A1IAF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O24 | C23 | sing | 1.36Å | 1.42Å | |
| C23 | C25 | doub | 1.39Å | 1.38Å | Aromatic |
| C23 | C22 | sing | 1.39Å | 1.37Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C20 | doub | 1.40Å | 1.37Å | Aromatic |
| C21 | C20 | sing | 1.40Å | 1.37Å | Aromatic |
| C20 | C19 | sing | 1.47Å | 1.42Å | |
| C06 | C05 | doub | 1.39Å | 1.37Å | Aromatic |
| C06 | C07 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | O15 | sing | 1.43Å | 1.38Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C05 | C04 | sing | 1.38Å | 1.40Å | Aromatic |
| C07 | C08 | doub | 1.39Å | 1.38Å | Aromatic |
| C19 | S27 | sing | 1.75Å | 1.75Å | Aromatic |
| C19 | C18 | doub | 1.37Å | 1.40Å | Aromatic |
| C04 | C03 | doub | 1.40Å | 1.39Å | Aromatic |
| O15 | C14 | sing | 1.43Å | 1.40Å | |
| C08 | C03 | sing | 1.40Å | 1.40Å | Aromatic |
| C08 | N09 | sing | 1.39Å | 1.46Å | |
| C03 | C02 | sing | 1.48Å | 1.52Å | |
| C17 | N12 | sing | 1.47Å | 1.40Å | |
| N09 | C10 | sing | 1.47Å | 1.45Å | |
| S27 | C28 | sing | 1.76Å | 1.74Å | Aromatic |
| C10 | C11 | sing | 1.53Å | 1.54Å | |
| C02 | C18 | sing | 1.46Å | 1.54Å | |
| C02 | O01 | doub | 1.22Å | 1.21Å | |
| C18 | C34 | sing | 1.46Å | 1.42Å | Aromatic |
| C11 | N12 | sing | 1.47Å | 1.34Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| N12 | C13 | sing | 1.47Å | 1.38Å | |
| C34 | C28 | doub | 1.39Å | 1.37Å | Aromatic |
| C34 | C33 | sing | 1.41Å | 1.42Å | Aromatic |
| C28 | C29 | sing | 1.40Å | 1.40Å | Aromatic |
| C33 | C32 | doub | 1.37Å | 1.38Å | Aromatic |
| C29 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| C32 | C30 | sing | 1.39Å | 1.38Å | Aromatic |
| C30 | O31 | sing | 1.36Å | 1.38Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| O31 | H311 | sing | 0.97Å | 0.95Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| N09 | H091 | sing | 0.97Å | 1.00Å | |
| O24 | H241 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O24 | C23 | C25 | 120.2° | 119.8° |
| O24 | C23 | C22 | 118.8° | 120.0° |
| C23 | O24 | H241 | 109.5° | 114.0° |
| C25 | C23 | C22 | 121.0° | 120.2° |
| C23 | C25 | C26 | 119.3° | 120.0° |
| C23 | C25 | H251 | 120.3° | 120.0° |
| C23 | C22 | C21 | 119.1° | 120.2° |
| C23 | C22 | H221 | 120.4° | 119.9° |
| C25 | C26 | C20 | 119.6° | 119.9° |
| C26 | C25 | H251 | 120.3° | 119.9° |
| C25 | C26 | H261 | 120.2° | 120.0° |
| C22 | C21 | C20 | 120.2° | 119.9° |
| C22 | C21 | H211 | 119.9° | 120.1° |
| C21 | C22 | H221 | 120.5° | 119.9° |
| C26 | C20 | C21 | 120.8° | 119.8° |
