A1IFN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | O01 | doub | 1.21Å | 1.17Å | |
| C05 | C04 | sing | 1.53Å | 1.53Å | |
| C06 | C05 | sing | 1.53Å | 1.52Å | |
| C07 | C05 | sing | 1.53Å | 1.52Å | |
| C04 | C03 | sing | 1.53Å | 1.51Å | |
| P08 | C03 | sing | 1.82Å | 1.79Å | |
| O09 | P08 | doub | 1.48Å | 1.48Å | |
| O10 | P08 | sing | 1.61Å | 1.51Å | |
| O11 | P08 | sing | 1.61Å | 1.52Å | |
| C03 | C02 | sing | 1.51Å | 1.52Å | |
| N12 | C02 | sing | 1.35Å | 1.40Å | |
| C13 | N12 | sing | 1.47Å | 1.40Å | |
| C16 | N15 | sing | 1.39Å | 1.46Å | |
| C17 | C16 | doub | 1.39Å | 1.38Å | Aromatic |
| C18 | C17 | sing | 1.37Å | 1.40Å | Aromatic |
| C19 | C18 | doub | 1.40Å | 1.38Å | Aromatic |
| F22 | C21 | sing | 1.40Å | 1.34Å | |
| F23 | C21 | sing | 1.40Å | 1.34Å | |
| F24 | C21 | sing | 1.40Å | 1.32Å | |
| C21 | C20 | sing | 1.51Å | 1.53Å | |
| O25 | C20 | doub | 1.21Å | 1.20Å | |
| C20 | C19 | sing | 1.47Å | 1.51Å | |
| C26 | C19 | sing | 1.40Å | 1.38Å | Aromatic |
| C27 | C26 | doub | 1.37Å | 1.38Å | Aromatic |
| N15 | C14 | sing | 1.35Å | 1.41Å | |
| O28 | C14 | doub | 1.21Å | 1.16Å | |
| C14 | C13 | sing | 1.51Å | 1.49Å | |
| C29 | C13 | sing | 1.53Å | 1.60Å | |
| C30 | C29 | sing | 1.53Å | 1.52Å | |
| C31 | C29 | sing | 1.53Å | 1.53Å | |
| C16 | C27 | sing | 1.39Å | 1.39Å | Aromatic |
| N12 | H121 | sing | 0.97Å | 1.00Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| C06 | H063 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C07 | H072 | sing | 1.09Å | 1.10Å | |
| C07 | H073 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C30 | H303 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C31 | H313 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| N15 | H151 | sing | 0.97Å | 1.00Å | |
| O10 | H1 | sing | 0.97Å | 0.95Å | |
| O11 | H2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C02 | C03 | 124.8° | 120.0° |
| O01 | C02 | N12 | 119.6° | 120.0° |
| C04 | C05 | C06 | 114.0° | 109.5° |
| C04 | C05 | C07 | 109.7° | 109.5° |
| C05 | C04 | C03 | 114.7° | 109.5° |
| C05 | C04 | H041 | 108.1° | 109.5° |
| C05 | C04 | H042 | 108.1° | 109.5° |
| C04 | C05 | H051 | 106.8° | 109.5° |
| C06 | C05 | C07 | 112.1° | 109.4° |
| C06 | C05 | H051 | 106.8° | 109.5° |
| C05 | C06 | H062 | 109.5° | 109.5° |
| C05 | C06 | H063 | 109.5° | 109.4° |
| C05 | C06 | H061 | 109.5° | 109.4° |
| C07 | C05 | H051 | 107.0° | 109.5° |
| C05 | C07 | H072 | 109.5° | 109.5° |
