A1ID2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | C01 | doub | 1.38Å | 1.38Å | Aromatic |
| C03 | C02 | sing | 1.39Å | 1.39Å | Aromatic |
| C04 | C03 | doub | 1.39Å | 1.40Å | Aromatic |
| C05 | C04 | sing | 1.41Å | 1.40Å | Aromatic |
| C06 | C05 | doub | 1.39Å | 1.40Å | Aromatic |
| C07 | C05 | sing | 1.48Å | 1.47Å | |
| O08 | C07 | doub | 1.21Å | 1.22Å | |
| C09 | C07 | sing | 1.48Å | 1.47Å | |
| C10 | C09 | doub | 1.41Å | 1.40Å | Aromatic |
| O12 | C11 | doub | 1.21Å | 1.23Å | |
| C11 | C10 | sing | 1.48Å | 1.48Å | |
| C13 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C16 | C15 | doub | 1.40Å | 1.39Å | Aromatic |
| C17 | C15 | sing | 1.48Å | 1.49Å | |
| O18 | C17 | doub | 1.22Å | 1.22Å | |
| N19 | C17 | sing | 1.35Å | 1.33Å | |
| C20 | N19 | sing | 1.47Å | 1.46Å | |
| C21 | C20 | sing | 1.53Å | 1.52Å | |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C23 | C22 | sing | 1.53Å | 1.52Å | |
| C24 | C23 | sing | 1.53Å | 1.51Å | |
| C25 | C24 | sing | 1.54Å | 1.53Å | |
| N26 | C25 | sing | 1.47Å | 1.45Å | |
| C27 | N26 | sing | 1.34Å | 1.34Å | |
| O28 | C27 | doub | 1.22Å | 1.23Å | |
| N29 | C27 | sing | 1.34Å | 1.33Å | |
| C30 | N29 | sing | 1.47Å | 1.46Å | |
| C31 | C30 | sing | 1.54Å | 1.53Å | |
| S32 | C31 | sing | 1.84Å | 1.81Å | |
| C01 | C06 | sing | 1.39Å | 1.38Å | Aromatic |
| C04 | C11 | sing | 1.48Å | 1.48Å | |
| C09 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| C24 | S32 | sing | 1.84Å | 1.82Å | |
| C25 | C30 | sing | 1.53Å | 1.55Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| N19 | H191 | sing | 0.97Å | 1.00Å | |
| N26 | H261 | sing | 0.97Å | 1.00Å | |
| N29 | H291 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | C03 | 120.4° | 120.4° |
| C02 | C01 | C06 | 120.4° | 120.5° |
| C02 | C01 | H011 | 119.8° | 119.8° |
| C01 | C02 | H021 | 119.8° | 119.8° |
| C02 | C03 | C04 | 120.1° | 119.8° |
| C02 | C03 | H031 | 119.9° | 120.1° |
| C03 | C02 | H021 | 119.8° | 119.8° |
| C03 | C04 | C05 | 119.3° | 119.7° |
| C03 | C04 | C11 | 119.7° | 120.6° |
| C04 | C03 | H031 | 120.0° | 120.1° |
| C04 | C05 | C06 | 119.9° | 119.8° |
| C04 | C05 | C07 | 121.0° | 119.7° |
| C05 | C04 | C11 | 121.0° | 119.7° |
| C06 | C05 | C07 | 119.1° | 120.6° |
| C05 | C06 | C01 | 119.9° | 119.8° |
| C05 | C06 | H061 | 120.1° | 120.1° |
| C05 | C07 | O08 | 120.9° | 120.4° |
| C05 | C07 | C09 | 118.2° | 119.2° |
| O08 | C07 | C09 | 120.9° | 120.3° |
| C07 | C09 | C10 | 121.1° | 119.7° |
| C07 | C09 | C16 | 119.0° | 120.5° |
| C09 | C10 | C11 | 121.0° | 119.6° |
| C09 | C10 | C13 | 119.4° | 120.0° |
