YLH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O20 | S17 | doub | 1.42Å | 1.45Å | |
| S17 | O19 | doub | 1.42Å | 1.47Å | |
| S17 | C18 | sing | 1.81Å | 1.78Å | |
| S17 | C16 | sing | 1.81Å | 1.82Å | |
| C16 | C15 | sing | 1.51Å | 1.55Å | |
| C15 | C21 | doub | 1.38Å | 1.37Å | Aromatic |
| C15 | C13 | sing | 1.39Å | 1.37Å | Aromatic |
| F14 | C13 | sing | 1.35Å | 1.37Å | |
| C21 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.37Å | Aromatic |
| C22 | C11 | doub | 1.40Å | 1.38Å | Aromatic |
| C12 | C11 | sing | 1.40Å | 1.40Å | Aromatic |
| C11 | C10 | sing | 1.48Å | 1.50Å | |
| O08 | C07 | doub | 1.22Å | 1.30Å | |
| C07 | C06 | sing | 1.47Å | 1.47Å | |
| C07 | O09 | sing | 1.35Å | 1.26Å | |
| C10 | C06 | doub | 1.38Å | 1.37Å | Aromatic |
| C10 | C23 | sing | 1.47Å | 1.40Å | Aromatic |
| C06 | N05 | sing | 1.38Å | 1.34Å | Aromatic |
| C23 | C24 | doub | 1.40Å | 1.40Å | Aromatic |
| C23 | C04 | sing | 1.41Å | 1.40Å | Aromatic |
| C24 | C25 | sing | 1.37Å | 1.39Å | Aromatic |
| N05 | C04 | sing | 1.37Å | 1.36Å | Aromatic |
| C04 | C03 | doub | 1.39Å | 1.42Å | Aromatic |
| C25 | C26 | doub | 1.39Å | 1.42Å | Aromatic |
| O36 | C35 | doub | 1.21Å | 1.19Å | |
| C03 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C03 | C02 | sing | 1.51Å | 1.56Å | |
| C35 | O34 | sing | 1.34Å | 1.39Å | |
| C35 | N27 | sing | 1.34Å | 1.36Å | |
| O34 | C29 | sing | 1.46Å | 1.41Å | |
| C02 | N27 | sing | 1.47Å | 1.44Å | |
| C02 | C01 | sing | 1.53Å | 1.55Å | |
| N27 | C28 | sing | 1.47Å | 1.42Å | |
| C29 | C28 | sing | 1.54Å | 1.39Å | |
| C29 | C30 | sing | 1.53Å | 1.51Å | |
| C30 | C31 | sing | 1.53Å | 1.50Å | |
| C31 | C32 | sing | 1.53Å | 1.55Å | |
| C32 | N33 | sing | 1.47Å | 1.46Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H183 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H1 | sing | 1.09Å | 1.10Å | |
| C29 | H2 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| N05 | H051 | sing | 0.97Å | 1.00Å | |
| N33 | H332 | sing | 1.01Å | 1.00Å | |
| N33 | H331 | sing | 1.01Å | 1.00Å | |
| O09 | H4 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O20 | S17 | O19 | 116.3° | 119.2° |
| O20 | S17 | C18 | 104.1° | 108.6° |
| O20 | S17 | C16 | 109.6° | 108.6° |
| O19 | S17 | C18 | 110.5° | 108.6° |
| O19 | S17 | C16 | 107.5° | 108.6° |
| C18 | S17 | C16 | 108.7° | 101.9° |
| S17 | C18 | H181 | 109.5° | 109.5° |
| S17 | C18 | H183 | 109.5° | 109.5° |