| C05 | C07 | H073 | 109.4° | 109.5° |
| C05 | C07 | H071 | 109.5° | 109.5° |
| C04 | C03 | P08 | 115.8° | 109.5° |
| C04 | C03 | C02 | 108.2° | 109.5° |
| C04 | C03 | H031 | 106.6° | 109.5° |
| C03 | C04 | H041 | 108.2° | 109.5° |
| C03 | C04 | H042 | 108.2° | 109.4° |
| C03 | P08 | O09 | 106.7° | 109.5° |
| C03 | P08 | O10 | 110.4° | 109.5° |
| C03 | P08 | O11 | 108.0° | 109.5° |
| P08 | C03 | C02 | 114.9° | 109.5° |
| P08 | C03 | H031 | 104.0° | 109.5° |
| O09 | P08 | O10 | 107.6° | 109.4° |
| O09 | P08 | O11 | 108.4° | 109.5° |
| O10 | P08 | O11 | 115.3° | 109.5° |
| P08 | O10 | H1 | 109.5° | 114.0° |
| P08 | O11 | H2 | 109.5° | 114.0° |
| C03 | C02 | N12 | 115.6° | 120.0° |
| C02 | C03 | H031 | 106.4° | 109.5° |
| C02 | N12 | C13 | 116.3° | 120.0° |
| C02 | N12 | H121 | 121.8° | 120.0° |
| N12 | C13 | C14 | 117.6° | 109.4° |
| N12 | C13 | C29 | 102.8° | 109.5° |
| C13 | N12 | H121 | 121.9° | 120.0° |
| N12 | C13 | H131 | 111.9° | 109.5° |
| N15 | C16 | C17 | 127.1° | 119.9° |
| C16 | N15 | C14 | 121.5° | 120.0° |
| N15 | C16 | C27 | 111.7° | 119.9° |
| C16 | N15 | H151 | 119.3° | 120.0° |
| C16 | C17 | C18 | 119.0° | 120.1° |
| C17 | C16 | C27 | 119.4° | 120.2° |
| C16 | C17 | H171 | 120.5° | 119.9° |
| C17 | C18 | C19 | 119.5° | 119.9° |
| C18 | C17 | H171 | 120.5° | 120.0° |
| C17 | C18 | H181 | 120.2° | 120.1° |
| C18 | C19 | C20 | 128.2° | 120.1° |
| C18 | C19 | C26 | 121.1° | 119.8° |
| C19 | C18 | H181 | 120.2° | 120.0° |
| F22 | C21 | F23 | 107.0° | 109.5° |
| F22 | C21 | F24 | 107.7° | 109.4° |
| F22 | C21 | C20 | 118.4° | 109.5° |
| F23 | C21 | F24 | 109.5° | 109.5° |
| F23 | C21 | C20 | 101.2° | 109.5° |
| F24 | C21 | C20 | 112.6° | 109.4° |
| C21 | C20 | O25 | 121.1° | 120.0° |
| C21 | C20 | C19 | 111.5° | 120.0° |
| O25 | C20 | C19 | 123.6° | 119.9° |
| C20 | C19 | C26 | 110.2° | 120.1° |
| C19 | C26 | C27 | 118.8° | 119.9° |
| C19 | C26 | H261 | 120.6° | 120.0° |
| C26 | C27 | C16 | 120.9° | 120.1° |
| C27 | C26 | H261 | 120.6° | 120.0° |
| C26 | C27 | H271 | 119.5° | 120.0° |
| N15 | C14 | O28 | 126.4° | 120.0° |
| N15 | C14 | C13 | 111.9° | 120.0° |
| C14 | N15 | H151 | 119.2° | 120.0° |
| O28 | C14 | C13 | 121.7° | 120.0° |
| C14 | C13 | C29 | 104.1° | 109.5° |
| C14 | C13 | H131 | 110.6° | 109.5° |
| C13 | C29 | C30 | 113.0° | 109.5° |
| C13 | C29 | C31 | 114.2° | 109.5° |
| C29 | C13 | H131 | 109.0° | 109.5° |
