2SO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | CA | sing | 1.51Å | 1.50Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| C | OXT | sing | 1.34Å | 1.08Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | N | sing | 1.47Å | 1.48Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | C12 | sing | 1.51Å | 1.50Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB3 | sing | 1.09Å | 1.10Å | |
| C12 | C13 | doub | 1.35Å | 1.35Å | Aromatic |
| C12 | N16 | sing | 1.37Å | 1.38Å | Aromatic |
| C13 | N14 | sing | 1.34Å | 1.36Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| N14 | C15 | doub | 1.31Å | 1.30Å | Aromatic |
| N14 | CCA | sing | 1.46Å | 1.48Å | |
| C15 | N16 | sing | 1.35Å | 1.34Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| N16 | C17 | sing | 1.46Å | 1.46Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C20 | C21 | sing | 1.53Å | 1.51Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C21 | C22 | sing | 1.53Å | 1.54Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C22 | C23 | sing | 1.53Å | 1.54Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C23 | C24 | sing | 1.53Å | 1.55Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C24 | C25 | sing | 1.51Å | 1.52Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C25 | C26 | doub | 1.38Å | 1.38Å | Aromatic |
| C25 | C30 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C28 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CCA | C32 | sing | 1.53Å | 1.54Å | |
| C32 | C33 | sing | 1.53Å | 1.54Å | |
| C33 | C34 | sing | 1.53Å | 1.54Å | |
| C34 | O3 | sing | 1.43Å | 1.54Å | |
| C33 | O4 | sing | 1.43Å | 1.10Å | |
| CCA | HCA | sing | 1.09Å | 1.10Å | |
| CCA | HCAA | sing | 1.09Å | 1.10Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H35 | sing | 1.09Å | 1.10Å | |
| C34 | H36 | sing | 1.09Å | 1.10Å | |
| O3 | H37 | sing | 0.97Å | 0.95Å | |
| O4 | H38 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | C | O | 122.0° | 120.0° |
| CA | C | OXT | 119.0° | 120.0° |
| C | CA | CB | 111.0° | 109.5° |
| C | CA | N | 104.6° | 109.5° |
| C | CA | HA | 107.8° | 109.4° |
| O | C | OXT | 119.0° | 119.9° |
| C | OXT | HXT | 109.5° | 117.0° |
| CB | CA | N | 117.8° | 109.5° |
| CB | CA | HA | 107.4° | 109.5° |
| CA | CB | C12 | 111.7° | 109.5° |
| CA | CB | HB2 | 108.9° | 109.5° |
| CA | CB | HB3 | 108.9° | 109.5° |
| N | CA | HA | 107.9° | 109.5° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| C12 | CB | HB2 | 108.9° | 109.4° |
