HAF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C29 | doub | 1.38Å | 1.38Å | Aromatic |
| C30 | C31 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C31 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C27 | doub | 1.38Å | 1.37Å | Aromatic |
| C32 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C27 | C4 | sing | 1.51Å | 1.55Å | |
| C3 | C4 | sing | 1.53Å | 1.56Å | |
| C3 | N2 | sing | 1.47Å | 1.44Å | |
| C4 | C5 | sing | 1.53Å | 1.42Å | |
| C5 | C6 | sing | 1.53Å | 1.46Å | |
| C1 | N2 | sing | 1.47Å | 1.21Å | |
| N2 | C7 | sing | 1.47Å | 1.42Å | |
| C7 | C6 | sing | 1.53Å | 1.55Å | |
| C6 | N8 | sing | 1.47Å | 1.50Å | |
| N8 | C9 | sing | 1.37Å | 1.44Å | |
| C9 | N10 | doub | 1.32Å | 1.46Å | |
| C9 | N18 | sing | 1.36Å | 1.47Å | |
| N10 | C11 | sing | 1.33Å | 1.44Å | |
| C19 | N18 | sing | 1.47Å | 1.46Å | |
| N18 | C16 | sing | 1.35Å | 1.46Å | |
| C11 | C12 | sing | 1.51Å | 1.52Å | |
| C11 | C15 | doub | 1.36Å | 1.46Å | |
| C16 | C15 | sing | 1.41Å | 1.50Å | |
| C16 | O17 | doub | 1.22Å | 1.19Å | |
| C12 | N13 | sing | 1.47Å | 1.48Å | |
| C15 | C14 | sing | 1.51Å | 1.46Å | |
| N13 | C14 | sing | 1.47Å | 1.47Å | |
| N13 | C20 | sing | 1.35Å | 1.43Å | |
| O22 | C20 | sing | 1.35Å | 1.37Å | |
| O22 | C23 | sing | 1.45Å | 1.39Å | |
| C25 | C23 | sing | 1.53Å | 1.52Å | |
| C20 | O21 | doub | 1.22Å | 1.17Å | |
| C23 | C26 | sing | 1.53Å | 1.52Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C24 | H243 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H263 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C1 | H012 | sing | 1.09Å | 1.10Å | |
| C1 | H011 | sing | 1.09Å | 1.10Å | |
| C1 | H013 | sing | 1.09Å | 1.10Å | |
| C3 | H032 | sing | 1.09Å | 1.10Å | |
| C3 | H031 | sing | 1.09Å | 1.10Å | |
| C4 | H041 | sing | 1.09Å | 1.10Å | |
| C5 | H052 | sing | 1.09Å | 1.10Å | |
| C5 | H051 | sing | 1.09Å | 1.10Å | |
| C6 | H061 | sing | 1.09Å | 1.10Å | |
| C7 | H071 | sing | 1.09Å | 1.10Å | |
| C7 | H072 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H193 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C25 | H253 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| N8 | H081 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C29 | C30 | C31 | 119.7° | 120.0° |
| C30 | C29 | C28 | 121.2° | 120.0° |
| C30 | C29 | H291 | 119.4° | 120.0° |
| C29 | C30 | H301 | 120.1° | 120.0° |
| C30 | C31 | C32 | 119.3° | 120.0° |
| C31 | C30 | H301 | 120.1° | 120.0° |
| C30 | C31 | H311 | 120.3° | 120.0° |
| C29 | C28 | C27 | 118.5° | 120.0° |