| C26 | C20 | C19 | 122.6° | 120.0° |
| C20 | C26 | H261 | 120.2° | 120.1° |
| C21 | C20 | C19 | 116.6° | 120.1° |
| C20 | C21 | H211 | 119.9° | 120.1° |
| C20 | C19 | S27 | 122.1° | 124.5° |
| C20 | C19 | C18 | 131.8° | 124.6° |
| C05 | C06 | C07 | 119.3° | 120.4° |
| C06 | C05 | C04 | 120.8° | 120.3° |
| C06 | C05 | H051 | 119.6° | 119.8° |
| C05 | C06 | H061 | 120.3° | 119.8° |
| C06 | C07 | C08 | 120.8° | 120.0° |
| C07 | C06 | H061 | 120.4° | 119.7° |
| C06 | C07 | H071 | 119.6° | 120.0° |
| O15 | C16 | C17 | 114.2° | 109.3° |
| C16 | O15 | C14 | 112.6° | 113.8° |
| O15 | C16 | H161 | 108.2° | 109.5° |
| O15 | C16 | H162 | 108.2° | 109.5° |
| C16 | C17 | N12 | 114.1° | 109.3° |
| C17 | C16 | H161 | 108.3° | 109.5° |
| C17 | C16 | H162 | 108.3° | 109.5° |
| C16 | C17 | H172 | 108.3° | 109.5° |
| C16 | C17 | H171 | 108.3° | 109.6° |
| C05 | C04 | C03 | 119.7° | 119.9° |
| C05 | C04 | H041 | 120.1° | 120.0° |
| C04 | C05 | H051 | 119.6° | 119.9° |
| C07 | C08 | C03 | 120.5° | 119.6° |
| C07 | C08 | N09 | 118.1° | 120.2° |
| C08 | C07 | H071 | 119.6° | 119.9° |
| S27 | C19 | C18 | 106.1° | 110.9° |
| C19 | S27 | C28 | 96.6° | 92.7° |
| C19 | C18 | C02 | 126.0° | 123.1° |
| C19 | C18 | C34 | 114.6° | 113.7° |
| C04 | C03 | C08 | 118.9° | 119.6° |
| C04 | C03 | C02 | 119.6° | 120.2° |
| C03 | C04 | H041 | 120.1° | 120.0° |
| O15 | C14 | C13 | 111.4° | 109.2° |
| O15 | C14 | H142 | 109.0° | 109.5° |
| O15 | C14 | H141 | 109.0° | 109.5° |
| C03 | C08 | N09 | 121.5° | 120.2° |
| C08 | C03 | C02 | 121.5° | 120.2° |
| C08 | N09 | C10 | 120.0° | 120.0° |
| C08 | N09 | H091 | 106.8° | 120.1° |
| C03 | C02 | C18 | 119.2° | 120.0° |
| C03 | C02 | O01 | 121.2° | 120.0° |
| C17 | N12 | C11 | 113.1° | 111.1° |
| C17 | N12 | C13 | 109.3° | 110.8° |
| N12 | C17 | H172 | 108.3° | 109.5° |
| N12 | C17 | H171 | 108.3° | 109.5° |
| N09 | C10 | C11 | 112.5° | 109.5° |
| N09 | C10 | H102 | 108.7° | 109.5° |
| N09 | C10 | H101 | 108.7° | 109.5° |
| C10 | N09 | H091 | 106.8° | 120.0° |
| S27 | C28 | C34 | 106.7° | 110.5° |
| S27 | C28 | C29 | 131.7° | 129.8° |
| C10 | C11 | N12 | 111.7° | 109.5° |
| C11 | C10 | H102 | 108.7° | 109.5° |
| C11 | C10 | H101 | 108.7° | 109.5° |
| C10 | C11 | H111 | 108.9° | 109.5° |
| C10 | C11 | H112 | 108.9° | 109.5° |
| C18 | C02 | O01 | 119.6° | 120.0° |
| C02 | C18 | C34 | 119.4° | 123.1° |
| C18 | C34 | C28 | 116.0° | 112.2° |
| C18 | C34 | C33 | 124.0° | 128.7° |
| C11 | N12 | C13 | 109.1° | 111.0° |
| N12 | C11 | H111 | 108.9° | 109.4° |
| N12 | C11 | H112 | 108.9° | 109.5° |
