S86
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F21 | C20 | sing | 1.40Å | 1.37Å | |
| F22 | C20 | sing | 1.40Å | 1.36Å | |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| C20 | C23 | sing | 1.53Å | 1.53Å | |
| C19 | C18 | sing | 1.53Å | 1.53Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C18 | C17 | sing | 1.53Å | 1.54Å | |
| C24 | C17 | sing | 1.53Å | 1.53Å | |
| C32 | C31 | doub | 1.38Å | 1.38Å | Aromatic |
| C32 | C26 | sing | 1.39Å | 1.36Å | Aromatic |
| C31 | C29 | sing | 1.38Å | 1.37Å | Aromatic |
| C17 | O25 | sing | 1.43Å | 1.43Å | |
| C17 | C15 | sing | 1.51Å | 1.53Å | |
| O25 | C26 | sing | 1.36Å | 1.43Å | |
| C26 | C27 | doub | 1.39Å | 1.39Å | Aromatic |
| C29 | CL30 | sing | 1.74Å | 1.77Å | |
| C29 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C15 | O16 | doub | 1.21Å | 1.19Å | |
| C15 | N14 | sing | 1.35Å | 1.44Å | |
| N14 | C13 | sing | 1.40Å | 1.44Å | |
| C13 | C12 | doub | 1.39Å | 1.37Å | Aromatic |
| C13 | C33 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C33 | C09 | doub | 1.39Å | 1.36Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C09 | C10 | sing | 1.39Å | 1.38Å | Aromatic |
| C09 | C06 | sing | 1.48Å | 1.51Å | |
| N03 | C02 | doub | 1.31Å | 1.25Å | |
| C05 | C06 | sing | 1.39Å | 1.51Å | Aromatic |
| C05 | C04 | doub | 1.35Å | 1.42Å | Aromatic |
| C06 | C07 | doub | 1.35Å | 1.42Å | Aromatic |
| C02 | C04 | sing | 1.47Å | 1.50Å | |
| C02 | N01 | sing | 1.38Å | 1.44Å | |
| C04 | S08 | sing | 1.76Å | 1.62Å | Aromatic |
| C07 | S08 | sing | 1.71Å | 1.62Å | Aromatic |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| N01 | H012 | sing | 0.97Å | 1.00Å | |
| N03 | H031 | sing | 0.97Å | 1.00Å | |
| N14 | H141 | sing | 0.97Å | 1.00Å | |
| N01 | H011 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F21 | C20 | F22 | 105.3° | 109.5° |
| F21 | C20 | C19 | 112.5° | 109.4° |
| F21 | C20 | C23 | 107.6° | 109.5° |
| F22 | C20 | C19 | 107.9° | 109.5° |
| F22 | C20 | C23 | 109.9° | 109.5° |
| C19 | C20 | C23 | 113.4° | 109.5° |
| C20 | C19 | C18 | 113.6° | 109.4° |
| C20 | C19 | H192 | 108.4° | 109.4° |
| C20 | C19 | H191 | 108.4° | 109.5° |
| C20 | C23 | C24 | 110.2° | 109.5° |
| C20 | C23 | H231 | 109.3° | 109.4° |
| C20 | C23 | H232 | 109.3° | 109.5° |
| C19 | C18 | C17 | 111.4° | 109.5° |
| C19 | C18 | H182 | 109.0° | 109.5° |
| C19 | C18 | H181 | 109.0° | 109.4° |
