XZL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O29 | S26 | doub | 1.42Å | 1.46Å | |
| O28 | S26 | doub | 1.42Å | 1.47Å | |
| S26 | C27 | sing | 1.81Å | 1.81Å | |
| S26 | C25 | sing | 1.81Å | 1.82Å | |
| C25 | C24 | sing | 1.51Å | 1.53Å | |
| C24 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C22 | sing | 1.39Å | 1.39Å | Aromatic |
| C30 | C31 | sing | 1.38Å | 1.38Å | Aromatic |
| F23 | C22 | sing | 1.35Å | 1.37Å | |
| C22 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C31 | C20 | doub | 1.40Å | 1.37Å | Aromatic |
| C21 | C20 | sing | 1.40Å | 1.40Å | Aromatic |
| C20 | C19 | sing | 1.48Å | 1.52Å | |
| O17 | C16 | doub | 1.22Å | 1.27Å | |
| C16 | C15 | sing | 1.47Å | 1.49Å | |
| C16 | O18 | sing | 1.35Å | 1.26Å | |
| C19 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | C32 | sing | 1.47Å | 1.41Å | Aromatic |
| C15 | N14 | sing | 1.38Å | 1.32Å | Aromatic |
| C32 | C33 | doub | 1.40Å | 1.41Å | Aromatic |
| C32 | C13 | sing | 1.41Å | 1.39Å | Aromatic |
| C33 | C34 | sing | 1.37Å | 1.39Å | Aromatic |
| N14 | C13 | sing | 1.38Å | 1.35Å | Aromatic |
| C13 | C12 | doub | 1.39Å | 1.41Å | Aromatic |
| C34 | C35 | doub | 1.39Å | 1.41Å | Aromatic |
| C12 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C02 | sing | 1.51Å | 1.54Å | |
| C06 | C05 | doub | 1.38Å | 1.38Å | Aromatic |
| C06 | C07 | sing | 1.38Å | 1.38Å | Aromatic |
| C05 | C04 | sing | 1.39Å | 1.39Å | Aromatic |
| C02 | C01 | sing | 1.53Å | 1.56Å | |
| C02 | O03 | sing | 1.43Å | 1.38Å | |
| C08 | C07 | sing | 1.51Å | 1.53Å | |
| C08 | N09 | sing | 1.47Å | 1.45Å | |
| C07 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C04 | O03 | sing | 1.36Å | 1.41Å | |
| C04 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
| C10 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H273 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| C34 | H341 | sing | 1.08Å | 1.08Å | |
| C35 | H351 | sing | 1.08Å | 1.08Å | |
| N09 | H092 | sing | 1.01Å | 1.00Å | |
| N09 | H091 | sing | 1.01Å | 1.00Å | |
| N14 | H141 | sing | 0.97Å | 1.00Å | |
| O18 | H2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O29 | S26 | O28 | 105.3° | 119.2° |
| O29 | S26 | C27 | 107.7° | 108.6° |
| O29 | S26 | C25 | 113.2° | 108.6° |
| O28 | S26 | C27 | 112.4° | 108.6° |
| O28 | S26 | C25 | 110.6° | 108.6° |
| C27 | S26 | C25 | 107.7° | 102.0° |
| S26 | C27 | H272 | 109.5° | 109.5° |
| S26 | C27 | H271 | 109.4° | 109.5° |
| S26 | C27 | H273 | 109.5° | 109.5° |
| S26 | C25 | C24 | 112.9° | 109.5° |