| C29 | C28 | H281 | 120.8° | 120.0° |
| C28 | C29 | H291 | 119.4° | 120.0° |
| C31 | C32 | C27 | 119.8° | 120.0° |
| C32 | C31 | H311 | 120.3° | 120.0° |
| C31 | C32 | H321 | 120.1° | 120.0° |
| C28 | C27 | C32 | 121.4° | 120.0° |
| C28 | C27 | C4 | 117.7° | 120.0° |
| C27 | C28 | H281 | 120.7° | 120.0° |
| C32 | C27 | C4 | 120.9° | 120.0° |
| C27 | C32 | H321 | 120.1° | 119.9° |
| C27 | C4 | C3 | 113.0° | 109.5° |
| C27 | C4 | C5 | 104.3° | 109.5° |
| C27 | C4 | H041 | 109.6° | 109.5° |
| C4 | C3 | N2 | 108.0° | 109.5° |
| C3 | C4 | C5 | 108.8° | 109.3° |
| C4 | C3 | H032 | 109.9° | 109.5° |
| C4 | C3 | H031 | 109.8° | 109.5° |
| C3 | C4 | H041 | 109.5° | 109.5° |
| C3 | N2 | C1 | 113.5° | 111.0° |
| C3 | N2 | C7 | 113.9° | 111.2° |
| N2 | C3 | H032 | 109.9° | 109.4° |
| N2 | C3 | H031 | 109.9° | 109.4° |
| C4 | C5 | C6 | 108.7° | 109.1° |
| C5 | C4 | H041 | 111.6° | 109.5° |
| C4 | C5 | H052 | 109.7° | 109.5° |
| C4 | C5 | H051 | 109.7° | 109.5° |
| C5 | C6 | C7 | 119.4° | 109.3° |
| C5 | C6 | N8 | 109.0° | 109.5° |
| C6 | C5 | H052 | 109.7° | 109.5° |
| C6 | C5 | H051 | 109.7° | 109.5° |
| C5 | C6 | H061 | 108.0° | 109.5° |
| C1 | N2 | C7 | 109.0° | 111.0° |
| N2 | C1 | H012 | 109.5° | 109.5° |
| N2 | C1 | H011 | 109.5° | 109.5° |
| N2 | C1 | H013 | 109.4° | 109.5° |
| N2 | C7 | C6 | 115.0° | 109.5° |
| N2 | C7 | H071 | 108.1° | 109.4° |
| N2 | C7 | H072 | 108.1° | 109.4° |
| C7 | C6 | N8 | 105.6° | 109.5° |
| C7 | C6 | H061 | 106.8° | 109.5° |
| C6 | C7 | H071 | 108.1° | 109.5° |
| C6 | C7 | H072 | 108.0° | 109.5° |
| C6 | N8 | C9 | 115.5° | 120.0° |
| N8 | C6 | H061 | 107.5° | 109.5° |
| C6 | N8 | H081 | 122.3° | 120.0° |
| N8 | C9 | N10 | 114.0° | 119.4° |
| N8 | C9 | N18 | 123.8° | 119.4° |
| C9 | N8 | H081 | 122.3° | 120.0° |
| N10 | C9 | N18 | 122.2° | 121.2° |
| C9 | N10 | C11 | 120.3° | 121.4° |
| C9 | N18 | C19 | 119.9° | 120.1° |
| C9 | N18 | C16 | 118.3° | 119.7° |
| N10 | C11 | C12 | 132.7° | 131.1° |
| N10 | C11 | C15 | 118.4° | 119.9° |
| C19 | N18 | C16 | 121.8° | 120.2° |
| N18 | C19 | H192 | 109.5° | 109.5° |
| N18 | C19 | H193 | 109.5° | 109.4° |
| N18 | C19 | H191 | 109.5° | 109.5° |
| N18 | C16 | C15 | 118.6° | 118.7° |
| N18 | C16 | O17 | 123.9° | 120.7° |
| C12 | C11 | C15 | 108.8° | 109.0° |
| C11 | C12 | N13 | 101.5° | 107.6° |
| C11 | C12 | H122 | 111.4° | 109.8° |
| C11 | C12 | H121 | 111.4° | 109.8° |
| C11 | C15 | C16 | 122.2° | 119.2° |
| C11 | C15 | C14 | 107.5° | 109.3° |
| C15 | C16 | O17 | 117.5° | 120.7° |