| C18 | C19 | H192 | 108.4° | 109.5° |
| C18 | C19 | H191 | 108.5° | 109.5° |
| C23 | C24 | C17 | 109.6° | 109.5° |
| C24 | C23 | H231 | 109.3° | 109.5° |
| C24 | C23 | H232 | 109.3° | 109.5° |
| C23 | C24 | H242 | 109.4° | 109.4° |
| C23 | C24 | H241 | 109.4° | 109.5° |
| C18 | C17 | C24 | 110.0° | 109.5° |
| C18 | C17 | O25 | 113.6° | 109.4° |
| C18 | C17 | C15 | 112.8° | 109.4° |
| C17 | C18 | H182 | 109.0° | 109.5° |
| C17 | C18 | H181 | 109.0° | 109.5° |
| C24 | C17 | O25 | 105.0° | 109.5° |
| C24 | C17 | C15 | 102.8° | 109.5° |
| C17 | C24 | H242 | 109.4° | 109.5° |
| C17 | C24 | H241 | 109.4° | 109.5° |
| C31 | C32 | C26 | 122.0° | 120.0° |
| C32 | C31 | C29 | 117.8° | 120.0° |
| C32 | C31 | H311 | 121.1° | 120.0° |
| C31 | C32 | H321 | 119.0° | 120.0° |
| C32 | C26 | O25 | 117.4° | 120.0° |
| C32 | C26 | C27 | 119.7° | 119.9° |
| C26 | C32 | H321 | 119.0° | 120.0° |
| C31 | C29 | CL30 | 120.0° | 119.9° |
| C31 | C29 | C28 | 121.6° | 120.1° |
| C29 | C31 | H311 | 121.1° | 120.0° |
| O25 | C17 | C15 | 111.8° | 109.5° |
| C17 | O25 | C26 | 116.5° | 117.0° |
| C17 | C15 | O16 | 122.5° | 120.1° |
| C17 | C15 | N14 | 114.3° | 120.0° |
| O25 | C26 | C27 | 122.8° | 120.0° |
| C26 | C27 | C28 | 119.4° | 119.9° |
| C26 | C27 | H271 | 120.3° | 120.1° |
| CL30 | C29 | C28 | 118.4° | 120.0° |
| C29 | C28 | C27 | 119.5° | 120.1° |
| C29 | C28 | H281 | 120.3° | 119.9° |
| C28 | C27 | H271 | 120.3° | 120.0° |
| C27 | C28 | H281 | 120.2° | 120.0° |
| O16 | C15 | N14 | 123.2° | 120.0° |
| C15 | N14 | C13 | 123.5° | 120.0° |
| C15 | N14 | H141 | 118.3° | 120.0° |
| N14 | C13 | C12 | 122.7° | 120.0° |
| N14 | C13 | C33 | 115.7° | 120.0° |
| C13 | N14 | H141 | 118.3° | 120.0° |
| C12 | C13 | C33 | 121.5° | 120.0° |
| C13 | C12 | C11 | 119.1° | 120.2° |
| C13 | C12 | H121 | 120.5° | 119.9° |
| C13 | C33 | C09 | 118.6° | 119.8° |
| C13 | C33 | H331 | 120.7° | 120.1° |
| C12 | C11 | C10 | 119.9° | 120.2° |
| C12 | C11 | H111 | 120.1° | 119.9° |
| C11 | C12 | H121 | 120.4° | 119.9° |
| C33 | C09 | C10 | 121.3° | 119.8° |
| C33 | C09 | C06 | 117.8° | 120.1° |
| C09 | C33 | H331 | 120.7° | 120.1° |
| C11 | C10 | C09 | 119.6° | 120.0° |
| C11 | C10 | H101 | 120.2° | 120.0° |
| C10 | C11 | H111 | 120.1° | 119.9° |
| C10 | C09 | C06 | 120.8° | 120.1° |
| C09 | C10 | H101 | 120.2° | 120.0° |
| C09 | C06 | C05 | 121.4° | 122.7° |