| C12 | CB | HB3 | 108.9° | 109.5° |
| CB | C12 | C13 | 127.4° | 126.6° |
| CB | C12 | N16 | 124.5° | 126.6° |
| HB2 | CB | HB3 | 109.5° | 109.5° |
| C13 | C12 | N16 | 108.1° | 106.8° |
| C12 | C13 | N14 | 106.6° | 108.1° |
| C12 | C13 | H13 | 126.7° | 126.0° |
| C12 | N16 | C15 | 106.1° | 107.2° |
| C12 | N16 | C17 | 126.4° | 126.4° |
| N14 | C13 | H13 | 126.7° | 125.9° |
| C13 | N14 | C15 | 109.2° | 109.2° |
| C13 | N14 | CCA | 125.4° | 125.4° |
| C15 | N14 | CCA | 125.4° | 125.4° |
| N14 | C15 | N16 | 109.9° | 108.7° |
| N14 | C15 | H15 | 125.0° | 125.7° |
| N14 | CCA | C32 | 120.0° | 109.5° |
| N14 | CCA | HCA | 106.8° | 109.5° |
| N14 | CCA | HCAA | 106.8° | 109.4° |
| N16 | C15 | H15 | 125.0° | 125.6° |
| C15 | N16 | C17 | 127.5° | 126.4° |
| N16 | C17 | C18 | 106.1° | 109.5° |
| N16 | C17 | H17 | 110.3° | 109.5° |
| N16 | C17 | H17A | 110.3° | 109.4° |
| C18 | C17 | H17 | 110.3° | 109.5° |
| C18 | C17 | H17A | 110.3° | 109.5° |
| C17 | C18 | C19 | 110.4° | 109.5° |
| C17 | C18 | H18 | 109.2° | 109.5° |
| C17 | C18 | H18A | 109.2° | 109.5° |
| H17 | C17 | H17A | 109.5° | 109.5° |
| C19 | C18 | H18 | 109.2° | 109.5° |
| C19 | C18 | H18A | 109.2° | 109.5° |
| C18 | C19 | C20 | 106.6° | 109.5° |
| C18 | C19 | H19 | 110.2° | 109.5° |
| C18 | C19 | H19A | 110.2° | 109.5° |
| H18 | C18 | H18A | 109.5° | 109.4° |
| C20 | C19 | H19 | 110.2° | 109.4° |
| C20 | C19 | H19A | 110.2° | 109.5° |
| C19 | C20 | C21 | 107.0° | 109.5° |
| C19 | C20 | H20 | 110.1° | 109.5° |
| C19 | C20 | H20A | 110.1° | 109.5° |
| H19 | C19 | H19A | 109.5° | 109.4° |
| C21 | C20 | H20 | 110.1° | 109.4° |
| C21 | C20 | H20A | 110.1° | 109.5° |
| C20 | C21 | C22 | 108.9° | 109.5° |
| C20 | C21 | H21 | 109.7° | 109.5° |
| C20 | C21 | H21A | 109.6° | 109.4° |
| H20 | C20 | H20A | 109.5° | 109.4° |
| C22 | C21 | H21 | 109.6° | 109.5° |
| C22 | C21 | H21A | 109.6° | 109.5° |
| C21 | C22 | C23 | 108.5° | 109.4° |
| C21 | C22 | H22 | 109.7° | 109.5° |
| C21 | C22 | H22A | 109.7° | 109.5° |
| H21 | C21 | H21A | 109.4° | 109.4° |
| C23 | C22 | H22 | 109.7° | 109.5° |
| C23 | C22 | H22A | 109.7° | 109.5° |
| C22 | C23 | C24 | 109.8° | 109.5° |
| C22 | C23 | H23 | 109.4° | 109.4° |
| C22 | C23 | H23A | 109.4° | 109.5° |
| H22 | C22 | H22A | 109.5° | 109.5° |
| C24 | C23 | H23 | 109.4° | 109.5° |
| C24 | C23 | H23A | 109.4° | 109.5° |
| C23 | C24 | C25 | 112.5° | 109.5° |
| C23 | C24 | H24 | 108.7° | 109.5° |