| C16 | C15 | C14 | 130.4° | 131.5° |
| C12 | N13 | C14 | 108.2° | 106.5° |
| C12 | N13 | C20 | 133.3° | 126.8° |
| N13 | C12 | H122 | 111.5° | 109.8° |
| N13 | C12 | H121 | 111.4° | 109.8° |
| C15 | C14 | N13 | 105.3° | 107.5° |
| C15 | C14 | H141 | 110.5° | 109.8° |
| C15 | C14 | H142 | 110.5° | 109.8° |
| C14 | N13 | C20 | 118.0° | 126.7° |
| N13 | C14 | H141 | 110.5° | 109.8° |
| N13 | C14 | H142 | 110.5° | 109.9° |
| N13 | C20 | O22 | 120.2° | 120.0° |
| N13 | C20 | O21 | 120.7° | 120.1° |
| C20 | O22 | C23 | 111.8° | 117.0° |
| O22 | C20 | O21 | 118.7° | 119.9° |
| O22 | C23 | C25 | 103.5° | 109.5° |
| O22 | C23 | C26 | 110.0° | 109.4° |
| O22 | C23 | C24 | 115.4° | 109.5° |
| C25 | C23 | C26 | 110.0° | 109.4° |
| C25 | C23 | C24 | 106.3° | 109.5° |
| C23 | C25 | H253 | 109.5° | 109.4° |
| C23 | C25 | H252 | 109.5° | 109.4° |
| C23 | C25 | H251 | 109.5° | 109.5° |
| C26 | C23 | C24 | 111.1° | 109.5° |
| C23 | C26 | H262 | 109.5° | 109.5° |
| C23 | C26 | H263 | 109.5° | 109.5° |
| C23 | C26 | H261 | 109.5° | 109.5° |
| C23 | C24 | H243 | 109.5° | 109.5° |
| C23 | C24 | H241 | 109.4° | 109.5° |
| C23 | C24 | H242 | 109.5° | 109.5° |
| H243 | C24 | H241 | 109.4° | 109.4° |
| H243 | C24 | H242 | 109.4° | 109.4° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H262 | C26 | H263 | 109.4° | 109.4° |
| H262 | C26 | H261 | 109.5° | 109.5° |
| H263 | C26 | H261 | 109.5° | 109.5° |
| H012 | C1 | H011 | 109.5° | 109.4° |
| H012 | C1 | H013 | 109.5° | 109.5° |
| H011 | C1 | H013 | 109.5° | 109.4° |
| H032 | C3 | H031 | 109.5° | 109.4° |
| H052 | C5 | H051 | 109.5° | 109.6° |
| H071 | C7 | H072 | 109.5° | 109.5° |
| H122 | C12 | H121 | 109.5° | 110.0° |
| H141 | C14 | H142 | 109.5° | 109.9° |
| H192 | C19 | H193 | 109.4° | 109.5° |
| H192 | C19 | H191 | 109.5° | 109.5° |
| H193 | C19 | H191 | 109.5° | 109.5° |
| H253 | C25 | H252 | 109.4° | 109.5° |
| H253 | C25 | H251 | 109.4° | 109.5° |
| H252 | C25 | H251 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C29 | C30 | C31 | H301 | 180.0° | 180.0° |
| C30 | C29 | C28 | H291 | 180.0° | 180.0° |
| C29 | C30 | C31 | C32 | 0.1° | 0.3° |
| C30 | C29 | C28 | C27 | 0.0° | 0.0° |
| C30 | C29 | C28 | H281 | 179.9° | 179.7° |
| C29 | C30 | C31 | H311 | 179.9° | 180.0° |
| C31 | C30 | C29 | C28 | 0.3° | 0.0° |
| C30 | C31 | C32 | H311 | 180.0° | 179.7° |
| C30 | C31 | C32 | C27 | 0.5° | 0.6° |
| C31 | C30 | C29 | H291 | 179.7° | 180.0° |
| C30 | C31 | C32 | H321 | 179.4° | 180.0° |
| C29 | C28 | C27 | H281 | 180.0° | 179.7° |