| S26 | C25 | H252 | 108.6° | 109.5° |
| S26 | C25 | H251 | 108.6° | 109.5° |
| C25 | C24 | C30 | 120.1° | 119.9° |
| C25 | C24 | C22 | 121.3° | 119.8° |
| C24 | C25 | H252 | 108.6° | 109.5° |
| C24 | C25 | H251 | 108.6° | 109.4° |
| C30 | C24 | C22 | 118.6° | 120.3° |
| C24 | C30 | C31 | 122.2° | 120.2° |
| C24 | C30 | H301 | 118.9° | 119.9° |
| C24 | C22 | F23 | 122.2° | 120.0° |
| C24 | C22 | C21 | 119.3° | 120.1° |
| C30 | C31 | C20 | 119.5° | 119.9° |
| C31 | C30 | H301 | 118.9° | 119.9° |
| C30 | C31 | H311 | 120.3° | 120.1° |
| F23 | C22 | C21 | 118.5° | 119.9° |
| C22 | C21 | C20 | 121.3° | 119.9° |
| C22 | C21 | H211 | 119.3° | 120.1° |
| C31 | C20 | C21 | 119.2° | 119.7° |
| C31 | C20 | C19 | 123.1° | 120.1° |
| C20 | C31 | H311 | 120.3° | 120.0° |
| C21 | C20 | C19 | 117.6° | 120.2° |
| C20 | C21 | H211 | 119.4° | 120.0° |
| C20 | C19 | C15 | 127.6° | 126.8° |
| C20 | C19 | C32 | 126.5° | 126.8° |
| O17 | C16 | C15 | 115.6° | 120.0° |
| O17 | C16 | O18 | 123.1° | 120.0° |
| C15 | C16 | O18 | 121.0° | 120.0° |
| C16 | C15 | C19 | 128.6° | 125.5° |
| C16 | C15 | N14 | 122.0° | 125.5° |
| C16 | O18 | H2 | 109.5° | 114.0° |
| C15 | C19 | C32 | 105.8° | 106.4° |
| C19 | C15 | N14 | 109.3° | 109.0° |
| C19 | C32 | C33 | 133.8° | 133.6° |
| C19 | C32 | C13 | 106.9° | 106.5° |
| C15 | N14 | C13 | 110.2° | 110.1° |
| C15 | N14 | H141 | 124.9° | 124.9° |
| C33 | C32 | C13 | 119.3° | 119.9° |
| C32 | C33 | C34 | 118.6° | 119.8° |
| C32 | C33 | H331 | 120.7° | 120.1° |
| C32 | C13 | N14 | 107.8° | 108.0° |
| C32 | C13 | C12 | 122.2° | 119.2° |
| C33 | C34 | C35 | 121.9° | 120.5° |
| C34 | C33 | H331 | 120.7° | 120.1° |
| C33 | C34 | H341 | 119.0° | 119.7° |
| N14 | C13 | C12 | 130.0° | 132.8° |
| C13 | N14 | H141 | 124.9° | 125.0° |
| C13 | C12 | C35 | 118.2° | 119.9° |
| C13 | C12 | C02 | 119.0° | 120.0° |
| C34 | C35 | C12 | 119.8° | 120.7° |
| C35 | C34 | H341 | 119.1° | 119.7° |
| C34 | C35 | H351 | 120.1° | 119.7° |
| C35 | C12 | C02 | 122.8° | 120.1° |
| C12 | C35 | H351 | 120.1° | 119.6° |
| C12 | C02 | C01 | 106.4° | 109.5° |
| C12 | C02 | O03 | 117.0° | 109.4° |
| C12 | C02 | H021 | 108.6° | 109.5° |
| C05 | C06 | C07 | 120.1° | 120.0° |
| C06 | C05 | C04 | 119.7° | 119.9° |
| C06 | C05 | H051 | 120.1° | 120.0° |
| C05 | C06 | H061 | 119.9° | 120.0° |
| C06 | C07 | C08 | 119.4° | 119.9° |
| C06 | C07 | C10 | 120.6° | 120.1° |
| C07 | C06 | H061 | 119.9° | 120.0° |
| C05 | C04 | O03 | 124.7° | 120.0° |
| C05 | C04 | C11 | 119.5° | 119.9° |