| C23 | C24 | H24A | 108.7° | 109.4° |
| H23 | C23 | H23A | 109.5° | 109.5° |
| C25 | C24 | H24 | 108.7° | 109.5° |
| C25 | C24 | H24A | 108.7° | 109.5° |
| C24 | C25 | C26 | 119.5° | 120.0° |
| C24 | C25 | C30 | 121.3° | 120.0° |
| H24 | C24 | H24A | 109.5° | 109.5° |
| C26 | C25 | C30 | 119.3° | 120.0° |
| C25 | C26 | C27 | 120.9° | 120.0° |
| C25 | C26 | H26 | 119.5° | 120.0° |
| C25 | C30 | C29 | 119.7° | 120.0° |
| C25 | C30 | H30 | 120.1° | 120.0° |
| C27 | C26 | H26 | 119.5° | 120.1° |
| C26 | C27 | C28 | 119.6° | 120.0° |
| C26 | C27 | H27 | 120.2° | 119.9° |
| C28 | C27 | H27 | 120.2° | 120.1° |
| C27 | C28 | C29 | 120.1° | 120.0° |
| C27 | C28 | H28 | 120.0° | 120.0° |
| C29 | C28 | H28 | 119.9° | 120.0° |
| C28 | C29 | C30 | 120.3° | 120.0° |
| C28 | C29 | H29 | 119.8° | 120.0° |
| C30 | C29 | H29 | 119.8° | 120.0° |
| C29 | C30 | H30 | 120.1° | 120.0° |
| H | N | H2 | 109.4° | 111.0° |
| CCA | C32 | C33 | 120.0° | 109.5° |
| C32 | CCA | HCA | 106.8° | 109.5° |
| C32 | CCA | HCAA | 106.8° | 109.4° |
| CCA | C32 | H32 | 106.8° | 109.4° |
| CCA | C32 | H33 | 106.8° | 109.4° |
| C32 | C33 | C34 | 120.0° | 109.5° |
| C32 | C33 | O4 | 109.1° | 109.5° |
| C33 | C32 | H32 | 106.8° | 109.5° |
| C33 | C32 | H33 | 106.8° | 109.5° |
| C32 | C33 | H34 | 104.1° | 109.5° |
| C33 | C34 | O3 | 120.0° | 109.5° |
| C34 | C33 | O4 | 109.1° | 109.5° |
| C34 | C33 | H34 | 104.0° | 109.5° |
| C33 | C34 | H35 | 106.8° | 109.5° |
| C33 | C34 | H36 | 106.8° | 109.4° |
| O3 | C34 | H35 | 106.8° | 109.5° |
| O3 | C34 | H36 | 106.8° | 109.5° |
| C34 | O3 | H37 | 109.5° | 114.0° |
| O4 | C33 | H34 | 109.9° | 109.4° |
| C33 | O4 | H38 | 109.5° | 113.9° |
| HCA | CCA | HCAA | 109.4° | 109.5° |
| H32 | C32 | H33 | 109.5° | 109.5° |
| H35 | C34 | H36 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | C | O | OXT | 180.0° | 179.7° |
| C | CA | CB | N | 120.5° | 120.0° |
| C | CA | CB | HA | 117.5° | 120.0° |
| C | CA | N | HA | 114.6° | 120.0° |
| C | CA | CB | C12 | 71.3° | 175.0° |
| C | CA | CB | HB2 | 49.1° | 65.0° |
| C | CA | CB | HB3 | 168.4° | 55.0° |
| C | CA | N | H | 180.0° | 64.0° |
| C | CA | N | H2 | 60.0° | 59.9° |
| CA | C | OXT | HXT | 180.0° | 180.0° |
| O | C | CA | CB | 110.5° | 100.0° |
| O | C | CA | N | 17.5° | 20.0° |
| O | C | CA | HA | 132.2° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.3° |
| OXT | C | CA | CB | 69.5° | 80.3° |
| OXT | C | CA | N | 162.5° | 159.7° |