| S17 | C18 | H182 | 109.5° | 109.5° |
| S17 | C16 | C15 | 110.6° | 109.4° |
| S17 | C16 | H162 | 109.2° | 109.5° |
| S17 | C16 | H161 | 109.2° | 109.5° |
| C16 | C15 | C21 | 123.9° | 119.9° |
| C16 | C15 | C13 | 120.1° | 119.9° |
| C15 | C16 | H162 | 109.2° | 109.4° |
| C15 | C16 | H161 | 109.2° | 109.5° |
| C21 | C15 | C13 | 115.9° | 120.3° |
| C15 | C21 | C22 | 125.1° | 120.1° |
| C15 | C21 | H211 | 117.4° | 120.0° |
| C15 | C13 | F14 | 121.3° | 120.0° |
| C15 | C13 | C12 | 121.2° | 120.1° |
| F14 | C13 | C12 | 117.3° | 119.9° |
| C21 | C22 | C11 | 118.1° | 119.9° |
| C22 | C21 | H211 | 117.5° | 119.9° |
| C21 | C22 | H221 | 121.0° | 120.0° |
| C13 | C12 | C11 | 121.6° | 119.8° |
| C13 | C12 | H121 | 119.2° | 120.1° |
| C22 | C11 | C12 | 117.8° | 119.7° |
| C22 | C11 | C10 | 121.2° | 120.1° |
| C11 | C22 | H221 | 120.9° | 120.1° |
| C12 | C11 | C10 | 120.9° | 120.1° |
| C11 | C12 | H121 | 119.2° | 120.1° |
| C11 | C10 | C06 | 126.0° | 126.8° |
| C11 | C10 | C23 | 127.1° | 126.8° |
| O08 | C07 | C06 | 115.7° | 120.0° |
| O08 | C07 | O09 | 123.1° | 120.0° |
| C06 | C07 | O09 | 120.8° | 120.0° |
| C07 | C06 | C10 | 131.3° | 125.5° |
| C07 | C06 | N05 | 118.2° | 125.6° |
| C07 | O09 | H4 | 109.5° | 114.0° |
| C06 | C10 | C23 | 106.6° | 106.5° |
| C10 | C06 | N05 | 110.1° | 109.0° |
| C10 | C23 | C24 | 134.2° | 133.6° |
| C10 | C23 | C04 | 106.6° | 106.4° |
| C06 | N05 | C04 | 108.4° | 110.1° |
| C06 | N05 | H051 | 125.8° | 125.0° |
| C24 | C23 | C04 | 119.0° | 120.0° |
| C23 | C24 | C25 | 118.0° | 119.8° |
| C23 | C24 | H241 | 121.0° | 120.1° |
| C23 | C04 | N05 | 108.1° | 108.0° |
| C23 | C04 | C03 | 123.7° | 119.2° |
| C24 | C25 | C26 | 123.0° | 120.5° |
| C25 | C24 | H241 | 121.0° | 120.1° |
| C24 | C25 | H251 | 118.5° | 119.7° |
| N05 | C04 | C03 | 128.1° | 132.9° |
| C04 | N05 | H051 | 125.8° | 124.9° |
| C04 | C03 | C26 | 116.4° | 119.9° |
| C04 | C03 | C02 | 118.5° | 120.0° |
| C25 | C26 | C03 | 119.7° | 120.7° |
| C26 | C25 | H251 | 118.5° | 119.8° |
| C25 | C26 | H261 | 120.1° | 119.7° |
| O36 | C35 | O34 | 123.0° | 123.0° |
| O36 | C35 | N27 | 129.7° | 123.2° |
| C26 | C03 | C02 | 125.1° | 120.1° |
| C03 | C26 | H261 | 120.1° | 119.7° |
| C03 | C02 | N27 | 108.9° | 109.5° |
| C03 | C02 | C01 | 109.0° | 109.4° |
| C03 | C02 | H021 | 108.4° | 109.5° |
| O34 | C35 | N27 | 107.0° | 113.8° |
| C35 | O34 | C29 | 107.3° | 109.4° |
| C35 | N27 | C02 | 119.9° | 125.5° |