| C10 | C09 | C16 | 119.9° | 119.8° |
| O12 | C11 | C10 | 121.1° | 120.4° |
| O12 | C11 | C04 | 121.2° | 120.4° |
| C11 | C10 | C13 | 119.5° | 120.4° |
| C10 | C11 | C04 | 117.7° | 119.2° |
| C10 | C13 | C14 | 120.1° | 120.0° |
| C10 | C13 | H131 | 119.9° | 119.9° |
| C13 | C14 | C15 | 120.7° | 120.3° |
| C14 | C13 | H131 | 119.9° | 120.1° |
| C13 | C14 | H141 | 119.7° | 119.8° |
| C14 | C15 | C16 | 119.5° | 120.2° |
| C14 | C15 | C17 | 120.0° | 119.9° |
| C15 | C14 | H141 | 119.6° | 119.9° |
| C16 | C15 | C17 | 120.3° | 119.9° |
| C15 | C16 | C09 | 120.3° | 119.7° |
| C15 | C16 | H161 | 119.8° | 120.2° |
| C15 | C17 | O18 | 120.7° | 120.0° |
| C15 | C17 | N19 | 117.3° | 120.0° |
| O18 | C17 | N19 | 122.0° | 120.0° |
| C17 | N19 | C20 | 120.9° | 120.0° |
| C17 | N19 | H191 | 119.6° | 120.0° |
| N19 | C20 | C21 | 111.7° | 109.5° |
| N19 | C20 | H201 | 108.9° | 109.4° |
| N19 | C20 | H202 | 108.9° | 109.5° |
| C20 | N19 | H191 | 119.5° | 120.0° |
| C20 | C21 | C22 | 113.4° | 109.5° |
| C20 | C21 | H212 | 108.5° | 109.5° |
| C20 | C21 | H211 | 108.5° | 109.5° |
| C21 | C20 | H201 | 108.9° | 109.5° |
| C21 | C20 | H202 | 108.9° | 109.5° |
| C21 | C22 | C23 | 113.2° | 109.5° |
| C22 | C21 | H212 | 108.5° | 109.5° |
| C22 | C21 | H211 | 108.5° | 109.4° |
| C21 | C22 | H221 | 108.5° | 109.5° |
| C21 | C22 | H222 | 108.5° | 109.4° |
| C22 | C23 | C24 | 113.7° | 109.4° |
| C23 | C22 | H221 | 108.5° | 109.5° |
| C23 | C22 | H222 | 108.5° | 109.5° |
| C22 | C23 | H232 | 108.4° | 109.4° |
| C22 | C23 | H231 | 108.4° | 109.5° |
| C23 | C24 | C25 | 114.8° | 110.7° |
| C23 | C24 | S32 | 113.9° | 110.8° |
| C24 | C23 | H232 | 108.4° | 109.5° |
| C24 | C23 | H231 | 108.4° | 109.5° |
| C23 | C24 | H241 | 109.3° | 110.7° |
| C24 | C25 | N26 | 115.5° | 109.2° |
| C25 | C24 | S32 | 103.2° | 102.7° |
| C24 | C25 | C30 | 110.5° | 112.4° |
| C25 | C24 | H241 | 109.1° | 110.9° |
| C24 | C25 | H251 | 109.0° | 110.3° |
| C25 | N26 | C27 | 112.4° | 109.0° |
| N26 | C25 | C30 | 102.5° | 104.0° |
| N26 | C25 | H251 | 110.2° | 110.5° |
| C25 | N26 | H261 | 123.8° | 125.5° |
| N26 | C27 | O28 | 124.8° | 123.0° |
| N26 | C27 | N29 | 109.9° | 113.9° |
| C27 | N26 | H261 | 123.8° | 125.5° |
| O28 | C27 | N29 | 125.3° | 123.1° |
| C27 | N29 | C30 | 111.9° | 109.0° |
| C27 | N29 | H291 | 124.0° | 125.5° |
| N29 | C30 | C31 | 116.9° | 109.3° |
| N29 | C30 | C25 | 103.0° | 104.1° |
| N29 | C30 | H301 | 110.5° | 110.3° |
| C30 | N29 | H291 | 124.1° | 125.5° |
| C30 | C31 | S32 | 105.3° | 102.7° |
| C31 | C30 | C25 | 107.4° | 112.4° |
