WNA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N13 | N12 | doub | 1.29Å | 1.31Å | Aromatic |
| N13 | N14 | sing | 1.41Å | 1.34Å | Aromatic |
| N12 | N11 | sing | 1.28Å | 1.35Å | Aromatic |
| N14 | C15 | sing | 1.46Å | 1.43Å | |
| N14 | C10 | sing | 1.35Å | 1.35Å | Aromatic |
| N11 | C10 | doub | 1.32Å | 1.34Å | Aromatic |
| C10 | N09 | sing | 1.38Å | 1.46Å | |
| N09 | C08 | sing | 1.47Å | 1.46Å | |
| C08 | C07 | sing | 1.51Å | 1.54Å | |
| C01 | C02 | sing | 1.51Å | 1.53Å | |
| C07 | C02 | doub | 1.38Å | 1.40Å | Aromatic |
| C07 | C06 | sing | 1.38Å | 1.40Å | Aromatic |
| C02 | C03 | sing | 1.38Å | 1.39Å | Aromatic |
| C06 | C05 | doub | 1.38Å | 1.38Å | Aromatic |
| C03 | C04 | doub | 1.38Å | 1.39Å | Aromatic |
| C05 | C04 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | H1 | sing | 1.09Å | 1.10Å | |
| C15 | H2 | sing | 1.09Å | 1.10Å | |
| C15 | H3 | sing | 1.09Å | 1.10Å | |
| C01 | H4 | sing | 1.09Å | 1.10Å | |
| C01 | H5 | sing | 1.09Å | 1.10Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C03 | H7 | sing | 1.08Å | 1.08Å | |
| C04 | H8 | sing | 1.08Å | 1.08Å | |
| C05 | H9 | sing | 1.08Å | 1.08Å | |
| C06 | H10 | sing | 1.08Å | 1.08Å | |
| C08 | H11 | sing | 1.09Å | 1.10Å | |
| C08 | H12 | sing | 1.09Å | 1.10Å | |
| N09 | H13 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N12 | N13 | N14 | 107.6° | 106.8° |
| N13 | N12 | N11 | 109.1° | 110.3° |
| N13 | N14 | C15 | 123.6° | 127.4° |
| N13 | N14 | C10 | 108.8° | 105.2° |
| N12 | N11 | C10 | 107.5° | 110.5° |
| C15 | N14 | C10 | 127.6° | 127.4° |
| N14 | C15 | H1 | 109.5° | 109.5° |
| N14 | C15 | H2 | 109.4° | 109.5° |
| N14 | C15 | H3 | 109.5° | 109.5° |
| N14 | C10 | N11 | 106.9° | 107.1° |
| N14 | C10 | N09 | 127.3° | 126.4° |
| N11 | C10 | N09 | 125.8° | 126.5° |
| C10 | N09 | C08 | 122.4° | 120.0° |
| C10 | N09 | H13 | 106.1° | 120.0° |
| N09 | C08 | C07 | 113.0° | 109.4° |
| N09 | C08 | H11 | 108.6° | 109.5° |
| N09 | C08 | H12 | 108.6° | 109.5° |
| C08 | N09 | H13 | 106.2° | 120.0° |
| C08 | C07 | C02 | 120.6° | 120.0° |
| C08 | C07 | C06 | 120.6° | 120.0° |
| C07 | C08 | H11 | 108.6° | 109.5° |
| C07 | C08 | H12 | 108.6° | 109.5° |
| C01 | C02 | C07 | 122.6° | 120.0° |
| C01 | C02 | C03 | 117.5° | 120.0° |
| C02 | C01 | H4 | 109.5° | 109.5° |
| C02 | C01 | H5 | 109.4° | 109.5° |
| C02 | C01 | H6 | 109.5° | 109.5° |
| C02 | C07 | C06 | 118.8° | 120.0° |
| C07 | C02 | C03 | 119.9° | 120.0° |
| C07 | C06 | C05 | 120.9° | 120.0° |
| C07 | C06 | H10 | 119.5° | 120.0° |
| C02 | C03 | C04 | 120.5° | 120.0° |
| C02 | C03 | H7 | 119.8° | 120.0° |
| C06 | C05 | C04 | 120.0° | 120.0° |
| C06 | C05 | H9 | 120.0° | 120.0° |
| C05 | C06 | H10 | 119.6° | 120.0° |
| C03 | C04 | C05 | 119.9° | 120.0° |
| C04 | C03 | H7 | 119.8° | 120.0° |
| C03 | C04 | H8 | 120.0° | 120.0° |
| C05 | C04 | H8 | 120.0° | 120.0° |
| C04 | C05 | H9 | 120.0° | 120.0° |
| H1 | C15 | H2 | 109.5° | 109.4° |
| H1 | C15 | H3 | 109.5° | 109.4° |
| H2 | C15 | H3 | 109.5° | 109.4° |
| H4 | C01 | H5 | 109.5° | 109.5° |
| H4 | C01 | H6 | 109.5° | 109.5° |
| H5 | C01 | H6 | 109.5° | 109.4° |
| H11 | C08 | H12 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N12 | N13 | N14 | C15 | 179.4° | 180.0° |
| N12 | N13 | N14 | C10 | 0.3° | 0.2° |
| N13 | N12 | N11 | C10 | 0.0° | 0.2° |
| N14 | N13 | N12 | N11 | 0.2° | 0.0° |
