6NZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C3 | C4 | sing | 1.51Å | 1.52Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C4 | C10 | sing | 1.41Å | 1.42Å | |
| C4 | C5 | doub | 1.36Å | 1.39Å | |
| C5 | C6 | sing | 1.40Å | 1.43Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | C7 | doub | 1.35Å | 1.37Å | |
| C6 | C12 | sing | 1.51Å | 1.53Å | |
| N8 | C7 | sing | 1.36Å | 1.37Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C10 | N8 | sing | 1.35Å | 1.36Å | |
| N8 | HN8 | sing | 0.97Å | 1.00Å | |
| O11 | C10 | doub | 1.22Å | 1.23Å | |
| C13 | C12 | sing | 1.53Å | 1.56Å | |
| C12 | C17 | sing | 1.53Å | 1.55Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.53Å | 1.55Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C14 | C15 | sing | 1.53Å | 1.54Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C15 | C16 | sing | 1.53Å | 1.54Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C17 | C16 | sing | 1.53Å | 1.54Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.5° | 109.5° |
| C2 | C1 | H1B | 109.4° | 109.4° |
| C1 | C2 | C3 | 112.0° | 109.4° |
| C1 | C2 | H2 | 108.9° | 109.4° |
| C1 | C2 | H2A | 108.9° | 109.5° |
| H1 | C1 | H1A | 109.4° | 109.5° |
| H1 | C1 | H1B | 109.5° | 109.4° |
| H1A | C1 | H1B | 109.5° | 109.5° |
| C3 | C2 | H2 | 108.9° | 109.5° |
| C3 | C2 | H2A | 108.8° | 109.5° |
| C2 | C3 | C4 | 111.5° | 109.5° |
| C2 | C3 | H3 | 109.0° | 109.5° |
| C2 | C3 | H3A | 108.9° | 109.5° |
| H2 | C2 | H2A | 109.4° | 109.5° |
| C4 | C3 | H3 | 109.0° | 109.5° |
| C4 | C3 | H3A | 109.0° | 109.5° |
| C3 | C4 | C10 | 119.8° | 120.4° |
| C3 | C4 | C5 | 121.7° | 120.4° |
| H3 | C3 | H3A | 109.5° | 109.5° |
| C10 | C4 | C5 | 118.5° | 119.3° |
| C4 | C10 | N8 | 119.2° | 120.1° |
| C4 | C10 | O11 | 121.3° | 119.9° |
| C4 | C5 | C6 | 120.8° | 119.3° |
| C4 | C5 | H5 | 119.6° | 120.3° |
| C6 | C5 | H5 | 119.6° | 120.4° |
| C5 | C6 | C7 | 117.9° | 119.9° |
| C5 | C6 | C12 | 123.9° | 120.0° |
| C7 | C6 | C12 | 118.2° | 120.1° |
| C6 | C7 | N8 | 121.4° | 120.7° |
| C6 | C7 | H7 | 119.3° | 119.7° |
| C6 | C12 | C13 | 113.9° | 109.5° |
| C6 | C12 | C17 | 110.8° | 109.5° |
| C6 | C12 | H12 | 106.3° | 109.5° |
| N8 | C7 | H7 | 119.3° | 119.6° |
| C7 | N8 | C10 | 122.1° | 120.8° |
| C7 | N8 | HN8 | 118.9° | 119.6° |
| C10 | N8 | HN8 | 119.0° | 119.7° |
| N8 | C10 | O11 | 119.5° | 120.0° |
| C13 | C12 | C17 | 113.0° | 109.5° |
| C13 | C12 | H12 | 106.0° | 109.5° |
| C12 | C13 | C14 | 115.3° | 109.5° |