| C13 | C29 | H291 | 106.1° | 109.5° |
| C30 | C29 | C31 | 109.1° | 109.5° |
| C30 | C29 | H291 | 107.0° | 109.5° |
| C29 | C30 | H303 | 109.5° | 109.4° |
| C29 | C30 | H301 | 109.5° | 109.5° |
| C29 | C30 | H302 | 109.4° | 109.5° |
| C31 | C29 | H291 | 106.9° | 109.4° |
| C29 | C31 | H313 | 109.5° | 109.5° |
| C29 | C31 | H312 | 109.4° | 109.4° |
| C29 | C31 | H311 | 109.4° | 109.4° |
| C16 | C27 | H271 | 119.5° | 119.9° |
| H041 | C04 | H042 | 109.5° | 109.5° |
| H062 | C06 | H063 | 109.5° | 109.5° |
| H062 | C06 | H061 | 109.5° | 109.5° |
| H063 | C06 | H061 | 109.4° | 109.5° |
| H072 | C07 | H073 | 109.5° | 109.5° |
| H072 | C07 | H071 | 109.4° | 109.5° |
| H073 | C07 | H071 | 109.5° | 109.4° |
| H303 | C30 | H301 | 109.5° | 109.4° |
| H303 | C30 | H302 | 109.5° | 109.5° |
| H301 | C30 | H302 | 109.5° | 109.5° |
| H313 | C31 | H312 | 109.5° | 109.5° |
| H313 | C31 | H311 | 109.5° | 109.5° |
| H312 | C31 | H311 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C02 | C03 | C04 | 37.8° | 90.0° |
| O01 | C02 | C03 | P08 | 93.5° | 30.0° |
| O01 | C02 | C03 | N12 | 179.0° | 179.9° |
| O01 | C02 | N12 | C13 | 5.2° | 0.2° |
| O01 | C02 | N12 | H121 | 174.8° | 180.0° |
| O01 | C02 | C03 | H031 | 152.0° | 150.0° |
| C04 | C05 | C06 | C07 | 125.4° | 120.0° |
| C04 | C05 | C06 | H051 | 117.7° | 120.0° |
| C04 | C05 | C07 | H051 | 115.5° | 120.0° |
| C05 | C04 | C03 | H041 | 120.8° | 120.0° |
| C05 | C04 | C03 | H042 | 120.8° | 120.0° |
| C05 | C04 | C03 | P08 | 171.6° | 173.2° |
| C05 | C04 | C03 | C02 | 57.7° | 66.8° |
| C05 | C04 | C03 | H031 | 56.5° | 53.3° |
| C05 | C04 | H041 | H042 | 117.6° | 120.0° |
| C04 | C05 | C06 | H062 | 180.0° | 60.0° |
| C04 | C05 | C06 | H063 | 60.0° | 180.0° |
| C04 | C05 | C06 | H061 | 60.0° | 60.0° |
| C04 | C05 | C07 | H072 | 180.0° | 54.6° |
| C04 | C05 | C07 | H073 | 60.0° | 65.4° |
| C04 | C05 | C07 | H071 | 60.0° | 174.6° |
| C06 | C05 | C07 | H051 | 116.8° | 120.0° |
| C06 | C05 | C04 | C03 | 57.8° | 174.4° |
| C06 | C05 | C04 | H041 | 63.0° | 54.4° |
| C06 | C05 | C04 | H042 | 178.6° | 65.6° |
| C05 | C06 | H062 | H063 | 120.0° | 120.0° |
| C05 | C06 | H062 | H061 | 120.0° | 120.0° |
| C05 | C06 | H063 | H061 | 120.0° | 119.9° |
| C06 | C05 | C07 | H072 | 52.2° | 65.4° |
| C06 | C05 | C07 | H073 | 172.2° | 174.6° |
| C06 | C05 | C07 | H071 | 67.8° | 54.7° |
| C07 | C05 | C04 | C03 | 175.5° | 65.6° |
| C07 | C05 | C04 | H041 | 63.7° | 174.3° |