| OXT | C | CA | HA | 47.8° | 39.7° |
| CB | CA | N | HA | 121.7° | 120.0° |
| CA | CB | C12 | HB2 | 120.4° | 120.0° |
| CA | CB | C12 | HB3 | 120.3° | 120.0° |
| CA | CB | HB2 | HB3 | 119.0° | 120.1° |
| CA | CB | C12 | C13 | 81.1° | 85.0° |
| CA | CB | C12 | N16 | 98.6° | 95.3° |
| CB | CA | N | H | 56.2° | 176.0° |
| CB | CA | N | H2 | 176.2° | 60.1° |
| N | CA | CB | C12 | 49.3° | 65.0° |
| N | CA | CB | HB2 | 169.6° | 55.0° |
| N | CA | CB | HB3 | 71.1° | 175.0° |
| CA | N | H | H2 | 120.0° | 123.9° |
| HA | CA | CB | C12 | 171.2° | 55.0° |
| HA | CA | CB | HB2 | 68.4° | 175.0° |
| HA | CA | CB | HB3 | 50.9° | 65.0° |
| HA | CA | N | H | 65.4° | 56.0° |
| HA | CA | N | H2 | 54.5° | 179.9° |
| C12 | CB | HB2 | HB3 | 119.0° | 120.0° |
| CB | C12 | C13 | N16 | 179.7° | 179.7° |
| CB | C12 | C13 | N14 | 179.8° | 180.0° |
| CB | C12 | C13 | H13 | 0.2° | 0.1° |
| CB | C12 | N16 | C15 | 179.8° | 179.9° |
| CB | C12 | N16 | C17 | 0.2° | 0.0° |
| HB2 | CB | C12 | C13 | 39.3° | 35.0° |
| HB2 | CB | C12 | N16 | 141.1° | 144.7° |
| HB3 | CB | C12 | C13 | 158.6° | 154.9° |
| HB3 | CB | C12 | N16 | 21.8° | 24.7° |
| C12 | C13 | N14 | H13 | 180.0° | 180.0° |
| C12 | C13 | N14 | C15 | 0.1° | 0.0° |
| C12 | C13 | N14 | CCA | 180.0° | 179.9° |
| C13 | C12 | N16 | C15 | 0.1° | 0.4° |
| C13 | C12 | N16 | C17 | 179.9° | 179.7° |
| N16 | C12 | C13 | N14 | 0.1° | 0.2° |
| N16 | C12 | C13 | H13 | 179.9° | 179.8° |
| C12 | N16 | C15 | N14 | 0.0° | 0.4° |
| C12 | N16 | C15 | C17 | 180.0° | 179.9° |
| C12 | N16 | C15 | H15 | 180.0° | 179.8° |
| C12 | N16 | C17 | C18 | 86.6° | 85.0° |
| C12 | N16 | C17 | H17 | 32.9° | 155.0° |
| C12 | N16 | C17 | H17A | 153.9° | 35.0° |
| C13 | N14 | C15 | CCA | 179.9° | 180.0° |
| C13 | N14 | C15 | N16 | 0.1° | 0.2° |
| C13 | N14 | C15 | H15 | 180.0° | 179.9° |
| C13 | N14 | CCA | C32 | 180.0° | 90.0° |
| C13 | N14 | CCA | HCA | 58.5° | 150.0° |
| C13 | N14 | CCA | HCAA | 58.5° | 29.9° |
| H13 | C13 | N14 | C15 | 179.9° | 180.0° |
| H13 | C13 | N14 | CCA | 0.0° | 0.0° |
| N14 | C15 | N16 | H15 | 180.0° | 179.9° |
| N14 | C15 | N16 | C17 | 180.0° | 179.7° |
| C15 | N14 | CCA | C32 | 0.1° | 90.0° |
| C15 | N14 | CCA | HCA | 121.4° | 30.0° |
| C15 | N14 | CCA | HCAA | 121.6° | 150.0° |
| CCA | N14 | C15 | N16 | 180.0° | 179.8° |
| CCA | N14 | C15 | H15 | 0.1° | 0.1° |
| N14 | CCA | C32 | HCA | 121.5° | 120.0° |
| N14 | CCA | C32 | HCAA | 121.5° | 119.9° |
| N14 | CCA | C32 | C33 | 180.0° | 180.0° |