| C04 | C05 | H051 | 120.1° | 120.0° |
| C01 | C02 | O03 | 105.0° | 109.4° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C01 | C02 | H021 | 108.4° | 109.5° |
| C02 | O03 | C04 | 117.6° | 117.0° |
| O03 | C02 | H021 | 110.9° | 109.5° |
| C07 | C08 | N09 | 111.6° | 109.4° |
| C08 | C07 | C10 | 120.1° | 120.0° |
| C07 | C08 | H082 | 108.9° | 109.5° |
| C07 | C08 | H081 | 108.9° | 109.5° |
| N09 | C08 | H082 | 108.9° | 109.5° |
| N09 | C08 | H081 | 108.9° | 109.5° |
| C08 | N09 | H092 | 109.5° | 111.0° |
| C08 | N09 | H091 | 109.5° | 111.1° |
| C07 | C10 | C11 | 119.3° | 120.1° |
| C07 | C10 | H101 | 120.3° | 119.9° |
| O03 | C04 | C11 | 115.8° | 120.1° |
| C04 | C11 | C10 | 120.7° | 120.0° |
| C04 | C11 | H111 | 119.6° | 120.0° |
| C11 | C10 | H101 | 120.4° | 120.0° |
| C10 | C11 | H111 | 119.6° | 120.0° |
| H013 | C01 | H011 | 109.4° | 109.5° |
| H013 | C01 | H012 | 109.5° | 109.4° |
| H011 | C01 | H012 | 109.5° | 109.5° |
| H082 | C08 | H081 | 109.5° | 109.5° |
| H252 | C25 | H251 | 109.4° | 109.4° |
| H272 | C27 | H271 | 109.4° | 109.4° |
| H272 | C27 | H273 | 109.5° | 109.5° |
| H271 | C27 | H273 | 109.5° | 109.4° |
| H092 | N09 | H091 | 109.4° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O29 | S26 | O28 | C27 | 117.0° | 124.9° |
| O29 | S26 | O28 | C25 | 122.7° | 124.9° |
| O29 | S26 | C27 | C25 | 122.4° | 114.5° |
| O29 | S26 | C25 | C24 | 171.6° | 65.5° |
| O29 | S26 | C25 | H252 | 67.8° | 54.5° |
| O29 | S26 | C25 | H251 | 51.1° | 174.5° |
| O29 | S26 | C27 | H272 | 180.0° | 65.5° |
| O29 | S26 | C27 | H271 | 60.0° | 54.5° |
| O29 | S26 | C27 | H273 | 60.0° | 174.5° |
| O28 | S26 | C27 | C25 | 122.0° | 114.5° |
| O28 | S26 | C25 | C24 | 70.5° | 65.4° |
| O28 | S26 | C25 | H252 | 50.1° | 174.5° |
| O28 | S26 | C25 | H251 | 169.0° | 54.6° |
| O28 | S26 | C27 | H272 | 64.5° | 65.5° |
| O28 | S26 | C27 | H271 | 175.6° | 174.5° |
| O28 | S26 | C27 | H273 | 55.5° | 54.6° |
| C27 | S26 | C25 | C24 | 52.7° | 180.0° |
| C27 | S26 | C25 | H252 | 173.2° | 60.0° |
| C27 | S26 | C25 | H251 | 67.8° | 60.0° |
| S26 | C27 | H272 | H271 | 120.0° | 120.0° |
| S26 | C27 | H272 | H273 | 120.0° | 120.0° |
| S26 | C27 | H271 | H273 | 120.0° | 120.0° |
| S26 | C25 | C24 | H252 | 120.5° | 120.0° |
| S26 | C25 | C24 | H251 | 120.5° | 120.0° |
| S26 | C25 | C24 | C30 | 89.0° | 89.9° |
| S26 | C25 | C24 | C22 | 91.9° | 89.7° |
| S26 | C25 | H252 | H251 | 118.4° | 120.0° |
| C25 | S26 | C27 | H272 | 57.6° | 180.0° |
| C25 | S26 | C27 | H271 | 62.4° | 60.0° |