| C07 | C05 | C04 | H042 | 54.7° | 54.3° |
| C07 | C05 | C06 | H062 | 54.6° | 60.0° |
| C07 | C05 | C06 | H063 | 65.5° | 60.1° |
| C07 | C05 | C06 | H061 | 174.6° | 180.0° |
| C05 | C07 | H072 | H073 | 120.0° | 120.0° |
| C05 | C07 | H072 | H071 | 120.0° | 120.1° |
| C05 | C07 | H073 | H071 | 120.0° | 120.0° |
| C04 | C03 | P08 | C02 | 127.5° | 120.0° |
| C04 | C03 | P08 | H031 | 116.6° | 120.0° |
| C04 | C03 | P08 | O09 | 73.1° | 54.9° |
| C04 | C03 | P08 | O10 | 170.3° | 174.9° |
| C04 | C03 | P08 | O11 | 43.3° | 65.1° |
| C04 | C03 | C02 | H031 | 114.3° | 120.0° |
| C04 | C03 | C02 | N12 | 141.2° | 90.0° |
| C03 | C04 | H041 | H042 | 117.6° | 120.0° |
| C03 | C04 | C05 | H051 | 59.9° | 54.4° |
| C03 | P08 | O09 | O10 | 118.5° | 120.0° |
| C03 | P08 | O09 | O11 | 116.1° | 120.0° |
| C03 | P08 | O10 | O11 | 122.8° | 120.0° |
| P08 | C03 | C02 | H031 | 114.5° | 120.0° |
| P08 | C03 | C02 | N12 | 87.5° | 150.0° |
| P08 | C03 | C04 | H041 | 50.8° | 66.7° |
| P08 | C03 | C04 | H042 | 67.7° | 53.3° |
| C03 | P08 | O10 | H1 | 116.1° | 60.0° |
| C03 | P08 | O11 | H2 | 115.3° | 65.1° |
| O09 | P08 | O10 | O11 | 121.1° | 120.0° |
| O09 | P08 | C03 | C02 | 54.4° | 65.1° |
| O09 | P08 | C03 | H031 | 170.3° | 174.9° |
| O09 | P08 | O10 | H1 | 0.0° | 60.0° |
| O09 | P08 | O11 | H2 | 0.0° | 54.9° |
| O10 | P08 | C03 | C02 | 62.2° | 54.9° |
| O10 | P08 | C03 | H031 | 53.7° | 65.1° |
| O10 | P08 | O11 | H2 | 120.6° | 174.9° |
| O11 | P08 | C03 | C02 | 170.8° | 174.9° |
| O11 | P08 | C03 | H031 | 73.3° | 54.9° |
| O11 | P08 | O10 | H1 | 121.1° | 180.0° |
| C03 | C02 | N12 | C13 | 173.8° | 179.7° |
| C03 | C02 | N12 | H121 | 6.1° | 0.0° |
| C02 | C03 | C04 | H041 | 178.5° | 53.3° |
| C02 | C03 | C04 | H042 | 63.1° | 173.2° |
| C02 | N12 | C13 | H121 | 180.0° | 179.8° |
| C02 | N12 | C13 | C14 | 96.7° | 155.1° |
| C02 | N12 | C13 | C29 | 149.7° | 85.0° |
| C02 | N12 | C13 | H131 | 32.8° | 35.1° |
| N12 | C02 | C03 | H031 | 27.0° | 30.0° |
| N12 | C13 | C14 | N15 | 155.5° | 169.4° |
| N12 | C13 | C14 | O28 | 24.9° | 10.6° |
| N12 | C13 | C14 | C29 | 112.9° | 120.0° |
| N12 | C13 | C14 | H131 | 130.1° | 120.0° |
| N12 | C13 | C29 | H131 | 118.8° | 120.0° |
| N12 | C13 | C29 | C30 | 174.1° | 63.5° |
| N12 | C13 | C29 | C31 | 60.4° | 56.6° |
| N12 | C13 | C29 | H291 | 57.2° | 176.6° |
| N15 | C16 | C17 | C27 | 163.4° | 179.9° |
| N15 | C16 | C17 | C18 | 176.2° | 179.8° |