| C29 | C28 | C27 | C32 | 0.7° | 0.3° |
| C29 | C28 | C27 | C4 | 179.4° | 179.7° |
| C28 | C29 | C30 | H301 | 179.6° | 180.0° |
| C31 | C32 | C27 | C28 | 0.9° | 0.6° |
| C31 | C32 | C27 | H321 | 180.0° | 179.4° |
| C31 | C32 | C27 | C4 | 179.6° | 179.4° |
| C32 | C31 | C30 | H301 | 179.9° | 179.7° |
| C28 | C27 | C32 | C4 | 178.6° | 180.0° |
| C28 | C27 | C4 | C3 | 26.3° | 120.0° |
| C28 | C27 | C4 | C5 | 91.7° | 120.2° |
| C28 | C27 | C4 | H041 | 148.7° | 0.1° |
| C27 | C28 | C29 | H291 | 179.9° | 180.0° |
| C28 | C27 | C32 | H321 | 179.0° | 180.0° |
| C32 | C27 | C4 | C3 | 155.0° | 60.0° |
| C32 | C27 | C4 | C5 | 87.0° | 59.8° |
| C32 | C27 | C28 | H281 | 179.3° | 180.0° |
| C32 | C27 | C4 | H041 | 32.6° | 179.9° |
| C27 | C32 | C31 | H311 | 179.5° | 179.7° |
| C27 | C4 | C3 | C5 | 115.3° | 119.9° |
| C27 | C4 | C3 | H041 | 122.5° | 120.1° |
| C27 | C4 | C3 | N2 | 173.7° | 179.1° |
| C27 | C4 | C5 | H041 | 118.3° | 120.1° |
| C27 | C4 | C5 | C6 | 178.9° | 177.6° |
| C4 | C27 | C28 | H281 | 0.6° | 0.0° |
| C27 | C4 | C3 | H032 | 66.5° | 59.1° |
| C27 | C4 | C3 | H031 | 53.9° | 60.9° |
| C27 | C4 | C5 | H052 | 59.0° | 62.5° |
| C27 | C4 | C5 | H051 | 61.2° | 57.7° |
| C4 | C27 | C32 | H321 | 0.4° | 0.0° |
| C4 | C3 | N2 | H032 | 119.8° | 120.1° |
| C4 | C3 | N2 | H031 | 119.7° | 120.0° |
| C3 | C4 | C5 | H041 | 120.9° | 120.0° |
| C3 | C4 | C5 | C6 | 60.2° | 57.6° |
| C4 | C3 | N2 | C1 | 178.9° | 174.2° |
| C4 | C3 | N2 | C7 | 55.5° | 61.7° |
| C4 | C3 | H032 | H031 | 120.7° | 120.0° |
| C3 | C4 | C5 | H052 | 179.9° | 177.6° |
| C3 | C4 | C5 | H051 | 59.7° | 62.2° |
| N2 | C3 | C4 | C5 | 71.0° | 59.2° |
| C3 | N2 | C1 | C7 | 128.1° | 124.2° |
| C3 | N2 | C7 | C6 | 34.5° | 61.7° |
| C3 | N2 | C1 | H012 | 180.0° | 60.0° |
| C3 | N2 | C1 | H011 | 60.0° | 180.0° |
| C3 | N2 | C1 | H013 | 60.0° | 60.0° |
| N2 | C3 | H032 | H031 | 120.7° | 119.9° |
| N2 | C3 | C4 | H041 | 51.2° | 60.8° |
| C3 | N2 | C7 | H071 | 86.3° | 178.3° |
| C3 | N2 | C7 | H072 | 155.3° | 58.3° |
| C4 | C5 | C6 | H052 | 119.9° | 119.9° |
| C4 | C5 | C6 | H051 | 119.9° | 119.9° |
| C4 | C5 | C6 | C7 | 39.8° | 57.6° |
| C4 | C5 | C6 | N8 | 161.2° | 177.6° |
| C5 | C4 | C3 | H032 | 48.8° | 60.8° |
| C5 | C4 | C3 | H031 | 169.3° | 179.2° |
| C4 | C5 | H052 | H051 | 120.4° | 120.2° |
| C4 | C5 | C6 | H061 | 82.3° | 62.4° |
| C5 | C6 | C7 | N2 | 26.0° | 59.2° |
| C5 | C6 | C7 | N8 | 123.1° | 120.0° |
| C5 | C6 | C7 | H061 | 122.7° | 120.0° |
| C5 | C6 | N8 | H061 | 116.8° | 120.1° |