| N13 | N14 | C15 | C10 | 178.8° | 179.8° |
| N13 | N14 | C10 | N11 | 0.4° | 0.2° |
| N13 | N14 | C10 | N09 | 179.7° | 180.0° |
| N13 | N14 | C15 | H1 | 0.0° | 90.0° |
| N13 | N14 | C15 | H2 | 120.0° | 150.0° |
| N13 | N14 | C15 | H3 | 120.0° | 30.0° |
| N12 | N11 | C10 | N14 | 0.2° | 0.2° |
| N12 | N11 | C10 | N09 | 179.8° | 180.0° |
| C15 | N14 | C10 | N11 | 179.3° | 179.9° |
| C15 | N14 | C10 | N09 | 0.7° | 0.2° |
| N14 | C15 | H1 | H2 | 120.0° | 120.0° |
| N14 | C15 | H1 | H3 | 120.0° | 120.0° |
| N14 | C15 | H2 | H3 | 119.9° | 120.0° |
| N14 | C10 | N11 | N09 | 180.0° | 179.7° |
| N14 | C10 | N09 | C08 | 161.8° | 179.7° |
| C10 | N14 | C15 | H1 | 178.8° | 90.2° |
| C10 | N14 | C15 | H2 | 61.1° | 29.8° |
| C10 | N14 | C15 | H3 | 58.8° | 149.8° |
| N14 | C10 | N09 | H13 | 76.4° | 0.3° |
| N11 | C10 | N09 | C08 | 18.2° | 0.0° |
| N11 | C10 | N09 | H13 | 103.6° | 180.0° |
| C10 | N09 | C08 | H13 | 121.8° | 180.0° |
| C10 | N09 | C08 | C07 | 113.3° | 180.0° |
| C10 | N09 | C08 | H11 | 126.2° | 60.0° |
| C10 | N09 | C08 | H12 | 7.2° | 60.0° |
| N09 | C08 | C07 | H11 | 120.5° | 120.0° |
| N09 | C08 | C07 | H12 | 120.5° | 120.0° |
| N09 | C08 | C07 | C02 | 167.9° | 80.0° |
| N09 | C08 | C07 | C06 | 12.4° | 99.7° |
| N09 | C08 | H11 | H12 | 118.4° | 120.0° |
| C08 | C07 | C02 | C01 | 0.1° | 0.0° |
| C08 | C07 | C02 | C06 | 179.7° | 179.7° |
| C08 | C07 | C02 | C03 | 179.7° | 179.7° |
| C08 | C07 | C06 | C05 | 179.9° | 179.7° |
| C08 | C07 | C06 | H10 | 0.1° | 0.0° |
| C07 | C08 | H11 | H12 | 118.4° | 120.0° |
| C07 | C08 | N09 | H13 | 8.5° | 0.0° |
| C01 | C02 | C07 | C03 | 179.9° | 179.7° |
| C01 | C02 | C07 | C06 | 179.9° | 179.7° |
| C01 | C02 | C03 | C04 | 179.9° | 180.0° |
| C02 | C01 | H4 | H5 | 120.0° | 120.0° |
| C02 | C01 | H4 | H6 | 120.0° | 120.0° |
| C02 | C01 | H5 | H6 | 120.0° | 120.0° |
| C01 | C02 | C03 | H7 | 0.1° | 0.0° |
| C02 | C07 | C06 | C05 | 0.1° | 0.6° |
| C07 | C02 | C03 | C04 | 0.2° | 0.3° |
| C07 | C02 | C01 | H4 | 90.1° | 90.3° |
| C07 | C02 | C01 | H5 | 149.9° | 29.7° |
| C07 | C02 | C01 | H6 | 29.9° | 149.7° |
| C07 | C02 | C03 | H7 | 179.8° | 179.7° |
| C02 | C07 | C06 | H10 | 179.8° | 179.7° |
| C02 | C07 | C08 | H11 | 71.6° | 160.0° |
| C02 | C07 | C08 | H12 | 47.3° | 40.0° |
| C06 | C07 | C02 | C03 | 0.0° | 0.6° |
| C07 | C06 | C05 | H10 | 180.0° | 179.8° |
| C07 | C06 | C05 | C04 | 0.0° | 0.3° |
| C07 | C06 | C05 | H9 | 179.9° | 179.7° |
| C06 | C07 | C08 | H11 | 108.1° | 20.2° |
| C06 | C07 | C08 | H12 | 133.0° | 140.3° |
| C02 | C03 | C04 | H7 | 180.0° | 180.0° |
| C02 | C03 | C04 | C05 | 0.3° | 0.0° |
| C03 | C02 | C01 | H4 | 90.1° | 90.0° |
| C03 | C02 | C01 | H5 | 30.0° | 150.0° |
| C03 | C02 | C01 | H6 | 149.9° | 30.0° |
| C02 | C03 | C04 | H8 | 179.7° | 180.0° |
| C06 | C05 | C04 | C03 | 0.2° | 0.0° |
| C06 | C05 | C04 | H9 | 180.0° | 180.0° |
| C06 | C05 | C04 | H8 | 179.8° | 180.0° |
| C03 | C04 | C05 | H8 | 180.0° | 180.0° |
| C03 | C04 | C05 | H9 | 179.8° | 180.0° |
| C05 | C04 | C03 | H7 | 179.7° | 180.0° |
| C04 | C05 | C06 | H10 | 179.9° | 180.0° |
| H1 | C15 | H2 | H3 | 120.0° | 119.9° |
| H4 | C01 | H5 | H6 | 120.0° | 120.0° |
| H7 | C03 | C04 | H8 | 0.3° | 0.0° |
| H8 | C04 | C05 | H9 | 0.2° | 0.0° |
| H9 | C05 | C06 | H10 | 0.1° | 0.0° |
| H11 | C08 | N09 | H13 | 112.1° | 120.0° |
| H12 | C08 | N09 | H13 | 129.0° | 120.0° |