| N15 | C16 | C27 | C26 | 176.9° | 179.6° |
| C16 | N15 | C14 | H151 | 180.0° | 180.0° |
| C16 | N15 | C14 | O28 | 11.2° | 6.0° |
| C16 | N15 | C14 | C13 | 168.3° | 174.1° |
| N15 | C16 | C17 | H171 | 3.8° | 0.1° |
| N15 | C16 | C27 | H271 | 3.0° | 0.1° |
| C16 | C17 | C18 | H171 | 180.0° | 179.7° |
| C16 | C17 | C18 | C19 | 6.4° | 0.0° |
| C17 | C16 | C27 | C26 | 11.1° | 0.5° |
| C17 | C16 | N15 | C14 | 16.7° | 146.6° |
| C16 | C17 | C18 | H181 | 173.6° | 179.9° |
| C17 | C16 | C27 | H271 | 168.8° | 180.0° |
| C17 | C16 | N15 | H151 | 163.3° | 33.5° |
| C17 | C18 | C19 | H181 | 180.0° | 179.9° |
| C17 | C18 | C19 | C20 | 173.3° | 180.0° |
| C17 | C18 | C19 | C26 | 1.9° | 0.1° |
| C18 | C17 | C16 | C27 | 12.8° | 0.3° |
| C18 | C19 | C20 | C21 | 73.7° | 0.1° |
| C18 | C19 | C20 | O25 | 128.2° | 180.0° |
| C18 | C19 | C20 | C26 | 172.1° | 179.9° |
| C18 | C19 | C26 | C27 | 3.7° | 0.2° |
| C19 | C18 | C17 | H171 | 173.6° | 179.7° |
| C18 | C19 | C26 | H261 | 176.3° | 180.0° |
| F22 | C21 | F23 | F24 | 116.5° | 120.0° |
| F22 | C21 | F23 | C20 | 124.5° | 120.0° |
| F22 | C21 | F24 | C20 | 132.3° | 120.0° |
| F22 | C21 | C20 | O25 | 161.9° | 0.1° |
| F22 | C21 | C20 | C19 | 39.4° | 180.0° |
| F23 | C21 | F24 | C20 | 111.7° | 120.0° |
| F23 | C21 | C20 | O25 | 81.7° | 120.0° |
| F23 | C21 | C20 | C19 | 77.1° | 60.0° |
| F24 | C21 | C20 | O25 | 35.1° | 120.0° |
| F24 | C21 | C20 | C19 | 166.1° | 60.0° |
| C21 | C20 | O25 | C19 | 156.1° | 180.0° |
| C21 | C20 | C19 | C26 | 98.4° | 180.0° |
| O25 | C20 | C19 | C26 | 59.7° | 0.0° |
| C20 | C19 | C26 | C27 | 176.5° | 179.7° |
| C20 | C19 | C26 | H261 | 3.5° | 0.1° |
| C20 | C19 | C18 | H181 | 6.7° | 0.1° |
| C19 | C26 | C27 | H261 | 180.0° | 179.8° |
| C19 | C26 | C27 | C16 | 2.8° | 0.5° |
| C26 | C19 | C18 | H181 | 178.1° | 180.0° |
| C19 | C26 | C27 | H271 | 177.2° | 180.0° |
| C26 | C27 | C16 | H271 | 180.0° | 179.5° |
| N15 | C14 | O28 | C13 | 179.5° | 180.0° |
| N15 | C14 | C13 | C29 | 91.6° | 70.6° |
| C14 | N15 | C16 | C27 | 147.7° | 33.4° |
| N15 | C14 | C13 | H131 | 25.3° | 49.4° |
| O28 | C14 | C13 | C29 | 88.0° | 109.3° |
| O28 | C14 | C13 | H131 | 155.1° | 130.6° |
| O28 | C14 | N15 | H151 | 168.8° | 174.1° |
| C14 | C13 | C29 | H131 | 118.0° | 120.0° |
| C14 | C13 | C29 | C30 | 51.0° | 176.6° |
| C14 | C13 | C29 | C31 | 176.5° | 63.4° |
| C14 | C13 | N12 | H121 | 83.3° | 24.7° |
