3° |
| C16 | C21 | C20 | H13 | 180.0° | 179.7° |
| C16 | C21 | C20 | C19 | 0.7° | 0.6° |
| C21 | C16 | C17 | H10 | 179.2° | 179.8° |
| C16 | C21 | C20 | H12 | 179.3° | 179.7° |
| C17 | C18 | C19 | H11 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.1° | 0.0° |
| C17 | C18 | C19 | CL1 | 180.0° | 180.0° |
| C21 | C20 | C19 | C18 | 0.3° | 0.3° |
| C21 | C20 | C19 | H12 | 180.0° | 179.7° |
| C21 | C20 | C19 | CL1 | 179.8° | 179.7° |
| C18 | C19 | C20 | CL1 | 179.9° | 180.0° |
| C19 | C18 | C17 | H10 | 179.6° | 179.9° |
| C18 | C19 | C20 | H12 | 179.7° | 179.9° |
| C20 | C19 | C18 | H11 | 179.8° | 180.0° |
| C19 | C20 | C21 | H13 | 179.3° | 179.7° |
| CL1 | C19 | C18 | H11 | 0.1° | 0.0° |
| CL1 | C19 | C20 | H12 | 0.2° | 0.0° |
| H1 | C12 | C11 | H2 | 0.6° | 0.1° |
| H1 | C12 | C13 | H7 | 0.0° | 0.3° |
| H4 | C05 | C06 | H5 | 0.2° | 0.0° |
| H5 | C06 | C07 | H6 | 0.3° | 0.0° |
| H7 | C13 | C14 | H8 | 0.2° | 0.2° |
| H8 | C14 | C15 | H9 | 0.4° | 0.8° |
| H10 | C17 | C18 | H11 | 0.5° | 0.1° |
| H12 | C20 | C21 | H13 | 0.7° | 0.0° |