| C35 | N27 | C28 | 111.7° | 108.9° |
| O34 | C29 | C28 | 110.2° | 104.0° |
| O34 | C29 | C30 | 121.7° | 110.5° |
| O34 | C29 | H2 | 90.2° | 110.6° |
| N27 | C02 | C01 | 112.2° | 109.5° |
| C02 | N27 | C28 | 128.0° | 125.5° |
| N27 | C02 | H021 | 109.8° | 109.5° |
| C02 | C01 | H012 | 109.5° | 109.4° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C01 | C02 | H021 | 108.4° | 109.5° |
| N27 | C28 | C29 | 103.6° | 103.9° |
| N27 | C28 | H281 | 110.9° | 110.6° |
| N27 | C28 | H1 | 110.9° | 110.6° |
| C28 | C29 | C30 | 128.2° | 110.5° |
| C29 | C28 | H281 | 110.9° | 110.6° |
| C29 | C28 | H1 | 110.9° | 110.5° |
| C28 | C29 | H2 | 90.1° | 110.5° |
| C29 | C30 | C31 | 110.2° | 109.5° |
| C30 | C29 | H2 | 90.2° | 110.5° |
| C29 | C30 | H301 | 109.3° | 109.4° |
| C29 | C30 | H302 | 109.3° | 109.5° |
| C30 | C31 | C32 | 106.8° | 109.5° |
| C31 | C30 | H301 | 109.3° | 109.5° |
| C31 | C30 | H302 | 109.3° | 109.5° |
| C30 | C31 | H312 | 110.1° | 109.5° |
| C30 | C31 | H311 | 110.1° | 109.5° |
| C31 | C32 | N33 | 108.2° | 109.5° |
| C32 | C31 | H312 | 110.1° | 109.4° |
| C32 | C31 | H311 | 110.1° | 109.5° |
| C31 | C32 | H322 | 109.8° | 109.4° |
| C31 | C32 | H321 | 109.8° | 109.5° |
| N33 | C32 | H322 | 109.8° | 109.5° |
| N33 | C32 | H321 | 109.8° | 109.5° |
| C32 | N33 | H332 | 109.5° | 111.0° |
| C32 | N33 | H331 | 109.5° | 111.1° |
| H012 | C01 | H011 | 109.5° | 109.5° |
| H012 | C01 | H013 | 109.5° | 109.4° |
| H011 | C01 | H013 | 109.5° | 109.5° |
| H162 | C16 | H161 | 109.5° | 109.5° |
| H181 | C18 | H183 | 109.5° | 109.4° |
| H181 | C18 | H182 | 109.5° | 109.4° |
| H183 | C18 | H182 | 109.4° | 109.5° |
| H281 | C28 | H1 | 109.5° | 110.5° |
| H301 | C30 | H302 | 109.5° | 109.5° |
| H312 | C31 | H311 | 109.5° | 109.5° |
| H322 | C32 | H321 | 109.5° | 109.5° |
| H332 | N33 | H331 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O20 | S17 | O19 | C18 | 118.3° | 125.0° |
| O20 | S17 | O19 | C16 | 123.3° | 125.0° |
| O20 | S17 | C18 | C16 | 116.7° | 114.5° |
| O20 | S17 | C16 | C15 | 176.6° | 65.5° |
| O20 | S17 | C16 | H162 | 63.2° | 54.4° |
| O20 | S17 | C16 | H161 | 56.5° | 174.5° |
| O20 | S17 | C18 | H181 | 180.0° | 54.5° |
| O20 | S17 | C18 | H183 | 60.0° | 174.5° |
| O20 | S17 | C18 | H182 | 60.0° | 65.5° |
| O19 | S17 | C18 | C16 | 117.7° | 114.5° |
| O19 | S17 | C16 | C15 | 56.1° | 65.5° |
| O19 | S17 | C16 | H162 | 64.1° | 174.5° |
| O19 | S17 | C16 | H161 | 176.3° | 54.5° |