| C14 | C13 | N12 | 114.1° | 109.3° |
| C14 | C13 | H131 | 108.3° | 109.5° |
| C14 | C13 | H132 | 108.3° | 109.5° |
| C13 | C14 | H142 | 109.0° | 109.6° |
| C13 | C14 | H141 | 109.0° | 109.5° |
| N12 | C13 | H131 | 108.3° | 109.5° |
| N12 | C13 | H132 | 108.3° | 109.5° |
| C28 | C34 | C33 | 120.0° | 119.1° |
| C34 | C28 | C29 | 121.6° | 119.7° |
| C34 | C33 | C32 | 118.5° | 120.5° |
| C34 | C33 | H331 | 120.8° | 119.8° |
| C28 | C29 | C30 | 117.7° | 120.4° |
| C28 | C29 | H291 | 121.1° | 119.8° |
| C33 | C32 | C30 | 120.3° | 120.3° |
| C33 | C32 | H321 | 119.8° | 119.9° |
| C32 | C33 | H331 | 120.8° | 119.7° |
| C29 | C30 | C32 | 121.8° | 120.0° |
| C29 | C30 | O31 | 119.1° | 120.0° |
| C30 | C29 | H291 | 121.2° | 119.8° |
| C32 | C30 | O31 | 119.0° | 120.0° |
| C30 | C32 | H321 | 119.8° | 119.9° |
| C30 | O31 | H311 | 109.5° | 114.0° |
| H102 | C10 | H101 | 109.5° | 109.5° |
| H111 | C11 | H112 | 109.5° | 109.5° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| H142 | C14 | H141 | 109.4° | 109.6° |
| H161 | C16 | H162 | 109.5° | 109.5° |
| H172 | C17 | H171 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O24 | C23 | C25 | C22 | 179.0° | 179.8° |
| O24 | C23 | C25 | C26 | 177.5° | 180.0° |
| O24 | C23 | C22 | C21 | 179.3° | 179.7° |
| O24 | C23 | C22 | H221 | 0.7° | 0.2° |
| O24 | C23 | C25 | H251 | 2.5° | 0.2° |
| C23 | C25 | C26 | H251 | 180.0° | 179.8° |
| C25 | C23 | C22 | C21 | 0.3° | 0.0° |
| C23 | C25 | C26 | C20 | 1.9° | 0.5° |
| C25 | C23 | C22 | H221 | 179.7° | 180.0° |
| C23 | C25 | C26 | H261 | 178.1° | 180.0° |
| C25 | C23 | O24 | H241 | 180.0° | 90.1° |
| C22 | C23 | C25 | C26 | 1.5° | 0.2° |
| C23 | C22 | C21 | H221 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 1.7° | 0.0° |
| C23 | C22 | C21 | H211 | 178.3° | 180.0° |
| C22 | C23 | C25 | H251 | 178.5° | 180.0° |
| C22 | C23 | O24 | H241 | 1.0° | 89.7° |
| C25 | C26 | C20 | H261 | 180.0° | 179.5° |
| C25 | C26 | C20 | C21 | 0.5° | 0.5° |
| C25 | C26 | C20 | C19 | 178.1° | 179.8° |
| C22 | C21 | C20 | C26 | 1.3° | 0.3° |
| C22 | C21 | C20 | H211 | 180.0° | 180.0° |
| C22 | C21 | C20 | C19 | 180.0° | 180.0° |
| C26 | C20 | C21 | C19 | 178.7° | 179.7° |
| C26 | C20 | C19 | S27 | 144.0° | 131.3° |
| C26 | C20 | C19 | C18 | 35.5° | 48.7° |
| C26 | C20 | C21 | H211 | 178.7° | 179.7° |
| C20 | C26 | C25 | H251 | 178.1° | 179.7° |
| C21 | C20 | C19 | S27 | 37.3° | 48.4° |
| C21 | C20 | C19 | C18 | 143.2° | 131.6° |
| C20 | C21 | C22 | H221 | 178.2° | 179.9° |
| C21 | C20 | C26 | H261 | 179.5° | 180.0° |
| C20 | C19 | S27 | C18 | 179.6° | 180.0° |