| C5 | C6 | N8 | C9 | 111.5° | 155.0° |
| C6 | C5 | C4 | H041 | 60.7° | 62.4° |
| C6 | C5 | H052 | H051 | 120.3° | 120.1° |
| C5 | C6 | C7 | H071 | 94.8° | 179.2° |
| C5 | C6 | C7 | H072 | 146.8° | 60.8° |
| C5 | C6 | N8 | H081 | 68.5° | 25.0° |
| C1 | N2 | C7 | C6 | 162.4° | 174.2° |
| N2 | C1 | H012 | H011 | 120.0° | 120.0° |
| N2 | C1 | H012 | H013 | 120.0° | 120.1° |
| N2 | C1 | H011 | H013 | 120.0° | 120.1° |
| C1 | N2 | C3 | H032 | 61.3° | 65.8° |
| C1 | N2 | C3 | H031 | 59.2° | 54.1° |
| C1 | N2 | C7 | H071 | 41.6° | 54.2° |
| C1 | N2 | C7 | H072 | 76.8° | 65.8° |
| N2 | C7 | C6 | H071 | 120.8° | 120.0° |
| N2 | C7 | C6 | H072 | 120.8° | 120.0° |
| N2 | C7 | C6 | N8 | 149.1° | 179.1° |
| C7 | N2 | C1 | H012 | 51.9° | 175.8° |
| C7 | N2 | C1 | H011 | 68.1° | 55.8° |
| C7 | N2 | C1 | H013 | 171.9° | 64.2° |
| C7 | N2 | C3 | H032 | 64.2° | 58.3° |
| C7 | N2 | C3 | H031 | 175.3° | 178.2° |
| N2 | C7 | C6 | H061 | 96.7° | 60.8° |
| N2 | C7 | H071 | H072 | 117.5° | 119.9° |
| C7 | C6 | N8 | H061 | 113.8° | 120.1° |
| C7 | C6 | N8 | C9 | 119.0° | 85.2° |
| C7 | C6 | C5 | H052 | 159.7° | 177.5° |
| C7 | C6 | C5 | H051 | 80.1° | 62.3° |
| C6 | C7 | H071 | H072 | 117.4° | 120.0° |
| C7 | C6 | N8 | H081 | 61.0° | 94.9° |
| C6 | N8 | C9 | H081 | 180.0° | 179.9° |
| C6 | N8 | C9 | N10 | 0.0° | 0.0° |
| C6 | N8 | C9 | N18 | 178.9° | 179.8° |
| N8 | C6 | C5 | H052 | 78.9° | 62.5° |
| N8 | C6 | C5 | H051 | 41.3° | 57.7° |
| N8 | C6 | C7 | H071 | 28.3° | 60.9° |
| N8 | C6 | C7 | H072 | 90.1° | 59.2° |
| N8 | C9 | N10 | N18 | 178.9° | 179.8° |
| N8 | C9 | N10 | C11 | 179.8° | 180.0° |
| N8 | C9 | N18 | C19 | 0.9° | 0.2° |
| N8 | C9 | N18 | C16 | 179.9° | 179.9° |
| C9 | N8 | C6 | H061 | 5.2° | 34.9° |
| N10 | C9 | N18 | C19 | 179.7° | 180.0° |
| N10 | C9 | N18 | C16 | 1.1° | 0.1° |
| C9 | N10 | C11 | C12 | 179.9° | 180.0° |
| C9 | N10 | C11 | C15 | 0.5° | 0.0° |
| N10 | C9 | N8 | H081 | 180.0° | 179.9° |
| N18 | C9 | N10 | C11 | 0.9° | 0.2° |
| C9 | N18 | C19 | C16 | 179.2° | 179.9° |
| C9 | N18 | C16 | C15 | 0.9° | 0.1° |
| C9 | N18 | C16 | O17 | 177.8° | 179.9° |
| C9 | N18 | C19 | H192 | 180.0° | 90.0° |
| C9 | N18 | C19 | H193 | 60.0° | 150.0° |
| C9 | N18 | C19 | H191 | 60.0° | 30.0° |
| N18 | C9 | N8 | H081 | 1.1° | 0.1° |
| N10 | C11 | C12 | C15 | 179.5° | 180.0° |
| N10 | C11 | C15 | C16 | 0.4° | 0.2° |
| N10 | C11 | C12 | N13 | 163.1° | 180.0° |
| N10 | C11 | C15 | C14 | 179.7° | 180.0° |
| N10 | C11 | C12 | H122 | 78.1° | 60.5° |
| N10 | C11 | C12 | H121 | 44.5° | 60.5° |