| O19 | S17 | C18 | H181 | 54.5° | 174.5° |
| O19 | S17 | C18 | H183 | 174.5° | 54.5° |
| O19 | S17 | C18 | H182 | 65.5° | 65.5° |
| C18 | S17 | C16 | C15 | 63.5° | 180.0° |
| C18 | S17 | C16 | H162 | 176.3° | 60.0° |
| C18 | S17 | C16 | H161 | 56.7° | 60.0° |
| S17 | C18 | H181 | H183 | 120.0° | 120.0° |
| S17 | C18 | H181 | H182 | 120.0° | 120.0° |
| S17 | C18 | H183 | H182 | 120.0° | 120.0° |
| S17 | C16 | C15 | H162 | 120.2° | 120.0° |
| S17 | C16 | C15 | H161 | 120.2° | 120.0° |
| S17 | C16 | C15 | C21 | 83.4° | 90.0° |
| S17 | C16 | C15 | C13 | 93.4° | 89.8° |
| S17 | C16 | H162 | H161 | 119.5° | 120.0° |
| C16 | S17 | C18 | H181 | 63.3° | 60.0° |
| C16 | S17 | C18 | H183 | 56.8° | 60.0° |
| C16 | S17 | C18 | H182 | 176.7° | 180.0° |
| C16 | C15 | C21 | C13 | 177.0° | 179.8° |
| C16 | C15 | C13 | F14 | 3.7° | 0.2° |
| C16 | C15 | C21 | C22 | 179.1° | 180.0° |
| C16 | C15 | C13 | C12 | 179.6° | 179.7° |
| C15 | C16 | H162 | H161 | 119.5° | 120.0° |
| C16 | C15 | C21 | H211 | 1.0° | 0.2° |
| C21 | C15 | C13 | F14 | 173.4° | 180.0° |
| C15 | C21 | C22 | H211 | 180.0° | 179.7° |
| C21 | C15 | C13 | C12 | 2.5° | 0.0° |
| C15 | C21 | C22 | C11 | 4.4° | 0.5° |
| C21 | C15 | C16 | H162 | 36.8° | 150.0° |
| C21 | C15 | C16 | H161 | 156.4° | 30.0° |
| C15 | C21 | C22 | H221 | 175.6° | 180.0° |
| C15 | C13 | F14 | C12 | 176.1° | 179.9° |
| C13 | C15 | C21 | C22 | 4.0° | 0.3° |
| C15 | C13 | C12 | C11 | 1.8° | 0.1° |
| C15 | C13 | C12 | H121 | 178.2° | 179.9° |
| C13 | C15 | C16 | H162 | 146.4° | 30.2° |
| C13 | C15 | C16 | H161 | 26.7° | 150.2° |
| C13 | C15 | C21 | H211 | 176.0° | 180.0° |
| F14 | C13 | C12 | C11 | 174.3° | 180.0° |
| F14 | C13 | C12 | H121 | 5.7° | 0.0° |
| C21 | C22 | C11 | H221 | 180.0° | 179.5° |
| C21 | C22 | C11 | C12 | 3.2° | 0.5° |
| C21 | C22 | C11 | C10 | 179.0° | 179.7° |
| C13 | C12 | C11 | C22 | 2.0° | 0.2° |
| C13 | C12 | C11 | H121 | 180.0° | 180.0° |
| C13 | C12 | C11 | C10 | 179.9° | 180.0° |
| C22 | C11 | C12 | C10 | 177.8° | 179.8° |
| C22 | C11 | C10 | C06 | 142.4° | 115.3° |
| C22 | C11 | C10 | C23 | 45.3° | 64.8° |
| C22 | C11 | C12 | H121 | 178.0° | 179.8° |
| C11 | C22 | C21 | H211 | 175.6° | 179.7° |
| C12 | C11 | C10 | C06 | 39.9° | 64.9° |
| C12 | C11 | C10 | C23 | 132.5° | 115.0° |
| C12 | C11 | C22 | H221 | 176.8° | 180.0° |
| C11 | C10 | C06 | C07 | 14.8° | 0.0° |
| C11 | C10 | C06 | C23 | 173.6° | 179.9° |