| C14 | C13 | C29 | H291 | 66.0° | 56.6° |
| C13 | C14 | N15 | H151 | 11.6° | 5.9° |
| C13 | C29 | C30 | C31 | 128.2° | 120.0° |
| C13 | C29 | C30 | H291 | 116.4° | 120.0° |
| C13 | C29 | C31 | H291 | 117.1° | 120.0° |
| C29 | C13 | N12 | H121 | 30.3° | 95.2° |
| C13 | C29 | C30 | H303 | 180.0° | 65.8° |
| C13 | C29 | C30 | H301 | 60.0° | 174.3° |
| C13 | C29 | C30 | H302 | 60.0° | 54.3° |
| C13 | C29 | C31 | H313 | 180.0° | 60.0° |
| C13 | C29 | C31 | H312 | 60.0° | 180.0° |
| C13 | C29 | C31 | H311 | 60.0° | 60.0° |
| C30 | C29 | C31 | H291 | 115.4° | 120.0° |
| C30 | C29 | C13 | H131 | 67.0° | 56.6° |
| C29 | C30 | H303 | H301 | 120.0° | 119.9° |
| C29 | C30 | H303 | H302 | 120.0° | 120.1° |
| C29 | C30 | H301 | H302 | 120.0° | 120.0° |
| C30 | C29 | C31 | H313 | 52.5° | 180.0° |
| C30 | C29 | C31 | H312 | 67.5° | 60.0° |
| C30 | C29 | C31 | H311 | 172.5° | 60.0° |
| C31 | C29 | C13 | H131 | 58.5° | 176.6° |
| C31 | C29 | C30 | H303 | 51.8° | 54.2° |
| C31 | C29 | C30 | H301 | 171.8° | 65.7° |
| C31 | C29 | C30 | H302 | 68.2° | 174.3° |
| C29 | C31 | H313 | H312 | 120.0° | 120.0° |
| C29 | C31 | H313 | H311 | 120.0° | 119.9° |
| C29 | C31 | H312 | H311 | 120.0° | 119.9° |
| C27 | C16 | C17 | H171 | 167.2° | 179.9° |
| C16 | C27 | C26 | H261 | 177.2° | 179.7° |
| C27 | C16 | N15 | H151 | 32.3° | 146.6° |
| H121 | N12 | C13 | H131 | 147.2° | 144.7° |
| H131 | C13 | C29 | H291 | 176.0° | 63.4° |
| H171 | C17 | C18 | H181 | 6.4° | 0.3° |
| H261 | C26 | C27 | H271 | 2.8° | 0.2° |
| H031 | C03 | C04 | H041 | 64.3° | 173.3° |
| H031 | C03 | C04 | H042 | 177.2° | 66.7° |
| H041 | C04 | C05 | H051 | 179.3° | 65.6° |
| H042 | C04 | C05 | H051 | 60.8° | 174.4° |
| H051 | C05 | C06 | H062 | 62.3° | 180.0° |
| H051 | C05 | C06 | H063 | 177.7° | 60.0° |
| H051 | C05 | C06 | H061 | 57.7° | 60.0° |
| H051 | C05 | C07 | H072 | 64.5° | 174.6° |
| H051 | C05 | C07 | H073 | 55.5° | 54.6° |
| H051 | C05 | C07 | H071 | 175.5° | 65.4° |
| H062 | C06 | H063 | H061 | 120.0° | 120.0° |
| H072 | C07 | H073 | H071 | 120.0° | 120.0° |
| H291 | C29 | C30 | H303 | 63.6° | 174.2° |
| H291 | C29 | C30 | H301 | 56.4° | 54.3° |
| H291 | C29 | C30 | H302 | 176.4° | 65.7° |
| H291 | C29 | C31 | H313 | 62.9° | 60.0° |
| H291 | C29 | C31 | H312 | 177.1° | 60.0° |
| H291 | C29 | C31 | H311 | 57.1° | 180.0° |
| H303 | C30 | H301 | H302 | 120.0° | 120.0° |
| H313 | C31 | H312 | H311 | 120.0° | 120.1° |