| C31 | C30 | H301 | 109.5° | 110.5° |
| C30 | C31 | H311 | 110.5° | 110.8° |
| C30 | C31 | H312 | 110.5° | 110.7° |
| C31 | S32 | C24 | 88.7° | 94.8° |
| S32 | C31 | H311 | 110.5° | 110.8° |
| S32 | C31 | H312 | 110.5° | 110.9° |
| C06 | C01 | H011 | 119.8° | 119.7° |
| C01 | C06 | H061 | 120.0° | 120.1° |
| C09 | C16 | H161 | 119.8° | 120.1° |
| S32 | C24 | H241 | 106.0° | 110.8° |
| C30 | C25 | H251 | 108.8° | 110.4° |
| C25 | C30 | H301 | 109.3° | 110.2° |
| H212 | C21 | H211 | 109.5° | 109.5° |
| H221 | C22 | H222 | 109.5° | 109.5° |
| H232 | C23 | H231 | 109.5° | 109.4° |
| H201 | C20 | H202 | 109.5° | 109.5° |
| H311 | C31 | H312 | 109.5° | 110.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | C03 | H021 | 180.0° | 179.9° |
| C01 | C02 | C03 | C04 | 0.0° | 0.0° |
| C02 | C01 | C06 | C05 | 0.1° | 0.0° |
| C02 | C01 | C06 | H011 | 180.0° | 179.9° |
| C01 | C02 | C03 | H031 | 180.0° | 179.9° |
| C02 | C01 | C06 | H061 | 179.9° | 180.0° |
| C02 | C03 | C04 | H031 | 180.0° | 179.9° |
| C02 | C03 | C04 | C05 | 0.1° | 0.0° |
| C03 | C02 | C01 | C06 | 0.1° | 0.1° |
| C02 | C03 | C04 | C11 | 179.2° | 179.9° |
| C03 | C02 | C01 | H011 | 179.9° | 180.0° |
| C03 | C04 | C05 | C11 | 179.2° | 179.9° |
| C03 | C04 | C05 | C06 | 0.1° | 0.0° |
| C03 | C04 | C05 | C07 | 179.8° | 179.9° |
| C03 | C04 | C11 | O12 | 3.9° | 13.9° |
| C03 | C04 | C11 | C10 | 178.8° | 166.1° |
| C04 | C03 | C02 | H021 | 180.0° | 180.0° |
| C04 | C05 | C06 | C07 | 179.9° | 179.9° |
| C04 | C05 | C07 | O08 | 179.7° | 166.2° |
| C04 | C05 | C07 | C09 | 0.4° | 13.8° |
| C05 | C04 | C11 | O12 | 175.4° | 166.2° |
| C05 | C04 | C11 | C10 | 2.0° | 13.8° |
| C04 | C05 | C06 | C01 | 0.0° | 0.0° |
| C05 | C04 | C03 | H031 | 179.9° | 179.9° |
| C04 | C05 | C06 | H061 | 180.0° | 180.0° |
| C06 | C05 | C07 | O08 | 0.4° | 13.9° |
| C06 | C05 | C07 | C09 | 179.7° | 166.1° |
| C05 | C06 | C01 | H061 | 180.0° | 180.0° |
| C06 | C05 | C04 | C11 | 179.2° | 179.9° |
| C05 | C06 | C01 | H011 | 179.9° | 179.9° |
| C05 | C07 | O08 | C09 | 179.3° | 179.9° |
| C05 | C07 | C09 | C10 | 1.1° | 13.8° |
| C07 | C05 | C06 | C01 | 179.9° | 179.9° |
| C07 | C05 | C04 | C11 | 0.9° | 0.0° |
| C05 | C07 | C09 | C16 | 177.8° | 166.1° |
| C07 | C05 | C06 | H061 | 0.0° | 0.1° |
| O08 | C07 | C09 | C10 | 179.6° | 166.2° |
| O08 | C07 | C09 | C16 | 1.5° | 13.9° |
| C07 | C09 | C10 | C16 | 178.9° | 179.9° |
| C07 | C09 | C10 | C11 | 2.3° | 0.0° |
| C07 | C09 | C10 | C13 | 179.1° | 179.7° |
| C07 | C09 | C16 | C15 | 178.8° | 179.5° |
| C07 | C09 | C16 | H161 | 1.2° | 0.1° |