| C11 | C10 | C06 | N05 | 173.8° | 179.9° |
| C11 | C10 | C23 | C24 | 7.8° | 0.1° |
| C11 | C10 | C23 | C04 | 176.2° | 180.0° |
| C10 | C11 | C12 | H121 | 0.1° | 0.0° |
| C10 | C11 | C22 | H221 | 1.0° | 0.3° |
| O08 | C07 | C06 | O09 | 172.6° | 180.0° |
| O08 | C07 | C06 | C10 | 31.4° | 0.0° |
| O08 | C07 | C06 | N05 | 139.4° | 180.0° |
| O08 | C07 | O09 | H4 | 0.0° | 0.0° |
| C07 | C06 | C10 | N05 | 171.3° | 180.0° |
| C07 | C06 | C10 | C23 | 171.6° | 180.0° |
| C07 | C06 | N05 | C04 | 170.2° | 180.0° |
| C07 | C06 | N05 | H051 | 9.8° | 0.0° |
| C06 | C07 | O09 | H4 | 172.0° | 180.0° |
| O09 | C07 | C06 | C10 | 156.0° | 180.0° |
| O09 | C07 | C06 | N05 | 33.2° | 0.0° |
| C06 | C10 | C23 | C24 | 178.7° | 180.0° |
| C06 | C10 | C23 | C04 | 2.7° | 0.0° |
| C10 | C06 | N05 | C04 | 2.5° | 0.0° |
| C10 | C06 | N05 | H051 | 177.6° | 180.0° |
| C23 | C10 | C06 | N05 | 0.2° | 0.0° |
| C10 | C23 | C24 | C04 | 175.6° | 180.0° |
| C10 | C23 | C24 | C25 | 172.6° | 180.0° |
| C10 | C23 | C04 | N05 | 4.2° | 0.0° |
| C10 | C23 | C04 | C03 | 175.8° | 180.0° |
| C10 | C23 | C24 | H241 | 7.4° | 0.0° |
| C06 | N05 | C04 | C23 | 4.2° | 0.0° |
| C06 | N05 | C04 | H051 | 180.0° | 180.0° |
| C06 | N05 | C04 | C03 | 175.9° | 180.0° |
| C23 | C24 | C25 | H241 | 180.0° | 180.0° |
| C24 | C23 | C04 | N05 | 179.0° | 180.0° |
| C24 | C23 | C04 | C03 | 0.9° | 0.0° |
| C23 | C24 | C25 | C26 | 4.1° | 0.1° |
| C23 | C24 | C25 | H251 | 175.9° | 180.0° |
| C04 | C23 | C24 | C25 | 3.0° | 0.1° |
| C23 | C04 | N05 | C03 | 179.9° | 180.0° |
| C23 | C04 | C03 | C26 | 0.4° | 0.0° |
| C23 | C04 | C03 | C02 | 178.3° | 179.7° |
| C04 | C23 | C24 | H241 | 177.0° | 180.0° |
| C23 | C04 | N05 | H051 | 175.9° | 180.0° |
| C24 | C25 | C26 | H251 | 180.0° | 179.9° |
| C24 | C25 | C26 | C03 | 2.8° | 0.0° |
| C24 | C25 | C26 | H261 | 177.2° | 179.7° |
| N05 | C04 | C03 | C26 | 179.7° | 180.0° |
| N05 | C04 | C03 | C02 | 1.6° | 0.3° |
| C04 | C03 | C26 | C25 | 0.5° | 0.0° |
| C04 | C03 | C26 | C02 | 178.6° | 179.7° |
| C04 | C03 | C02 | N27 | 101.2° | 76.1° |
| C04 | C03 | C02 | C01 | 136.1° | 163.9° |
| C04 | C03 | C02 | H021 | 18.3° | 43.9° |
| C04 | C03 | C26 | H261 | 179.5° | 179.7° |
| C03 | C04 | N05 | H051 | 4.1° | 0.0° |
| C25 | C26 | C03 | H261 | 180.0° | 179.7° |
| C25 | C26 | C03 | C02 | 179.1° | 179.7° |
| C26 | C25 | C24 | H241 | 175.9° | 180.0° |
| O36 | C35 | O34 | N27 | 174.4° | 179.9° |
| O36 | C35 | O34 | C29 | 178.3° | 180.0° |