| C19 | N18 | C16 | C15 | 179.9° | 179.8° |
| C19 | N18 | C16 | O17 | 1.4° | 0.2° |
| N18 | C19 | H192 | H193 | 120.0° | 120.0° |
| N18 | C19 | H192 | H191 | 120.0° | 120.0° |
| N18 | C19 | H193 | H191 | 120.0° | 120.0° |
| N18 | C16 | C15 | C11 | 0.6° | 0.3° |
| N18 | C16 | C15 | O17 | 178.8° | 180.0° |
| N18 | C16 | C15 | C14 | 179.5° | 180.0° |
| C16 | N18 | C19 | H192 | 0.8° | 89.9° |
| C16 | N18 | C19 | H193 | 119.2° | 30.1° |
| C16 | N18 | C19 | H191 | 120.8° | 150.1° |
| C12 | C11 | C15 | C16 | 179.9° | 179.8° |
| C11 | C12 | N13 | H122 | 118.7° | 119.5° |
| C11 | C12 | N13 | H121 | 118.7° | 119.5° |
| C12 | C11 | C15 | C14 | 0.1° | 0.0° |
| C11 | C12 | N13 | C14 | 28.5° | 0.0° |
| C11 | C12 | N13 | C20 | 160.0° | 180.0° |
| C11 | C12 | H122 | H121 | 123.7° | 120.9° |
| C11 | C15 | C16 | C14 | 179.9° | 179.7° |
| C11 | C15 | C16 | O17 | 178.2° | 179.7° |
| C15 | C11 | C12 | N13 | 17.4° | 0.0° |
| C11 | C15 | C14 | N13 | 17.5° | 0.0° |
| C15 | C11 | C12 | H122 | 101.3° | 119.5° |
| C15 | C11 | C12 | H121 | 136.1° | 119.5° |
| C11 | C15 | C14 | H141 | 136.9° | 119.5° |
| C11 | C15 | C14 | H142 | 101.8° | 119.6° |
| C16 | C15 | C14 | N13 | 162.4° | 179.7° |
| C16 | C15 | C14 | H141 | 43.1° | 60.2° |
| C16 | C15 | C14 | H142 | 78.3° | 60.7° |
| O17 | C16 | C15 | C14 | 1.7° | 0.0° |
| C12 | N13 | C14 | C15 | 29.6° | 0.0° |
| C12 | N13 | C14 | C20 | 173.0° | 180.0° |
| C12 | N13 | C20 | O22 | 92.7° | 0.0° |
| C12 | N13 | C20 | O21 | 94.4° | 179.9° |
| N13 | C12 | H122 | H121 | 123.7° | 120.9° |
| C12 | N13 | C14 | H141 | 149.0° | 119.5° |
| C12 | N13 | C14 | H142 | 89.7° | 119.5° |
| C15 | C14 | N13 | H141 | 119.3° | 119.5° |
| C15 | C14 | N13 | H142 | 119.3° | 119.5° |
| C15 | C14 | N13 | C20 | 157.4° | 180.0° |
| C15 | C14 | H141 | H142 | 121.9° | 120.9° |
| C14 | N13 | C20 | O22 | 96.4° | 180.0° |
| C14 | N13 | C20 | O21 | 76.4° | 0.0° |
| C14 | N13 | C12 | H122 | 90.2° | 119.5° |
| C14 | N13 | C12 | H121 | 147.2° | 119.5° |
| N13 | C14 | H141 | H142 | 122.0° | 121.0° |
| N13 | C20 | O22 | O21 | 173.0° | 179.9° |
| N13 | C20 | O22 | C23 | 164.9° | 180.0° |
| C20 | N13 | C12 | H122 | 81.3° | 60.5° |
| C20 | N13 | C12 | H121 | 41.3° | 60.5° |
| C20 | N13 | C14 | H141 | 38.0° | 60.5° |
| C20 | N13 | C14 | H142 | 83.3° | 60.5° |
| C20 | O22 | C23 | C25 | 178.8° | 59.9° |
| C20 | O22 | C23 | C26 | 63.6° | 60.1° |
| C20 | O22 | C23 | C24 | 63.0° | 180.0° |
| O22 | C23 | C25 | C26 | 117.5° | 120.0° |
| O22 | C23 | C25 | C24 | 122.1° | 120.1° |