| C09 | C06 | C07 | 125.1° | 122.8° |
| N03 | C02 | C04 | 119.6° | 120.0° |
| N03 | C02 | N01 | 122.5° | 120.0° |
| C02 | N03 | H031 | 112.0° | 120.1° |
| C06 | C05 | C04 | 107.7° | 113.5° |
| C05 | C06 | C07 | 113.4° | 114.5° |
| C06 | C05 | H051 | 126.1° | 123.2° |
| C05 | C04 | C02 | 124.0° | 125.2° |
| C05 | C04 | S08 | 110.3° | 109.5° |
| C04 | C05 | H051 | 126.2° | 123.3° |
| C06 | C07 | S08 | 107.0° | 110.7° |
| C06 | C07 | H071 | 126.5° | 124.6° |
| C04 | C02 | N01 | 117.9° | 120.0° |
| C02 | C04 | S08 | 125.7° | 125.2° |
| C02 | N01 | H012 | 120.0° | 120.0° |
| C02 | N01 | H011 | 120.0° | 120.0° |
| C04 | S08 | C07 | 101.5° | 91.7° |
| S08 | C07 | H071 | 126.5° | 124.6° |
| H182 | C18 | H181 | 109.5° | 109.5° |
| H192 | C19 | H191 | 109.5° | 109.5° |
| H231 | C23 | H232 | 109.5° | 109.5° |
| H242 | C24 | H241 | 109.5° | 109.5° |
| H012 | N01 | H011 | 120.0° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F21 | C20 | F22 | C19 | 120.3° | 120.0° |
| F21 | C20 | F22 | C23 | 115.6° | 120.0° |
| F21 | C20 | C19 | C23 | 122.4° | 120.0° |
| F21 | C20 | C19 | C18 | 169.2° | 180.0° |
| F21 | C20 | C23 | C24 | 177.9° | 180.0° |
| F21 | C20 | C19 | H192 | 48.6° | 60.0° |
| F21 | C20 | C19 | H191 | 70.1° | 60.0° |
| F21 | C20 | C23 | H231 | 62.0° | 60.0° |
| F21 | C20 | C23 | H232 | 57.8° | 59.9° |
| F22 | C20 | C19 | C23 | 121.9° | 120.0° |
| F22 | C20 | C19 | C18 | 75.1° | 60.0° |
| F22 | C20 | C23 | C24 | 68.0° | 60.0° |
| F22 | C20 | C19 | H192 | 164.3° | 60.0° |
| F22 | C20 | C19 | H191 | 45.6° | 180.0° |
| F22 | C20 | C23 | H231 | 52.1° | 60.0° |
| F22 | C20 | C23 | H232 | 171.9° | 180.0° |
| C20 | C19 | C18 | H192 | 120.6° | 119.9° |
| C20 | C19 | C18 | H191 | 120.6° | 120.0° |
| C19 | C20 | C23 | C24 | 52.8° | 60.0° |
| C20 | C19 | C18 | C17 | 47.9° | 60.0° |
| C20 | C19 | C18 | H182 | 168.2° | 60.0° |
| C20 | C19 | C18 | H181 | 72.4° | 180.0° |
| C20 | C19 | H192 | H191 | 118.1° | 120.0° |
| C19 | C20 | C23 | H231 | 172.9° | 180.0° |
| C19 | C20 | C23 | H232 | 67.3° | 60.0° |
| C23 | C20 | C19 | C18 | 46.8° | 60.0° |
| C20 | C23 | C24 | H231 | 120.1° | 119.9° |
| C20 | C23 | C24 | H232 | 120.1° | 120.0° |
| C20 | C23 | C24 | C17 | 60.7° | 60.0° |
| C23 | C20 | C19 | H192 | 73.8° | 180.0° |
| C23 | C20 | C19 | H191 | 167.5° | 60.0° |
| C20 | C23 | H231 | H232 | 119.7° | 120.0° |