| C25 | S26 | C27 | H273 | 177.6° | 60.0° |
| C25 | C24 | C30 | C22 | 179.1° | 179.7° |
| C25 | C24 | C30 | C31 | 179.6° | 180.0° |
| C25 | C24 | C22 | F23 | 0.7° | 0.3° |
| C25 | C24 | C22 | C21 | 179.7° | 179.7° |
| C24 | C25 | H252 | H251 | 118.4° | 119.9° |
| C25 | C24 | C30 | H301 | 0.4° | 0.3° |
| C24 | C30 | C31 | H301 | 180.0° | 179.7° |
| C30 | C24 | C22 | F23 | 179.7° | 179.9° |
| C30 | C24 | C22 | C21 | 0.6° | 0.0° |
| C24 | C30 | C31 | C20 | 0.8° | 0.6° |
| C30 | C24 | C25 | H252 | 31.5° | 150.0° |
| C30 | C24 | C25 | H251 | 150.4° | 30.1° |
| C24 | C30 | C31 | H311 | 179.2° | 180.0° |
| C22 | C24 | C30 | C31 | 0.6° | 0.3° |
| C24 | C22 | F23 | C21 | 179.6° | 180.0° |
| C24 | C22 | C21 | C20 | 0.6° | 0.0° |
| C24 | C22 | C21 | H211 | 179.4° | 180.0° |
| C22 | C24 | C25 | H252 | 147.5° | 30.3° |
| C22 | C24 | C25 | H251 | 28.6° | 150.2° |
| C22 | C24 | C30 | H301 | 179.5° | 180.0° |
| C30 | C31 | C20 | H311 | 180.0° | 179.4° |
| C30 | C31 | C20 | C21 | 2.0° | 0.6° |
| C30 | C31 | C20 | C19 | 178.3° | 179.7° |
| F23 | C22 | C21 | C20 | 179.0° | 180.0° |
| F23 | C22 | C21 | H211 | 1.0° | 0.0° |
| C22 | C21 | C20 | C31 | 2.0° | 0.3° |
| C22 | C21 | C20 | H211 | 180.0° | 180.0° |
| C22 | C21 | C20 | C19 | 178.4° | 180.0° |
| C31 | C20 | C21 | C19 | 176.5° | 179.7° |
| C31 | C20 | C19 | C15 | 135.7° | 115.3° |
| C31 | C20 | C19 | C32 | 48.9° | 64.7° |
| C31 | C20 | C21 | H211 | 178.0° | 179.7° |
| C20 | C31 | C30 | H301 | 179.2° | 179.7° |
| C21 | C20 | C19 | C15 | 48.0° | 65.0° |
| C21 | C20 | C19 | C32 | 127.5° | 115.0° |
| C21 | C20 | C31 | H311 | 178.0° | 180.0° |
| C20 | C19 | C15 | C16 | 6.6° | 0.0° |
| C20 | C19 | C15 | C32 | 176.2° | 180.0° |
| C20 | C19 | C15 | N14 | 177.3° | 180.0° |
| C20 | C19 | C32 | C33 | 2.4° | 0.0° |
| C20 | C19 | C32 | C13 | 177.7° | 179.9° |
| C19 | C20 | C21 | H211 | 1.6° | 0.0° |
| C19 | C20 | C31 | H311 | 1.8° | 0.3° |
| O17 | C16 | C15 | O18 | 173.7° | 180.0° |
| O17 | C16 | C15 | C19 | 40.9° | 0.0° |
| O17 | C16 | C15 | N14 | 134.8° | 180.0° |
| O17 | C16 | O18 | H2 | 0.0° | 0.0° |
| C16 | C15 | C19 | N14 | 176.1° | 180.0° |
| C16 | C15 | C19 | C32 | 177.2° | 180.0° |
| C16 | C15 | N14 | C13 | 176.8° | 180.0° |
| C16 | C15 | N14 | H141 | 3.3° | 0.0° |
| C15 | C16 | O18 | H2 | 173.2° | 180.0° |
| O18 | C16 | C15 | C19 | 145.4° | 180.0° |
| O18 | C16 | C15 | N14 | 38.9° | 0.0° |
| C15 | C19 | C32 | C33 | 178.6° | 180.0° |
| C15 | C19 | C32 | C13 | 1.4° | 0.0° |
| C19 | C15 | N14 | C13 | 0.3° | 0.0° |