| C23 | O22 | C20 | O21 | 8.1° | 0.1° |
| O22 | C23 | C26 | C24 | 129.1° | 120.0° |
| O22 | C23 | C24 | H243 | 180.0° | 59.9° |
| O22 | C23 | C24 | H241 | 60.0° | 60.0° |
| O22 | C23 | C24 | H242 | 60.0° | 179.9° |
| O22 | C23 | C26 | H262 | 180.0° | 180.0° |
| O22 | C23 | C26 | H263 | 60.0° | 60.0° |
| O22 | C23 | C26 | H261 | 60.0° | 60.0° |
| O22 | C23 | C25 | H253 | 180.0° | 180.0° |
| O22 | C23 | C25 | H252 | 60.0° | 60.0° |
| O22 | C23 | C25 | H251 | 60.0° | 60.0° |
| C25 | C23 | C26 | C24 | 117.5° | 120.0° |
| C25 | C23 | C24 | H243 | 65.8° | 180.0° |
| C25 | C23 | C24 | H241 | 54.2° | 60.1° |
| C25 | C23 | C24 | H242 | 174.2° | 60.0° |
| C25 | C23 | C26 | H262 | 66.5° | 60.0° |
| C25 | C23 | C26 | H263 | 173.5° | 60.0° |
| C25 | C23 | C26 | H261 | 53.4° | 180.0° |
| C23 | C25 | H253 | H252 | 120.0° | 119.9° |
| C23 | C25 | H253 | H251 | 120.0° | 120.0° |
| C23 | C25 | H252 | H251 | 120.0° | 120.0° |
| C26 | C23 | C24 | H243 | 53.9° | 60.0° |
| C26 | C23 | C24 | H241 | 173.9° | 180.0° |
| C26 | C23 | C24 | H242 | 66.1° | 60.0° |
| C23 | C26 | H262 | H263 | 120.0° | 120.0° |
| C23 | C26 | H262 | H261 | 120.0° | 120.0° |
| C23 | C26 | H263 | H261 | 120.0° | 120.0° |
| C26 | C23 | C25 | H253 | 62.5° | 60.0° |
| C26 | C23 | C25 | H252 | 57.5° | 180.0° |
| C26 | C23 | C25 | H251 | 177.6° | 60.0° |
| C23 | C24 | H243 | H241 | 120.0° | 120.0° |
| C23 | C24 | H243 | H242 | 120.0° | 120.0° |
| C23 | C24 | H241 | H242 | 120.0° | 120.1° |
| C24 | C23 | C26 | H262 | 50.9° | 60.0° |
| C24 | C23 | C26 | H263 | 69.0° | 180.0° |
| C24 | C23 | C26 | H261 | 170.9° | 60.0° |
| C24 | C23 | C25 | H253 | 57.9° | 59.9° |
| C24 | C23 | C25 | H252 | 177.9° | 60.0° |
| C24 | C23 | C25 | H251 | 62.0° | 180.0° |
| H243 | C24 | H241 | H242 | 120.0° | 119.9° |
| H262 | C26 | H263 | H261 | 120.0° | 120.0° |
| H281 | C28 | C29 | H291 | 0.1° | 0.3° |
| H012 | C1 | H011 | H013 | 120.0° | 119.9° |
| H032 | C3 | C4 | H041 | 171.0° | 179.2° |
| H031 | C3 | C4 | H041 | 68.6° | 59.2° |
| H041 | C4 | C5 | H052 | 59.2° | 57.6° |
| H041 | C4 | C5 | H051 | 179.5° | 177.8° |
| H052 | C5 | C6 | H061 | 37.6° | 57.5° |
| H051 | C5 | C6 | H061 | 157.8° | 177.7° |
| H061 | C6 | C7 | H071 | 142.5° | 59.2° |
| H061 | C6 | C7 | H072 | 24.1° | 179.2° |
| H061 | C6 | N8 | H081 | 174.8° | 145.0° |
| H192 | C19 | H193 | H191 | 120.0° | 120.0° |
| H253 | C25 | H252 | H251 | 119.9° | 120.0° |
| H291 | C29 | C30 | H301 | 0.3° | 0.0° |
| H301 | C30 | C31 | H311 | 0.1° | 0.0° |
| H311 | C31 | C32 | H321 | 0.5° | 0.3° |