| N14 | CCA | HCA | HCAA | 115.2° | 120.0° |
| N14 | CCA | C32 | H32 | 58.5° | 59.9° |
| N14 | CCA | C32 | H33 | 58.5° | 60.0° |
| C15 | N16 | C17 | C18 | 93.4° | 94.9° |
| C15 | N16 | C17 | H17 | 147.1° | 25.1° |
| C15 | N16 | C17 | H17A | 26.0° | 145.1° |
| H15 | C15 | N16 | C17 | 0.1° | 0.1° |
| N16 | C17 | C18 | H17 | 119.5° | 120.0° |
| N16 | C17 | C18 | H17A | 119.5° | 119.9° |
| N16 | C17 | H17 | H17A | 121.6° | 120.0° |
| N16 | C17 | C18 | C19 | 176.1° | 180.0° |
| N16 | C17 | C18 | H18 | 63.8° | 60.0° |
| N16 | C17 | C18 | H18A | 56.0° | 60.0° |
| C18 | C17 | H17 | H17A | 121.6° | 120.0° |
| C17 | C18 | C19 | H18 | 120.1° | 120.0° |
| C17 | C18 | C19 | H18A | 120.1° | 120.0° |
| C17 | C18 | H18 | H18A | 119.6° | 120.0° |
| C17 | C18 | C19 | C20 | 178.9° | 180.0° |
| C17 | C18 | C19 | H19 | 59.3° | 60.0° |
| C17 | C18 | C19 | H19A | 61.6° | 60.0° |
| H17 | C17 | C18 | C19 | 56.6° | 60.0° |
| H17 | C17 | C18 | H18 | 176.7° | 180.0° |
| H17 | C17 | C18 | H18A | 63.5° | 60.0° |
| H17A | C17 | C18 | C19 | 64.5° | 60.0° |
| H17A | C17 | C18 | H18 | 55.7° | 60.0° |
| H17A | C17 | C18 | H18A | 175.4° | 179.9° |
| C19 | C18 | H18 | H18A | 119.5° | 120.0° |
| C18 | C19 | C20 | H19 | 119.5° | 120.0° |
| C18 | C19 | C20 | H19A | 119.5° | 120.1° |
| C18 | C19 | H19 | H19A | 121.3° | 120.0° |
| C18 | C19 | C20 | C21 | 164.2° | 180.0° |
| C18 | C19 | C20 | H20 | 76.3° | 60.1° |
| C18 | C19 | C20 | H20A | 44.5° | 59.9° |
| H18 | C18 | C19 | C20 | 61.0° | 60.0° |
| H18 | C18 | C19 | H19 | 179.5° | 180.0° |
| H18 | C18 | C19 | H19A | 58.5° | 60.0° |
| H18A | C18 | C19 | C20 | 58.7° | 59.9° |
| H18A | C18 | C19 | H19 | 60.8° | 60.0° |
| H18A | C18 | C19 | H19A | 178.3° | NaN° |
| C20 | C19 | H19 | H19A | 121.3° | 119.9° |
| C19 | C20 | C21 | H20 | 119.6° | 120.0° |
| C19 | C20 | C21 | H20A | 119.6° | 120.1° |
| C19 | C20 | H20 | H20A | 121.1° | 120.0° |
| C19 | C20 | C21 | C22 | 176.7° | 179.9° |
| C19 | C20 | C21 | H21 | 63.3° | 60.0° |
| C19 | C20 | C21 | H21A | 56.8° | 60.0° |
| H19 | C19 | C20 | C21 | 44.6° | 60.0° |
| H19 | C19 | C20 | H20 | 164.2° | 180.0° |
| H19 | C19 | C20 | H20A | 75.0° | 60.1° |
| H19A | C19 | C20 | C21 | 76.3° | 59.9° |
| H19A | C19 | C20 | H20 | 43.3° | 60.0° |
| H19A | C19 | C20 | H20A | 164.0° | 180.0° |
| C21 | C20 | H20 | H20A | 121.1° | 119.9° |
| C20 | C21 | C22 | H21 | 119.9° | 120.1° |
| C20 | C21 | C22 | H21A | 119.9° | 119.9° |