| O36 | C35 | N27 | C02 | 8.2° | 0.1° |
| O36 | C35 | N27 | C28 | 179.1° | 179.9° |
| C26 | C03 | C02 | N27 | 80.2° | 104.2° |
| C26 | C03 | C02 | C01 | 42.5° | 15.8° |
| C26 | C03 | C02 | H021 | 160.3° | 135.8° |
| C03 | C26 | C25 | H251 | 177.2° | 180.0° |
| C03 | C02 | N27 | C35 | 81.2° | 59.7° |
| C03 | C02 | N27 | C01 | 120.8° | 120.0° |
| C03 | C02 | N27 | H021 | 118.6° | 120.0° |
| C03 | C02 | C01 | H021 | 117.8° | 120.0° |
| C03 | C02 | N27 | C28 | 90.2° | 120.3° |
| C03 | C02 | C01 | H012 | 180.0° | 60.0° |
| C03 | C02 | C01 | H011 | 60.0° | 60.0° |
| C03 | C02 | C01 | H013 | 60.0° | 179.9° |
| C02 | C03 | C26 | H261 | 0.9° | 0.0° |
| O34 | C35 | N27 | C02 | 177.9° | 180.0° |
| O34 | C35 | N27 | C28 | 5.2° | 0.0° |
| C35 | O34 | C29 | C28 | 1.3° | 0.1° |
| C35 | O34 | C29 | C30 | 179.2° | 118.7° |
| C35 | O34 | C29 | H2 | 88.9° | 118.6° |
| N27 | C35 | O34 | C29 | 3.9° | 0.0° |
| C35 | N27 | C02 | C28 | 171.4° | 180.0° |
| C35 | N27 | C02 | C01 | 158.0° | 60.2° |
| C35 | N27 | C28 | C29 | 4.3° | 0.1° |
| C35 | N27 | C02 | H021 | 37.4° | 179.7° |
| C35 | N27 | C28 | H281 | 114.7° | 118.6° |
| C35 | N27 | C28 | H1 | 123.3° | 118.7° |
| O34 | C29 | C28 | N27 | 1.7° | 0.1° |
| O34 | C29 | C28 | C30 | 179.5° | 118.6° |
| O34 | C29 | C28 | H2 | 90.2° | 118.8° |
| O34 | C29 | C30 | H2 | 90.3° | 122.8° |
| O34 | C29 | C30 | C31 | 58.2° | 70.4° |
| O34 | C29 | C28 | H281 | 117.3° | 118.6° |
| O34 | C29 | C28 | H1 | 120.8° | 118.7° |
| O34 | C29 | C30 | H301 | 61.9° | 169.6° |
| O34 | C29 | C30 | H302 | 178.3° | 49.6° |
| N27 | C02 | C01 | H021 | 121.5° | 120.1° |
| C02 | N27 | C28 | C29 | 176.2° | 179.9° |
| N27 | C02 | C01 | H012 | 59.3° | 60.0° |
| N27 | C02 | C01 | H011 | 60.7° | 180.0° |
| N27 | C02 | C01 | H013 | 179.3° | 60.0° |
| C02 | N27 | C28 | H281 | 57.2° | 61.4° |
| C02 | N27 | C28 | H1 | 64.7° | 61.3° |
| C01 | C02 | N27 | C28 | 30.6° | 119.8° |
| C02 | C01 | H012 | H011 | 120.0° | 120.0° |
| C02 | C01 | H012 | H013 | 120.0° | 120.0° |
| C02 | C01 | H011 | H013 | 120.0° | 120.1° |
| N27 | C28 | C29 | H281 | 119.0° | 118.7° |
| N27 | C28 | C29 | H1 | 119.1° | 118.6° |
| N27 | C28 | C29 | C30 | 177.8° | 118.7° |
| C28 | N27 | C02 | H021 | 151.3° | 0.3° |
| N27 | C28 | H281 | H1 | 122.8° | 122.7° |
| N27 | C28 | C29 | H2 | 91.9° | 118.7° |
| C28 | C29 | C30 | H2 | 90.3° | 122.7° |
| C28 | C29 | C30 | C31 | 121.2° | 175.0° |