| C09 | C10 | C11 | O12 | 174.7° | 166.2° |
| C09 | C10 | C11 | C13 | 176.8° | 179.7° |
| C09 | C10 | C13 | C14 | 0.2° | 0.0° |
| C10 | C09 | C16 | C15 | 0.1° | 0.4° |
| C09 | C10 | C11 | C04 | 2.7° | 13.8° |
| C09 | C10 | C13 | H131 | 179.9° | 180.0° |
| C10 | C09 | C16 | H161 | 179.9° | 179.9° |
| O12 | C11 | C10 | C04 | 177.4° | 179.9° |
| O12 | C11 | C10 | C13 | 2.1° | 14.1° |
| C11 | C10 | C13 | C14 | 176.7° | 179.7° |
| C11 | C10 | C09 | C16 | 176.6° | 179.9° |
| C11 | C10 | C13 | H131 | 3.3° | 0.3° |
| C10 | C13 | C14 | H131 | 180.0° | 179.9° |
| C10 | C13 | C14 | C15 | 0.2° | 0.0° |
| C13 | C10 | C11 | C04 | 179.5° | 165.9° |
| C13 | C10 | C09 | C16 | 0.2° | 0.2° |
| C10 | C13 | C14 | H141 | 179.8° | 180.0° |
| C13 | C14 | C15 | H141 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.5° | 0.2° |
| C13 | C14 | C15 | C17 | 175.6° | 180.0° |
| C14 | C15 | C16 | C17 | 176.1° | 179.8° |
| C14 | C15 | C17 | O18 | 5.7° | 180.0° |
| C14 | C15 | C17 | N19 | 174.2° | 0.0° |
| C14 | C15 | C16 | C09 | 0.4° | 0.4° |
| C15 | C14 | C13 | H131 | 179.8° | 180.0° |
| C14 | C15 | C16 | H161 | 179.5° | 179.9° |
| C16 | C15 | C17 | O18 | 178.3° | 0.2° |
| C16 | C15 | C17 | N19 | 1.9° | 179.8° |
| C15 | C16 | C09 | H161 | 180.0° | 179.6° |
| C16 | C15 | C14 | H141 | 179.5° | 179.8° |
| C15 | C17 | O18 | N19 | 179.9° | 179.9° |
| C15 | C17 | N19 | C20 | 179.2° | 180.0° |
| C17 | C15 | C16 | C09 | 175.7° | 179.8° |
| C17 | C15 | C14 | H141 | 4.4° | 0.0° |
| C17 | C15 | C16 | H161 | 4.3° | 0.1° |
| C15 | C17 | N19 | H191 | 0.8° | 0.1° |
| O18 | C17 | N19 | C20 | 0.7° | 0.1° |
| O18 | C17 | N19 | H191 | 179.3° | 180.0° |
| C17 | N19 | C20 | H191 | 180.0° | 179.9° |
| C17 | N19 | C20 | C21 | 71.5° | 180.0° |
| C17 | N19 | C20 | H201 | 48.8° | 60.0° |
| C17 | N19 | C20 | H202 | 168.1° | 60.0° |
| N19 | C20 | C21 | H201 | 120.3° | 120.0° |
| N19 | C20 | C21 | H202 | 120.3° | 120.0° |
| N19 | C20 | C21 | C22 | 45.8° | 180.0° |
| N19 | C20 | C21 | H212 | 74.8° | 60.0° |
| N19 | C20 | C21 | H211 | 166.4° | 60.0° |
| N19 | C20 | H201 | H202 | 119.0° | 120.0° |
| C20 | C21 | C22 | H212 | 120.6° | 120.0° |
| C20 | C21 | C22 | H211 | 120.6° | 120.0° |
| C20 | C21 | C22 | C23 | 177.5° | 180.0° |
| C20 | C21 | H212 | H211 | 118.2° | 120.0° |
| C20 | C21 | C22 | H221 | 62.0° | 60.0° |
| C20 | C21 | C22 | H222 | 56.9° | 60.0° |
| C21 | C20 | H201 | H202 | 119.0° | 120.0° |
| C21 | C20 | N19 | H191 | 108.5° | 0.0° |
| C21 | C22 | C23 | H221 | 120.6° | 120.0° |
| C21 | C22 | C23 | H222 | 120.5° | 120.0° |
| C21 | C22 | C23 | C24 | 179.9° | 180.0° |