| C20 | C23 | C24 | H242 | 59.3° | 180.0° |
| C20 | C23 | C24 | H241 | 179.3° | 60.0° |
| C19 | C18 | C17 | H182 | 120.3° | 120.0° |
| C19 | C18 | C17 | H181 | 120.3° | 120.0° |
| C19 | C18 | C17 | C24 | 55.8° | 60.0° |
| C19 | C18 | C17 | O25 | 61.6° | 60.0° |
| C19 | C18 | C17 | C15 | 169.9° | 180.0° |
| C19 | C18 | H182 | H181 | 119.1° | 120.0° |
| C18 | C19 | H192 | H191 | 118.1° | 120.1° |
| C23 | C24 | C17 | C18 | 62.8° | 60.0° |
| C23 | C24 | C17 | H242 | 120.0° | 120.0° |
| C23 | C24 | C17 | H241 | 120.0° | 120.0° |
| C23 | C24 | C17 | O25 | 59.8° | 59.9° |
| C23 | C24 | C17 | C15 | 176.9° | 180.0° |
| C24 | C23 | H231 | H232 | 119.7° | 120.0° |
| C23 | C24 | H242 | H241 | 120.0° | 120.0° |
| C18 | C17 | C24 | O25 | 122.6° | 120.0° |
| C18 | C17 | C24 | C15 | 120.4° | 120.0° |
| C18 | C17 | O25 | C15 | 129.0° | 120.0° |
| C18 | C17 | O25 | C26 | 53.6° | 68.6° |
| C18 | C17 | C15 | O16 | 33.1° | 17.6° |
| C18 | C17 | C15 | N14 | 149.2° | 162.4° |
| C17 | C18 | H182 | H181 | 119.1° | 120.0° |
| C17 | C18 | C19 | H192 | 72.7° | 179.9° |
| C17 | C18 | C19 | H191 | 168.5° | 60.0° |
| C18 | C17 | C24 | H242 | 57.2° | 180.0° |
| C18 | C17 | C24 | H241 | 177.2° | 60.0° |
| C24 | C17 | O25 | C15 | 110.8° | 120.1° |
| C24 | C17 | O25 | C26 | 173.8° | 171.5° |
| C24 | C17 | C15 | O16 | 85.3° | 102.4° |
| C24 | C17 | C15 | N14 | 92.3° | 77.7° |
| C24 | C17 | C18 | H182 | 176.0° | 60.0° |
| C24 | C17 | C18 | H181 | 64.5° | 180.0° |
| C17 | C24 | C23 | H231 | 179.2° | 180.0° |
| C17 | C24 | C23 | H232 | 59.4° | 60.0° |
| C17 | C24 | H242 | H241 | 120.0° | 120.0° |
| C31 | C32 | C26 | H321 | 180.0° | 180.0° |
| C32 | C31 | C29 | H311 | 180.0° | 180.0° |
| C31 | C32 | C26 | O25 | 179.6° | 179.7° |
| C31 | C32 | C26 | C27 | 2.9° | 0.0° |
| C32 | C31 | C29 | CL30 | 179.5° | 180.0° |
| C32 | C31 | C29 | C28 | 0.3° | 0.0° |
| C26 | C32 | C31 | C29 | 1.7° | 0.0° |
| C32 | C26 | O25 | C17 | 153.3° | 1.1° |
| C32 | C26 | O25 | C27 | 176.6° | 179.7° |
| C32 | C26 | C27 | C28 | 2.7° | 0.1° |
| C32 | C26 | C27 | H271 | 177.3° | 180.0° |
| C26 | C32 | C31 | H311 | 178.3° | 180.0° |
| C31 | C29 | CL30 | C28 | 179.8° | 180.0° |
| C31 | C29 | C28 | C27 | 0.2° | 0.1° |
| C31 | C29 | C28 | H281 | 179.8° | 179.9° |
| C29 | C31 | C32 | H321 | 178.3° | 180.0° |
| C17 | O25 | C26 | C27 | 30.2° | 179.2° |
| O25 | C17 | C15 | O16 | 162.6° | 137.6° |