| C12 | C13 | H13 | 108.0° | 109.5° |
| C12 | C13 | H13A | 108.0° | 109.5° |
| C17 | C12 | H12 | 106.1° | 109.4° |
| C12 | C17 | C16 | 111.8° | 109.5° |
| C12 | C17 | H17 | 108.8° | 109.5° |
| C12 | C17 | H17A | 108.9° | 109.5° |
| C14 | C13 | H13 | 108.0° | 109.5° |
| C14 | C13 | H13A | 108.0° | 109.5° |
| C13 | C14 | C15 | 112.6° | 109.5° |
| C13 | C14 | H14 | 108.7° | 109.4° |
| C13 | C14 | H14A | 108.7° | 109.4° |
| H13 | C13 | H13A | 109.4° | 109.4° |
| C15 | C14 | H14 | 108.7° | 109.5° |
| C15 | C14 | H14A | 108.7° | 109.5° |
| C14 | C15 | C16 | 110.2° | 109.5° |
| C14 | C15 | H15 | 109.3° | 109.5° |
| C14 | C15 | H15A | 109.3° | 109.4° |
| H14 | C14 | H14A | 109.5° | 109.5° |
| C16 | C15 | H15 | 109.3° | 109.5° |
| C16 | C15 | H15A | 109.3° | 109.5° |
| C15 | C16 | C17 | 108.5° | 109.5° |
| C15 | C16 | H16 | 109.7° | 109.4° |
| C15 | C16 | H16A | 109.7° | 109.5° |
| H15 | C15 | H15A | 109.5° | 109.4° |
| C17 | C16 | H16 | 109.7° | 109.5° |
| C17 | C16 | H16A | 109.7° | 109.5° |
| C16 | C17 | H17 | 108.9° | 109.5° |
| C16 | C17 | H17A | 108.8° | 109.5° |
| H16 | C16 | H16A | 109.5° | 109.4° |
| H17 | C17 | H17A | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | H1 | H1A | 120.0° | 120.1° |
| C2 | C1 | H1 | H1B | 120.0° | 120.0° |
| C2 | C1 | H1A | H1B | 120.0° | 120.0° |
| C1 | C2 | C3 | H2 | 120.4° | 119.9° |
| C1 | C2 | C3 | H2A | 120.4° | 120.0° |
| C1 | C2 | H2 | H2A | 118.9° | 120.0° |
| C1 | C2 | C3 | C4 | 118.4° | 180.0° |
| C1 | C2 | C3 | H3 | 121.3° | 60.0° |
| C1 | C2 | C3 | H3A | 1.9° | 60.0° |
| H1 | C1 | H1A | H1B | 120.0° | 119.9° |
| H1 | C1 | C2 | C3 | 180.0° | 60.0° |
| H1 | C1 | C2 | H2 | 59.6° | 59.9° |
| H1 | C1 | C2 | H2A | 59.7° | 179.9° |
| H1A | C1 | C2 | C3 | 60.0° | 60.1° |
| H1A | C1 | C2 | H2 | 60.4° | 180.0° |
| H1A | C1 | C2 | H2A | 179.6° | 60.0° |
| H1B | C1 | C2 | C3 | 60.0° | 180.0° |
| H1B | C1 | C2 | H2 | 179.6° | 60.0° |
| H1B | C1 | C2 | H2A | 60.4° | 60.0° |
| C3 | C2 | H2 | H2A | 118.8° | 120.1° |
| C2 | C3 | C4 | H3 | 120.3° | 120.0° |
| C2 | C3 | C4 | H3A | 120.3° | 120.0° |
| C2 | C3 | H3 | H3A | 119.1° | 120.0° |
| C2 | C3 | C4 | C10 | 106.4° | 85.0° |
| C2 | C3 | C4 | C5 | 74.5° | 95.3° |
| H2 | C2 | C3 | C4 | 2.0° | 60.0° |
| H2 | C2 | C3 | H3 | 118.3° | 180.0° |
| H2 | C2 | C3 | H3A | 122.3° | 60.0° |
| H2A | C2 | C3 | C4 | 121.2° | 60.0° |
| H2A | C2 | C3 | H3 | 0.9° | 60.0° |
| H2A | C2 | C3 | H3A | 118.5° | 180.0° |
| C4 | C3 | H3 | H3A | 119.1° | 120.0° |
| C3 | C4 | C10 | C5 | 179.2° | 179.7° |