| C22 | C21 | H212 | H211 | 118.2° | 119.9° |
| C21 | C22 | H221 | H222 | 118.3° | 120.0° |
| C21 | C22 | C23 | H232 | 59.3° | 60.0° |
| C21 | C22 | C23 | H231 | 59.4° | 60.0° |
| C22 | C21 | C20 | H201 | 166.2° | 60.0° |
| C22 | C21 | C20 | H202 | 74.5° | 60.0° |
| C22 | C23 | C24 | H232 | 120.6° | 120.0° |
| C22 | C23 | C24 | H231 | 120.6° | 120.0° |
| C22 | C23 | C24 | C25 | 164.5° | 179.8° |
| C22 | C23 | C24 | S32 | 76.8° | 66.5° |
| C23 | C22 | C21 | H212 | 56.9° | 60.0° |
| C23 | C22 | C21 | H211 | 61.9° | 60.0° |
| C23 | C22 | H221 | H222 | 118.3° | 120.0° |
| C22 | C23 | H232 | H231 | 118.1° | 119.9° |
| C22 | C23 | C24 | H241 | 41.6° | 56.8° |
| C23 | C24 | C25 | S32 | 124.5° | 118.3° |
| C23 | C24 | C25 | H241 | 123.0° | 123.3° |
| C23 | C24 | C25 | N26 | 40.7° | 28.0° |
| C23 | C24 | S32 | C31 | 168.8° | 153.0° |
| C23 | C24 | S32 | H241 | 120.3° | 123.3° |
| C23 | C24 | C25 | C30 | 156.5° | 142.9° |
| C24 | C23 | C22 | H221 | 59.5° | 60.0° |
| C24 | C23 | C22 | H222 | 59.4° | 60.0° |
| C24 | C23 | H232 | H231 | 118.1° | 120.1° |
| C23 | C24 | C25 | H251 | 84.0° | 93.5° |
| C24 | C25 | N26 | C30 | 120.2° | 120.1° |
| C24 | C25 | N26 | H251 | 124.1° | 121.4° |
| C24 | C25 | N26 | C27 | 117.3° | 120.2° |
| C24 | C25 | C30 | N29 | 124.4° | 118.0° |
| C24 | C25 | C30 | C31 | 0.5° | 0.1° |
| C25 | C24 | S32 | C31 | 43.7° | 34.7° |
| C25 | C24 | S32 | H241 | 114.7° | 118.4° |
| C24 | C25 | C30 | H251 | 119.7° | 123.5° |
| C25 | C24 | C23 | H232 | 43.9° | 60.3° |
| C25 | C24 | C23 | H231 | 74.8° | 59.8° |
| C24 | C25 | C30 | H301 | 118.2° | 123.8° |
| C24 | C25 | N26 | H261 | 62.6° | 59.9° |
| C25 | N26 | C27 | H261 | 180.0° | 179.9° |
| C25 | N26 | C27 | O28 | 176.3° | 180.0° |
| C25 | N26 | C27 | N29 | 5.8° | 0.1° |
| N26 | C25 | C30 | N29 | 0.7° | 0.0° |
| N26 | C25 | C30 | C31 | 123.2° | 118.1° |
| N26 | C25 | C24 | S32 | 83.9° | 90.3° |
| N26 | C25 | C30 | H251 | 116.7° | 118.5° |
| N26 | C25 | C24 | H241 | 163.7° | 151.4° |
| N26 | C25 | C30 | H301 | 118.1° | 118.3° |
| N26 | C27 | O28 | N29 | 177.7° | 179.9° |
| N26 | C27 | N29 | C30 | 6.2° | 0.1° |
| C27 | N26 | C25 | C30 | 2.9° | 0.1° |
| C27 | N26 | C25 | H251 | 118.6° | 118.4° |
| N26 | C27 | N29 | H291 | 173.7° | 180.0° |
| O28 | C27 | N29 | C30 | 175.8° | 180.0° |
| O28 | C27 | N26 | H261 | 3.7° | 0.1° |
| O28 | C27 | N29 | H291 | 4.2° | 0.1° |
| C27 | N29 | C30 | H291 | 180.0° | 179.9° |
| C27 | N29 | C30 | C31 | 113.2° | 120.2° |
| C27 | N29 | C30 | C25 | 4.2° | 0.0° |
| C27 | N29 | C30 | H301 | 120.8° | 118.2° |