| C29 | C28 | H281 | H1 | 122.7° | 122.7° |
| C28 | C29 | C30 | H301 | 118.7° | 55.0° |
| C28 | C29 | C30 | H302 | 1.1° | 65.0° |
| C29 | C30 | C31 | H301 | 120.1° | 120.0° |
| C29 | C30 | C31 | H302 | 120.1° | 120.0° |
| C29 | C30 | C31 | C32 | 170.7° | 180.0° |
| C30 | C29 | C28 | H281 | 63.2° | 0.0° |
| C30 | C29 | C28 | H1 | 58.7° | 122.7° |
| C29 | C30 | H301 | H302 | 119.7° | 120.0° |
| C29 | C30 | C31 | H312 | 69.7° | 60.0° |
| C29 | C30 | C31 | H311 | 51.1° | 59.9° |
| C30 | C31 | C32 | H312 | 119.6° | 120.0° |
| C30 | C31 | C32 | H311 | 119.6° | 120.0° |
| C30 | C31 | C32 | N33 | 179.1° | 180.0° |
| C31 | C30 | C29 | H2 | 148.5° | 52.3° |
| C31 | C30 | H301 | H302 | 119.7° | 120.0° |
| C30 | C31 | H312 | H311 | 121.2° | 120.0° |
| C30 | C31 | C32 | H322 | 61.1° | 60.0° |
| C30 | C31 | C32 | H321 | 59.3° | 60.0° |
| C31 | C32 | N33 | H322 | 119.8° | 120.0° |
| C31 | C32 | N33 | H321 | 119.8° | 120.0° |
| C32 | C31 | C30 | H301 | 50.6° | 60.0° |
| C32 | C31 | C30 | H302 | 69.2° | 60.0° |
| C32 | C31 | H312 | H311 | 121.2° | 120.0° |
| C31 | C32 | H322 | H321 | 120.6° | 120.0° |
| C31 | C32 | N33 | H332 | 180.0° | 56.0° |
| C31 | C32 | N33 | H331 | 60.0° | 180.0° |
| N33 | C32 | C31 | H312 | 59.5° | 60.0° |
| N33 | C32 | C31 | H311 | 61.4° | 60.0° |
| N33 | C32 | H322 | H321 | 120.6° | 120.0° |
| C32 | N33 | H332 | H331 | 120.0° | 124.0° |
| H012 | C01 | H011 | H013 | 120.0° | 120.0° |
| H012 | C01 | C02 | H021 | 62.2° | 180.0° |
| H011 | C01 | C02 | H021 | 177.8° | 60.0° |
| H013 | C01 | C02 | H021 | 57.8° | 60.1° |
| H181 | C18 | H183 | H182 | 120.0° | 119.9° |
| H211 | C21 | C22 | H221 | 4.4° | 0.3° |
| H241 | C24 | C25 | H251 | 4.0° | 0.1° |
| H251 | C25 | C26 | H261 | 2.8° | 0.4° |
| H281 | C28 | C29 | H2 | 27.1° | 122.6° |
| H1 | C28 | C29 | H2 | 149.0° | 0.1° |
| H2 | C29 | C30 | H301 | 28.4° | 67.6° |
| H2 | C29 | C30 | H302 | 91.4° | 172.4° |
| H301 | C30 | C31 | H312 | 170.2° | 180.0° |
| H301 | C30 | C31 | H311 | 69.0° | 60.0° |
| H302 | C30 | C31 | H312 | 50.4° | 60.0° |
| H302 | C30 | C31 | H311 | 171.2° | 180.0° |
| H312 | C31 | C32 | H322 | 179.2° | 180.0° |
| H312 | C31 | C32 | H321 | 60.3° | 60.0° |
| H311 | C31 | C32 | H322 | 58.4° | 60.0° |
| H311 | C31 | C32 | H321 | 178.8° | 180.0° |
| H322 | C32 | N33 | H332 | 60.2° | 64.0° |
| H322 | C32 | N33 | H331 | 179.8° | 60.0° |
| H321 | C32 | N33 | H332 | 60.2° | 176.0° |
| H321 | C32 | N33 | H331 | 59.8° | 60.0° |