| C3 | C4 | C5 | C6 | 179.0° | 180.0° |
| C3 | C4 | C5 | H5 | 1.0° | 0.1° |
| C3 | C4 | C10 | N8 | 179.1° | 179.7° |
| C3 | C4 | C10 | O11 | 0.4° | 0.0° |
| H3 | C3 | C4 | C10 | 133.3° | 155.0° |
| H3 | C3 | C4 | C5 | 45.8° | 24.7° |
| H3A | C3 | C4 | C10 | 13.9° | 35.0° |
| H3A | C3 | C4 | C5 | 165.3° | 144.7° |
| C10 | C4 | C5 | C6 | 0.2° | 0.3° |
| C10 | C4 | C5 | H5 | 179.8° | 179.8° |
| C4 | C10 | N8 | C7 | 0.2° | 0.6° |
| C4 | C10 | N8 | O11 | 179.5° | 179.7° |
| C4 | C10 | N8 | HN8 | 179.8° | 179.7° |
| C4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 0.0° | 0.1° |
| C4 | C5 | C6 | C12 | 180.0° | 180.0° |
| C5 | C4 | C10 | N8 | 0.1° | 0.6° |
| C5 | C4 | C10 | O11 | 179.6° | 179.7° |
| C5 | C6 | C7 | C12 | 180.0° | 179.9° |
| C5 | C6 | C7 | N8 | 0.3° | 0.1° |
| C5 | C6 | C7 | H7 | 179.7° | 180.0° |
| C5 | C6 | C12 | C13 | 22.6° | 60.1° |
| C5 | C6 | C12 | C17 | 106.2° | 60.0° |
| C5 | C6 | C12 | H12 | 138.9° | 179.9° |
| H5 | C5 | C6 | C7 | 180.0° | 180.0° |
| H5 | C5 | C6 | C12 | 0.0° | 0.1° |
| C6 | C7 | N8 | H7 | 180.0° | 179.9° |
| C6 | C7 | N8 | C10 | 0.4° | 0.4° |
| C6 | C7 | N8 | HN8 | 179.6° | 180.0° |
| C7 | C6 | C12 | C13 | 157.5° | 120.0° |
| C7 | C6 | C12 | C17 | 73.8° | 120.0° |
| C7 | C6 | C12 | H12 | 41.1° | 0.0° |
| C12 | C6 | C7 | N8 | 179.7° | 180.0° |
| C12 | C6 | C7 | H7 | 0.3° | 0.1° |
| C6 | C12 | C13 | C17 | 127.6° | 120.0° |
| C6 | C12 | C13 | H12 | 116.6° | 120.0° |
| C6 | C12 | C17 | H12 | 115.0° | 120.0° |
| C6 | C12 | C13 | C14 | 168.1° | 180.0° |
| C6 | C12 | C13 | H13 | 71.1° | 59.9° |
| C6 | C12 | C13 | H13A | 47.2° | 60.0° |
| C6 | C12 | C17 | C16 | 178.9° | 180.0° |
| C6 | C12 | C17 | H17 | 58.5° | 60.0° |
| C6 | C12 | C17 | H17A | 60.8° | 60.0° |
| C7 | N8 | C10 | HN8 | 180.0° | 179.7° |
| C7 | N8 | C10 | O11 | 179.3° | 179.7° |
| H7 | C7 | N8 | C10 | 179.6° | 179.7° |
| H7 | C7 | N8 | HN8 | 0.4° | 0.1° |
| HN8 | N8 | C10 | O11 | 0.7° | 0.0° |
| C13 | C12 | C17 | H12 | 115.7° | 120.0° |
| C12 | C13 | C14 | H13 | 120.9° | 120.0° |
| C12 | C13 | C14 | H13A | 120.9° | 120.0° |
| C12 | C13 | H13 | H13A | 117.4° | 119.9° |
| C12 | C13 | C14 | C15 | 43.2° | 60.0° |
| C12 | C13 | C14 | H14 | 77.3° | 60.0° |
| C12 | C13 | C14 | H14A | 163.6° | 180.0° |
| C13 | C12 | C17 | C16 | 49.6° | 60.0° |
| C13 | C12 | C17 | H17 | 70.8° | 60.0° |
| C13 | C12 | C17 | H17A | 169.9° | 179.9° |
| C17 | C12 | C13 | C14 | 40.5° | 60.0° |
| C17 | C12 | C13 | H13 | 161.3° | 180.0° |