| C19 | C15 | N14 | H141 | 179.7° | 180.0° |
| C32 | C19 | C15 | N14 | 1.1° | 0.0° |
| C19 | C32 | C33 | C13 | 179.9° | 180.0° |
| C19 | C32 | C33 | C34 | 178.8° | 180.0° |
| C19 | C32 | C13 | N14 | 1.3° | 0.0° |
| C19 | C32 | C13 | C12 | 179.0° | 180.0° |
| C19 | C32 | C33 | H331 | 1.2° | 0.0° |
| C15 | N14 | C13 | C32 | 0.6° | 0.0° |
| C15 | N14 | C13 | H141 | 180.0° | 180.0° |
| C15 | N14 | C13 | C12 | 179.7° | 180.0° |
| C32 | C33 | C34 | H331 | 180.0° | 180.0° |
| C33 | C32 | C13 | N14 | 178.8° | 180.0° |
| C33 | C32 | C13 | C12 | 0.9° | 0.0° |
| C32 | C33 | C34 | C35 | 1.5° | 0.0° |
| C32 | C33 | C34 | H341 | 178.5° | 180.0° |
| C13 | C32 | C33 | C34 | 1.1° | 0.0° |
| C32 | C13 | N14 | C12 | 179.7° | 180.0° |
| C32 | C13 | C12 | C35 | 1.1° | 0.0° |
| C32 | C13 | C12 | C02 | 178.4° | 179.8° |
| C13 | C32 | C33 | H331 | 178.9° | 180.0° |
| C32 | C13 | N14 | H141 | 179.4° | 180.0° |
| C33 | C34 | C35 | H341 | 180.0° | 180.0° |
| C33 | C34 | C35 | C12 | 1.8° | 0.1° |
| C33 | C34 | C35 | H351 | 178.2° | 179.7° |
| N14 | C13 | C12 | C35 | 178.5° | 180.0° |
| N14 | C13 | C12 | C02 | 1.2° | 0.3° |
| C13 | C12 | C35 | C34 | 1.5° | 0.0° |
| C13 | C12 | C35 | C02 | 177.1° | 179.7° |
| C13 | C12 | C02 | C01 | 92.1° | 84.8° |
| C13 | C12 | C02 | O03 | 150.9° | 155.3° |
| C13 | C12 | C02 | H021 | 24.5° | 35.3° |
| C13 | C12 | C35 | H351 | 178.5° | 179.6° |
| C12 | C13 | N14 | H141 | 0.3° | 0.0° |
| C34 | C35 | C12 | H351 | 180.0° | 179.6° |
| C34 | C35 | C12 | C02 | 178.7° | 179.7° |
| C35 | C34 | C33 | H331 | 178.5° | 180.0° |
| C35 | C12 | C02 | C01 | 85.1° | 95.0° |
| C35 | C12 | C02 | O03 | 31.9° | 24.9° |
| C35 | C12 | C02 | H021 | 158.4° | 144.9° |
| C12 | C35 | C34 | H341 | 178.2° | 180.0° |
| C12 | C02 | C01 | O03 | 124.7° | 119.9° |
| C12 | C02 | C01 | H021 | 116.7° | 120.1° |
| C12 | C02 | O03 | H021 | 125.3° | 120.0° |
| C12 | C02 | O03 | C04 | 91.5° | 155.2° |
| C12 | C02 | C01 | H013 | 180.0° | 60.1° |
| C12 | C02 | C01 | H011 | 60.0° | 180.0° |
| C12 | C02 | C01 | H012 | 60.0° | 59.9° |
| C02 | C12 | C35 | H351 | 1.3° | 0.1° |
| C05 | C06 | C07 | H061 | 180.0° | 180.0° |
| C06 | C05 | C04 | H051 | 180.0° | 179.9° |
| C05 | C06 | C07 | C08 | 179.9° | 180.0° |
| C05 | C06 | C07 | C10 | 0.0° | 0.0° |
| C06 | C05 | C04 | O03 | 179.0° | 180.0° |
| C06 | C05 | C04 | C11 | 0.1° | 0.3° |
| C07 | C06 | C05 | C04 | 0.2° | 0.1° |
| C06 | C07 | C08 | C10 | 179.9° | 180.0° |
| C06 | C07 | C08 | N09 | 149.6° | 90.0° |