| N29 | C27 | N26 | H261 | 174.3° | 180.0° |
| N29 | C30 | C31 | C25 | 115.0° | 115.0° |
| N29 | C30 | C31 | H301 | 126.5° | 121.5° |
| N29 | C30 | C31 | S32 | 83.3° | 90.2° |
| N29 | C30 | C25 | H301 | 117.4° | 118.3° |
| N29 | C30 | C25 | H251 | 116.0° | 118.5° |
| N29 | C30 | C31 | H311 | 157.4° | 151.4° |
| N29 | C30 | C31 | H312 | 36.1° | 28.2° |
| C30 | C31 | S32 | H311 | 119.3° | 118.4° |
| C30 | C31 | S32 | H312 | 119.3° | 118.3° |
| C30 | C31 | S32 | C24 | 44.6° | 34.8° |
| C31 | C30 | C25 | H301 | 118.7° | 123.7° |
| C31 | C30 | C25 | H251 | 120.1° | 123.4° |
| C30 | C31 | H311 | H312 | 121.9° | 123.2° |
| C31 | C30 | N29 | H291 | 66.8° | 59.8° |
| S32 | C31 | C30 | C25 | 31.7° | 24.7° |
| C31 | S32 | C24 | H241 | 70.9° | 83.7° |
| S32 | C31 | C30 | H301 | 150.2° | 148.2° |
| S32 | C31 | H311 | H312 | 121.9° | 123.5° |
| C06 | C01 | C02 | H021 | 179.9° | 180.0° |
| C11 | C04 | C03 | H031 | 0.9° | 0.2° |
| S32 | C24 | C25 | C30 | 31.9° | 24.6° |
| S32 | C24 | C23 | H232 | 162.6° | 173.5° |
| S32 | C24 | C23 | H231 | 43.9° | 53.5° |
| S32 | C24 | C25 | H251 | 151.5° | 148.1° |
| C24 | S32 | C31 | H311 | 74.7° | 83.6° |
| C24 | S32 | C31 | H312 | 164.0° | 153.0° |
| C30 | C25 | C24 | H241 | 80.5° | 93.8° |
| C25 | C30 | C31 | H311 | 87.7° | 93.6° |
| C25 | C30 | C31 | H312 | 151.0° | 143.1° |
| C30 | C25 | N26 | H261 | 177.1° | 179.9° |
| C25 | C30 | N29 | H291 | 175.8° | 179.9° |
| H212 | C21 | C22 | H221 | 177.4° | 60.1° |
| H212 | C21 | C22 | H222 | 63.7° | 180.0° |
| H212 | C21 | C20 | H201 | 45.6° | 180.0° |
| H212 | C21 | C20 | H202 | 164.9° | 60.0° |
| H211 | C21 | C22 | H221 | 58.6° | 180.0° |
| H211 | C21 | C22 | H222 | 177.5° | 60.0° |
| H211 | C21 | C20 | H201 | 73.2° | 60.0° |
| H211 | C21 | C20 | H202 | 46.1° | 180.0° |
| H221 | C22 | C23 | H232 | 179.9° | 180.0° |
| H221 | C22 | C23 | H231 | 61.1° | 60.0° |
| H222 | C22 | C23 | H232 | 61.2° | 60.0° |
| H222 | C22 | C23 | H231 | 180.0° | 179.9° |
| H232 | C23 | C24 | H241 | 79.0° | 63.1° |
| H231 | C23 | C24 | H241 | 162.3° | 176.8° |
| H011 | C01 | C06 | H061 | 0.2° | 0.1° |
| H011 | C01 | C02 | H021 | 0.1° | 0.1° |
| H031 | C03 | C02 | H021 | 0.0° | 0.0° |
| H131 | C13 | C14 | H141 | 0.2° | 0.1° |
| H201 | C20 | N19 | H191 | 131.1° | 120.0° |
| H202 | C20 | N19 | H191 | 11.8° | 120.0° |
| H241 | C24 | C25 | H251 | 39.1° | 29.8° |
| H251 | C25 | C30 | H301 | 1.5° | 0.2° |
| H251 | C25 | N26 | H261 | 61.4° | 61.5° |
| H301 | C30 | C31 | H311 | 30.9° | 29.9° |
| H301 | C30 | C31 | H312 | 90.5° | 93.3° |
| H301 | C30 | N29 | H291 | 59.2° | 61.7° |