| C20 | C19 | S27 | C28 | 179.3° | 179.9° |
| C20 | C19 | C18 | C02 | 1.5° | 0.3° |
| C20 | C19 | C18 | C34 | 179.3° | 179.9° |
| C19 | C20 | C21 | H211 | 0.1° | 0.0° |
| C19 | C20 | C26 | H261 | 1.9° | 0.2° |
| C05 | C06 | C07 | H061 | 180.0° | 179.9° |
| C06 | C05 | C04 | H051 | 180.0° | 179.9° |
| C05 | C06 | C07 | C08 | 0.9° | 0.2° |
| C06 | C05 | C04 | C03 | 1.3° | 0.0° |
| C06 | C05 | C04 | H041 | 178.7° | 179.9° |
| C05 | C06 | C07 | H071 | 179.1° | 180.0° |
| C07 | C06 | C05 | C04 | 0.8° | 0.1° |
| C06 | C07 | C08 | H071 | 180.0° | 179.8° |
| C06 | C07 | C08 | C03 | 1.5° | 0.5° |
| C06 | C07 | C08 | N09 | 178.9° | 180.0° |
| C07 | C06 | C05 | H051 | 179.3° | 180.0° |
| O15 | C16 | C17 | H161 | 120.7° | 119.9° |
| O15 | C16 | C17 | H162 | 120.7° | 120.0° |
| O15 | C16 | C17 | N12 | 48.0° | 56.8° |
| C16 | O15 | C14 | C13 | 50.3° | 58.7° |
| C16 | O15 | C14 | H142 | 170.6° | 178.6° |
| C16 | O15 | C14 | H141 | 70.0° | 61.3° |
| O15 | C16 | H161 | H162 | 117.8° | 120.1° |
| O15 | C16 | C17 | H172 | 168.7° | 63.1° |
| O15 | C16 | C17 | H171 | 72.7° | 176.8° |
| C17 | C16 | O15 | C14 | 47.4° | 58.7° |
| C16 | C17 | N12 | H172 | 120.7° | 119.9° |
| C16 | C17 | N12 | H171 | 120.7° | 120.0° |
| C16 | C17 | N12 | C11 | 71.4° | 177.7° |
| C16 | C17 | N12 | C13 | 50.3° | 58.5° |
| C17 | C16 | H161 | H162 | 117.9° | 120.1° |
| C16 | C17 | H172 | H171 | 117.9° | 120.1° |
| C05 | C04 | C03 | H041 | 180.0° | 180.0° |
| C05 | C04 | C03 | C08 | 1.9° | 0.2° |
| C05 | C04 | C03 | C02 | 179.3° | 180.0° |
| C04 | C05 | C06 | H061 | 179.2° | 180.0° |
| C07 | C08 | C03 | C04 | 2.0° | 0.5° |
| C07 | C08 | C03 | N09 | 179.5° | 179.5° |
| C07 | C08 | C03 | C02 | 179.2° | 179.8° |
| C07 | C08 | N09 | C10 | 23.1° | 6.2° |
| C08 | C07 | C06 | H061 | 179.1° | 179.8° |
| C07 | C08 | N09 | H091 | 98.4° | 173.8° |
| S27 | C19 | C18 | C02 | 178.9° | 179.7° |
| S27 | C19 | C18 | C34 | 1.1° | 0.1° |
| C19 | S27 | C28 | C34 | 0.7° | 0.3° |
| C19 | S27 | C28 | C29 | 179.9° | 179.9° |
| C19 | C18 | C02 | C03 | 54.5° | 91.9° |
| C18 | C19 | S27 | C28 | 1.0° | 0.1° |
| C19 | C18 | C02 | C34 | 177.7° | 179.6° |
| C19 | C18 | C02 | O01 | 124.8° | 88.1° |
| C19 | C18 | C34 | C28 | 0.7° | 0.3° |
| C19 | C18 | C34 | C33 | 179.5° | 179.8° |
| C04 | C03 | C08 | C02 | 178.8° | 179.7° |
| C04 | C03 | C08 | N09 | 178.5° | 180.0° |
| C04 | C03 | C02 | C18 | 2.1° | 5.5° |
| C04 | C03 | C02 | O01 | 178.6° | 174.5° |
| C03 | C04 | C05 | H051 | 178.8° | 180.0° |
| O15 | C14 | C13 | H142 | 120.3° | 119.9° |
| O15 | C14 | C13 | H141 | 120.3° | 119.9° |