| O25 | C17 | C15 | N14 | 19.8° | 42.4° |
| O25 | C17 | C18 | H182 | 58.7° | 180.0° |
| O25 | C17 | C18 | H181 | 178.1° | 60.0° |
| O25 | C17 | C24 | H242 | 179.8° | 60.0° |
| O25 | C17 | C24 | H241 | 60.2° | 180.0° |
| C15 | C17 | O25 | C26 | 75.4° | 51.4° |
| C17 | C15 | O16 | N14 | 177.4° | 180.0° |
| C17 | C15 | N14 | C13 | 178.4° | 177.6° |
| C15 | C17 | C18 | H182 | 69.8° | 60.0° |
| C15 | C17 | C18 | H181 | 49.6° | 60.0° |
| C15 | C17 | C24 | H242 | 63.1° | 60.0° |
| C15 | C17 | C24 | H241 | 56.9° | 60.0° |
| C17 | C15 | N14 | H141 | 1.6° | 2.3° |
| O25 | C26 | C27 | C28 | 179.2° | 179.6° |
| O25 | C26 | C27 | H271 | 0.8° | 0.3° |
| O25 | C26 | C32 | H321 | 0.4° | 0.3° |
| C26 | C27 | C28 | C29 | 1.4° | 0.1° |
| C26 | C27 | C28 | H271 | 180.0° | 179.9° |
| C26 | C27 | C28 | H281 | 178.6° | 179.9° |
| C27 | C26 | C32 | H321 | 177.1° | 180.0° |
| CL30 | C29 | C28 | C27 | 179.6° | 179.9° |
| CL30 | C29 | C28 | H281 | 0.4° | 0.1° |
| CL30 | C29 | C31 | H311 | 0.5° | 0.0° |
| C29 | C28 | C27 | H281 | 180.0° | 179.9° |
| C29 | C28 | C27 | H271 | 178.6° | 180.0° |
| C28 | C29 | C31 | H311 | 179.7° | 180.0° |
| O16 | C15 | N14 | C13 | 0.8° | 2.4° |
| O16 | C15 | N14 | H141 | 179.2° | 177.6° |
| C15 | N14 | C13 | H141 | 180.0° | 180.0° |
| C15 | N14 | C13 | C12 | 37.6° | 30.4° |
| C15 | N14 | C13 | C33 | 142.8° | 149.6° |
| N14 | C13 | C12 | C33 | 179.6° | 180.0° |
| N14 | C13 | C12 | C11 | 179.4° | 180.0° |
| N14 | C13 | C33 | C09 | 179.4° | 179.8° |
| N14 | C13 | C12 | H121 | 0.6° | 0.0° |
| N14 | C13 | C33 | H331 | 0.6° | 0.0° |
| C13 | C12 | C11 | H121 | 180.0° | 179.9° |
| C12 | C13 | C33 | C09 | 1.0° | 0.3° |
| C13 | C12 | C11 | C10 | 0.5° | 0.1° |
| C13 | C12 | C11 | H111 | 179.5° | 179.9° |
| C12 | C13 | C33 | H331 | 179.0° | 180.0° |
| C12 | C13 | N14 | H141 | 142.4° | 149.6° |
| C33 | C13 | C12 | C11 | 0.2° | 0.0° |
| C13 | C33 | C09 | H331 | 180.0° | 179.7° |
| C13 | C33 | C09 | C10 | 2.0° | 0.5° |
| C13 | C33 | C09 | C06 | 179.1° | 179.7° |
| C33 | C13 | C12 | H121 | 179.8° | 180.0° |
| C33 | C13 | N14 | H141 | 37.2° | 30.4° |
| C12 | C11 | C10 | H111 | 180.0° | 179.9° |
| C12 | C11 | C10 | C09 | 0.4° | 0.3° |
| C12 | C11 | C10 | H101 | 179.6° | 179.9° |
| C33 | C09 | C10 | C11 | 1.8° | 0.5° |
| C33 | C09 | C10 | C06 | 176.9° | 179.8° |
| C33 | C09 | C06 | C05 | 18.9° | 179.8° |
| C33 | C09 | C06 | C07 | 164.0° | 0.3° |