| C06 | C07 | C10 | C11 | 0.1° | 0.2° |
| C07 | C06 | C05 | H051 | 179.9° | 179.9° |
| C06 | C07 | C08 | H082 | 29.3° | 150.0° |
| C06 | C07 | C08 | H081 | 90.0° | 30.0° |
| C06 | C07 | C10 | H101 | 179.9° | 180.0° |
| C05 | C04 | O03 | C02 | 11.8° | 5.1° |
| C05 | C04 | O03 | C11 | 179.2° | 179.6° |
| C05 | C04 | C11 | C10 | 0.0° | 0.6° |
| C04 | C05 | C06 | H061 | 179.8° | 180.0° |
| C05 | C04 | C11 | H111 | 180.0° | 179.7° |
| C01 | C02 | O03 | H021 | 116.9° | 120.0° |
| C01 | C02 | O03 | C04 | 150.8° | 84.8° |
| C02 | C01 | H013 | H011 | 120.0° | 120.0° |
| C02 | C01 | H013 | H012 | 120.0° | 120.0° |
| C02 | C01 | H011 | H012 | 120.0° | 120.1° |
| C02 | O03 | C04 | C11 | 167.4° | 174.5° |
| O03 | C02 | C01 | H013 | 55.3° | 180.0° |
| O03 | C02 | C01 | H011 | 64.7° | 60.0° |
| O03 | C02 | C01 | H012 | 175.3° | 60.0° |
| C07 | C08 | N09 | H082 | 120.3° | 120.0° |
| C07 | C08 | N09 | H081 | 120.3° | 120.0° |
| C08 | C07 | C10 | C11 | 180.0° | 179.8° |
| C08 | C07 | C06 | H061 | 0.2° | 0.0° |
| C07 | C08 | H082 | H081 | 119.0° | 120.0° |
| C08 | C07 | C10 | H101 | 0.0° | 0.0° |
| C07 | C08 | N09 | H092 | 180.0° | 180.0° |
| C07 | C08 | N09 | H091 | 60.0° | 56.1° |
| N09 | C08 | C07 | C10 | 30.2° | 90.0° |
| N09 | C08 | H082 | H081 | 119.0° | 120.0° |
| C08 | N09 | H092 | H091 | 120.0° | 124.0° |
| C07 | C10 | C11 | C04 | 0.2° | 0.5° |
| C07 | C10 | C11 | H101 | 180.0° | 179.7° |
| C10 | C07 | C06 | H061 | 180.0° | 180.0° |
| C10 | C07 | C08 | H082 | 150.5° | 30.0° |
| C10 | C07 | C08 | H081 | 90.1° | 150.0° |
| C07 | C10 | C11 | H111 | 179.9° | 179.8° |
| O03 | C04 | C11 | C10 | 179.2° | 179.8° |
| C04 | O03 | C02 | H021 | 33.8° | 35.2° |
| O03 | C04 | C05 | H051 | 1.0° | 0.2° |
| O03 | C04 | C11 | H111 | 0.8° | 0.1° |
| C04 | C11 | C10 | H111 | 180.0° | 179.7° |
| C11 | C04 | C05 | H051 | 179.9° | 179.8° |
| C04 | C11 | C10 | H101 | 179.9° | 179.8° |
| H013 | C01 | H011 | H012 | 120.0° | 120.0° |
| H013 | C01 | C02 | H021 | 63.3° | 60.0° |
| H011 | C01 | C02 | H021 | 176.7° | 60.0° |
| H012 | C01 | C02 | H021 | 56.7° | 180.0° |
| H051 | C05 | C06 | H061 | 0.1° | 0.1° |
| H082 | C08 | N09 | H092 | 59.7° | 59.9° |
| H082 | C08 | N09 | H091 | 179.7° | 176.1° |
| H081 | C08 | N09 | H092 | 59.7° | 60.1° |
| H081 | C08 | N09 | H091 | 60.3° | 63.9° |
| H101 | C10 | C11 | H111 | 0.1° | 0.0° |
| H272 | C27 | H271 | H273 | 120.0° | 120.0° |
| H301 | C30 | C31 | H311 | 0.8° | 0.3° |
| H331 | C33 | C34 | H341 | 1.5° | 0.0° |
| H341 | C34 | C35 | H351 | 1.8° | 0.4° |