| O15 | C14 | C13 | N12 | 56.1° | 56.8° |
| O15 | C14 | C13 | H131 | 64.6° | 176.8° |
| O15 | C14 | C13 | H132 | 176.8° | 63.1° |
| O15 | C14 | H142 | H141 | 119.1° | 120.1° |
| C14 | O15 | C16 | H161 | 73.3° | 61.2° |
| C14 | O15 | C16 | H162 | 168.1° | 178.7° |
| C03 | C08 | N09 | C10 | 157.4° | 173.3° |
| C08 | C03 | C02 | C18 | 179.1° | 174.7° |
| C08 | C03 | C02 | O01 | 0.2° | 5.2° |
| C08 | C03 | C04 | H041 | 178.1° | 179.8° |
| C03 | C08 | C07 | H071 | 178.5° | 179.7° |
| C03 | C08 | N09 | H091 | 81.1° | 6.7° |
| N09 | C08 | C03 | C02 | 0.3° | 0.3° |
| C08 | N09 | C10 | H091 | 121.5° | 180.0° |
| C08 | N09 | C10 | C11 | 178.3° | 180.0° |
| C08 | N09 | C10 | H102 | 57.9° | 60.0° |
| C08 | N09 | C10 | H101 | 61.2° | 60.0° |
| N09 | C08 | C07 | H071 | 1.1° | 0.2° |
| C03 | C02 | C18 | O01 | 179.3° | 180.0° |
| C03 | C02 | C18 | C34 | 123.3° | 87.7° |
| C02 | C03 | C04 | H041 | 0.7° | 0.1° |
| C17 | N12 | C11 | C10 | 71.9° | 170.0° |
| C17 | N12 | C11 | C13 | 121.8° | 123.7° |
| C17 | N12 | C13 | C14 | 54.8° | 58.5° |
| C17 | N12 | C11 | H111 | 48.4° | 50.0° |
| C17 | N12 | C11 | H112 | 167.8° | 70.0° |
| C17 | N12 | C13 | H131 | 65.9° | 178.5° |
| C17 | N12 | C13 | H132 | 175.5° | 61.4° |
| N12 | C17 | C16 | H161 | 72.7° | 63.1° |
| N12 | C17 | C16 | H162 | 168.7° | 176.8° |
| N12 | C17 | H172 | H171 | 117.9° | 120.1° |
| N09 | C10 | C11 | H102 | 120.4° | 120.0° |
| N09 | C10 | C11 | H101 | 120.4° | 120.0° |
| N09 | C10 | C11 | N12 | 177.6° | 180.0° |
| N09 | C10 | H102 | H101 | 118.6° | 120.0° |
| N09 | C10 | C11 | H111 | 62.1° | 60.0° |
| N09 | C10 | C11 | H112 | 57.3° | 60.0° |
| S27 | C28 | C34 | C18 | 0.1° | 0.4° |
| S27 | C28 | C34 | C29 | 179.3° | 179.7° |
| S27 | C28 | C34 | C33 | 179.7° | 179.7° |
| S27 | C28 | C29 | C30 | 179.3° | 179.6° |
| S27 | C28 | C29 | H291 | 0.7° | 0.5° |
| C10 | C11 | N12 | H111 | 120.3° | 120.0° |
| C10 | C11 | N12 | H112 | 120.3° | 120.0° |
| C10 | C11 | N12 | C13 | 166.3° | 66.3° |
| C11 | C10 | H102 | H101 | 118.6° | 120.0° |
| C10 | C11 | H111 | H112 | 119.0° | 120.0° |
| C11 | C10 | N09 | H091 | 60.2° | 0.0° |
| C02 | C18 | C34 | C28 | 178.7° | 180.0° |
| C02 | C18 | C34 | C33 | 1.5° | 0.1° |
| O01 | C02 | C18 | C34 | 57.4° | 92.3° |
| C18 | C34 | C28 | C33 | 179.8° | 179.9° |
| C18 | C34 | C28 | C29 | 179.5° | 180.0° |
| C18 | C34 | C33 | C32 | 179.5° | 180.0° |
| C18 | C34 | C33 | H331 | 0.5° | 0.0° |
| C11 | N12 | C13 | C14 | 69.3° | 177.6° |
| N12 | C11 | C10 | H102 | 57.2° | 60.0° |
| N12 | C11 | C10 | H101 | 62.0° | 60.0° |