| C17 | C12 | C13 | H13A | 80.4° | 60.0° |
| C12 | C17 | C16 | C15 | 61.4° | 60.0° |
| C12 | C17 | C16 | H17 | 120.3° | 120.0° |
| C12 | C17 | C16 | H17A | 120.4° | 120.0° |
| C12 | C17 | C16 | H16 | 58.5° | 60.0° |
| C12 | C17 | C16 | H16A | 178.8° | 180.0° |
| C12 | C17 | H17 | H17A | 118.9° | 120.0° |
| H12 | C12 | C13 | C14 | 75.3° | 60.0° |
| H12 | C12 | C13 | H13 | 45.5° | 60.1° |
| H12 | C12 | C13 | H13A | 163.8° | 180.0° |
| H12 | C12 | C17 | C16 | 66.1° | 60.0° |
| H12 | C12 | C17 | H17 | 173.5° | 180.0° |
| H12 | C12 | C17 | H17A | 54.2° | 60.0° |
| C14 | C13 | H13 | H13A | 117.4° | 120.0° |
| C13 | C14 | C15 | H14 | 120.5° | 120.0° |
| C13 | C14 | C15 | H14A | 120.5° | 120.0° |
| C13 | C14 | H14 | H14A | 118.6° | 119.9° |
| C13 | C14 | C15 | C16 | 54.7° | 60.0° |
| C13 | C14 | C15 | H15 | 174.8° | 180.0° |
| C13 | C14 | C15 | H15A | 65.4° | 60.0° |
| H13 | C13 | C14 | C15 | 164.0° | 180.0° |
| H13 | C13 | C14 | H14 | 43.6° | 60.0° |
| H13 | C13 | C14 | H14A | 75.5° | 60.0° |
| H13A | C13 | C14 | C15 | 77.7° | 60.0° |
| H13A | C13 | C14 | H14 | 161.8° | 180.0° |
| H13A | C13 | C14 | H14A | 42.8° | 60.0° |
| C15 | C14 | H14 | H14A | 118.6° | 120.1° |
| C14 | C15 | C16 | H15 | 120.1° | 120.1° |
| C14 | C15 | C16 | H15A | 120.1° | 119.9° |
| C14 | C15 | H15 | H15A | 119.7° | 120.0° |
| C14 | C15 | C16 | C17 | 63.6° | 60.0° |
| C14 | C15 | C16 | H16 | 56.3° | 60.1° |
| C14 | C15 | C16 | H16A | 176.6° | 180.0° |
| H14 | C14 | C15 | C16 | 65.8° | 60.0° |
| H14 | C14 | C15 | H15 | 54.3° | 60.1° |
| H14 | C14 | C15 | H15A | 174.1° | 180.0° |
| H14A | C14 | C15 | C16 | 175.1° | 180.0° |
| H14A | C14 | C15 | H15 | 64.7° | 60.0° |
| H14A | C14 | C15 | H15A | 55.0° | 60.0° |
| C16 | C15 | H15 | H15A | 119.6° | 120.0° |
| C15 | C16 | C17 | H16 | 119.9° | 120.0° |
| C15 | C16 | C17 | H16A | 119.8° | 120.0° |
| C15 | C16 | H16 | H16A | 120.4° | 119.9° |
| C15 | C16 | C17 | H17 | 59.0° | 60.0° |
| C15 | C16 | C17 | H17A | 178.3° | 180.0° |
| H15 | C15 | C16 | C17 | 176.3° | 179.9° |
| H15 | C15 | C16 | H16 | 63.9° | 60.0° |
| H15 | C15 | C16 | H16A | 56.4° | 59.9° |
| H15A | C15 | C16 | C17 | 56.5° | 60.0° |
| H15A | C15 | C16 | H16 | 176.4° | 180.0° |
| H15A | C15 | C16 | H16A | 63.3° | 60.1° |
| C17 | C16 | H16 | H16A | 120.4° | 120.0° |
| C16 | C17 | H17 | H17A | 118.9° | 120.0° |
| H16 | C16 | C17 | H17 | 178.8° | 180.0° |
| H16 | C16 | C17 | H17A | 61.9° | 60.0° |
| H16A | C16 | C17 | H17 | 60.9° | 60.0° |
| H16A | C16 | C17 | H17A | 58.4° | 60.0° |