| C33 | C09 | C10 | H101 | 178.3° | 179.7° |
| C11 | C10 | C09 | H101 | 180.0° | 179.7° |
| C11 | C10 | C09 | C06 | 178.7° | 179.7° |
| C10 | C11 | C12 | H121 | 179.5° | 180.0° |
| C10 | C09 | C06 | C05 | 158.2° | 0.0° |
| C10 | C09 | C06 | C07 | 19.0° | 180.0° |
| C09 | C10 | C11 | H111 | 179.6° | 179.8° |
| C10 | C09 | C33 | H331 | 178.0° | 179.8° |
| C09 | C06 | C05 | C07 | 177.4° | 179.9° |
| C09 | C06 | C05 | C04 | 178.8° | 180.0° |
| C09 | C06 | C07 | S08 | 178.5° | 179.8° |
| C06 | C09 | C10 | H101 | 1.3° | 0.0° |
| C09 | C06 | C05 | H051 | 1.2° | 0.1° |
| C09 | C06 | C07 | H071 | 1.5° | 0.0° |
| C06 | C09 | C33 | H331 | 1.0° | 0.0° |
| N03 | C02 | C04 | C05 | 1.8° | 0.3° |
| N03 | C02 | C04 | N01 | 178.3° | 180.0° |
| N03 | C02 | C04 | S08 | 179.2° | 180.0° |
| N03 | C02 | N01 | H012 | 178.3° | 180.0° |
| N03 | C02 | N01 | H011 | 1.7° | 0.0° |
| C06 | C05 | C04 | H051 | 180.0° | 179.9° |
| C06 | C05 | C04 | C02 | 179.9° | 180.0° |
| C06 | C05 | C04 | S08 | 0.9° | 0.3° |
| C05 | C06 | C07 | S08 | 1.2° | 0.2° |
| C05 | C06 | C07 | H071 | 178.8° | 180.0° |
| C04 | C05 | C06 | C07 | 1.4° | 0.1° |
| C05 | C04 | C02 | S08 | 179.0° | 179.7° |
| C05 | C04 | C02 | N01 | 176.5° | 179.8° |
| C05 | C04 | S08 | C07 | 0.2° | 0.3° |
| C06 | C07 | S08 | C04 | 0.6° | 0.3° |
| C06 | C07 | S08 | H071 | 180.0° | 179.8° |
| C07 | C06 | C05 | H051 | 178.6° | 180.0° |
| C02 | C04 | S08 | C07 | 179.4° | 179.9° |
| C02 | C04 | C05 | H051 | 0.0° | 0.1° |
| C04 | C02 | N01 | H012 | 0.0° | 0.0° |
| C04 | C02 | N03 | H031 | 178.2° | 180.0° |
| C04 | C02 | N01 | H011 | 180.0° | 180.0° |
| N01 | C02 | C04 | S08 | 2.5° | 0.0° |
| C02 | N01 | H012 | H011 | 180.0° | 180.0° |
| N01 | C02 | N03 | H031 | 0.0° | 0.1° |
| S08 | C04 | C05 | H051 | 179.1° | 179.8° |
| C04 | S08 | C07 | H071 | 179.4° | 179.9° |
| H101 | C10 | C11 | H111 | 0.4° | 0.1° |
| H111 | C11 | C12 | H121 | 0.5° | 0.1° |
| H182 | C18 | C19 | H192 | 47.6° | 60.0° |
| H182 | C18 | C19 | H191 | 71.2° | 180.0° |
| H181 | C18 | C19 | H192 | 167.0° | 60.1° |
| H181 | C18 | C19 | H191 | 48.2° | 60.0° |
| H231 | C23 | C24 | H242 | 60.8° | 60.1° |
| H231 | C23 | C24 | H241 | 59.2° | 59.9° |
| H232 | C23 | C24 | H242 | 179.4° | 60.0° |
| H232 | C23 | C24 | H241 | 60.6° | 180.0° |
| H271 | C27 | C28 | H281 | 1.4° | 0.1° |
| H311 | C31 | C32 | H321 | 1.7° | 0.1° |