| N12 | C11 | H111 | H112 | 119.0° | 120.0° |
| C11 | N12 | C13 | H131 | 170.0° | 57.6° |
| C11 | N12 | C13 | H132 | 51.4° | 62.5° |
| C11 | N12 | C17 | H172 | 49.3° | 62.4° |
| C11 | N12 | C17 | H171 | 167.9° | 57.7° |
| C14 | C13 | N12 | H131 | 120.7° | 120.0° |
| C14 | C13 | N12 | H132 | 120.7° | 119.9° |
| C14 | C13 | H131 | H132 | 117.9° | 120.1° |
| C13 | C14 | H142 | H141 | 119.1° | 120.1° |
| C13 | N12 | C11 | H111 | 73.4° | 173.6° |
| C13 | N12 | C11 | H112 | 46.0° | 53.7° |
| N12 | C13 | H131 | H132 | 117.9° | 120.1° |
| N12 | C13 | C14 | H142 | 176.4° | 176.7° |
| N12 | C13 | C14 | H141 | 64.2° | 63.1° |
| C13 | N12 | C17 | H172 | 171.0° | 61.4° |
| C13 | N12 | C17 | H171 | 70.4° | 178.5° |
| C28 | C34 | C33 | C32 | 0.3° | 0.0° |
| C34 | C28 | C29 | C30 | 0.2° | 0.0° |
| C34 | C28 | C29 | H291 | 179.8° | 180.0° |
| C28 | C34 | C33 | H331 | 179.7° | 180.0° |
| C33 | C34 | C28 | C29 | 0.4° | 0.1° |
| C34 | C33 | C32 | H331 | 180.0° | 180.0° |
| C34 | C33 | C32 | C30 | 0.1° | 0.0° |
| C34 | C33 | C32 | H321 | 179.9° | 179.9° |
| C28 | C29 | C30 | H291 | 180.0° | 180.0° |
| C28 | C29 | C30 | C32 | 0.1° | 0.1° |
| C28 | C29 | C30 | O31 | 178.1° | 180.0° |
| C33 | C32 | C30 | C29 | 0.1° | 0.1° |
| C33 | C32 | C30 | H321 | 180.0° | 179.8° |
| C33 | C32 | C30 | O31 | 178.2° | 180.0° |
| C29 | C30 | C32 | O31 | 178.1° | 179.9° |
| C29 | C30 | O31 | H311 | 180.0° | 90.1° |
| C29 | C30 | C32 | H321 | 179.9° | 180.0° |
| C32 | C30 | C29 | H291 | 180.0° | 179.9° |
| C32 | C30 | O31 | H311 | 1.9° | 90.0° |
| C30 | C32 | C33 | H331 | 179.9° | 180.0° |
| O31 | C30 | C29 | H291 | 1.9° | 0.0° |
| O31 | C30 | C32 | H321 | 1.8° | 0.1° |
| H102 | C10 | C11 | H111 | 177.5° | 60.0° |
| H102 | C10 | C11 | H112 | 63.2° | 180.0° |
| H102 | C10 | N09 | H091 | 179.4° | 120.0° |
| H101 | C10 | C11 | H111 | 58.4° | 180.0° |
| H101 | C10 | C11 | H112 | 177.7° | 60.0° |
| H101 | C10 | N09 | H091 | 60.3° | 120.0° |
| H131 | C13 | C14 | H142 | 55.7° | 63.3° |
| H131 | C13 | C14 | H141 | 175.1° | 56.8° |
| H132 | C13 | C14 | H142 | 62.9° | 56.8° |
| H132 | C13 | C14 | H141 | 56.5° | 176.9° |
| H161 | C16 | C17 | H172 | 48.0° | 177.0° |
| H161 | C16 | C17 | H171 | 166.6° | 56.9° |
| H162 | C16 | C17 | H172 | 70.6° | 56.9° |
| H162 | C16 | C17 | H171 | 48.0° | 63.2° |
| H211 | C21 | C22 | H221 | 1.8° | 0.0° |
| H251 | C25 | C26 | H261 | 1.9° | 0.2° |
| H321 | C32 | C33 | H331 | 0.1° | 0.1° |
| H041 | C04 | C05 | H051 | 1.3° | 0.0° |
| H051 | C05 | C06 | H061 | 0.7° | 0.0° |
| H061 | C06 | C07 | H071 | 0.9° | 0.1° |