| C20 | C21 | H21 | H21A | 120.3° | 119.9° |
| C20 | C21 | C22 | C23 | 82.7° | 180.0° |
| C20 | C21 | C22 | H22 | 157.5° | 60.0° |
| C20 | C21 | C22 | H22A | 37.1° | 60.0° |
| H20 | C20 | C21 | C22 | 57.1° | 59.9° |
| H20 | C20 | C21 | H21 | 177.0° | 180.0° |
| H20 | C20 | C21 | H21A | 62.8° | 60.0° |
| H20A | C20 | C21 | C22 | 63.6° | 60.0° |
| H20A | C20 | C21 | H21 | 56.3° | 60.1° |
| H20A | C20 | C21 | H21A | 176.5° | 180.0° |
| C22 | C21 | H21 | H21A | 120.2° | 120.0° |
| C21 | C22 | C23 | H22 | 119.9° | 120.0° |
| C21 | C22 | C23 | H22A | 119.8° | 120.0° |
| C21 | C22 | H22 | H22A | 120.4° | 120.0° |
| C21 | C22 | C23 | C24 | 171.1° | 180.0° |
| C21 | C22 | C23 | H23 | 68.8° | 60.0° |
| C21 | C22 | C23 | H23A | 51.1° | 60.0° |
| H21 | C21 | C22 | C23 | 37.3° | 60.0° |
| H21 | C21 | C22 | H22 | 82.6° | 180.0° |
| H21 | C21 | C22 | H22A | 157.1° | 60.0° |
| H21A | C21 | C22 | C23 | 157.4° | 60.0° |
| H21A | C21 | C22 | H22 | 37.5° | 60.0° |
| H21A | C21 | C22 | H22A | 82.8° | 180.0° |
| C23 | C22 | H22 | H22A | 120.4° | 120.0° |
| C22 | C23 | C24 | H23 | 120.1° | 119.9° |
| C22 | C23 | C24 | H23A | 120.0° | 120.0° |
| C22 | C23 | H23 | H23A | 119.9° | 120.0° |
| C22 | C23 | C24 | C25 | 66.5° | 180.0° |
| C22 | C23 | C24 | H24 | 54.0° | 60.0° |
| C22 | C23 | C24 | H24A | 173.1° | 60.0° |
| H22 | C22 | C23 | C24 | 51.3° | 60.0° |
| H22 | C22 | C23 | H23 | 171.3° | 180.0° |
| H22 | C22 | C23 | H23A | 68.7° | 60.0° |
| H22A | C22 | C23 | C24 | 69.0° | 60.0° |
| H22A | C22 | C23 | H23 | 51.0° | 60.0° |
| H22A | C22 | C23 | H23A | 170.9° | 180.0° |
| C24 | C23 | H23 | H23A | 119.8° | 120.0° |
| C23 | C24 | C25 | H24 | 120.4° | 120.0° |
| C23 | C24 | C25 | H24A | 120.5° | 120.0° |
| C23 | C24 | H24 | H24A | 118.6° | 120.0° |
| C23 | C24 | C25 | C26 | 69.2° | 90.0° |
| C23 | C24 | C25 | C30 | 110.6° | 90.2° |
| H23 | C23 | C24 | C25 | 173.5° | 60.1° |
| H23 | C23 | C24 | H24 | 66.1° | 179.9° |
| H23 | C23 | C24 | H24A | 53.0° | 60.0° |
| H23A | C23 | C24 | C25 | 53.6° | 60.0° |
| H23A | C23 | C24 | H24 | 174.0° | 60.0° |
| H23A | C23 | C24 | H24A | 66.9° | 180.0° |
| C25 | C24 | H24 | H24A | 118.6° | 120.1° |
| C24 | C25 | C26 | C30 | 179.8° | 179.8° |
| C24 | C25 | C26 | C27 | 179.9° | 180.0° |
| C24 | C25 | C26 | H26 | 0.1° | 0.0° |
| C24 | C25 | C30 | C29 | 179.9° | 179.8° |
| C24 | C25 | C30 | H30 | 0.1° | 0.1° |
| H24 | C24 | C25 | C26 | 170.4° | 30.0° |
| H24 | C24 | C25 | C30 | 9.8° | 149.8° |
| H24A | C24 | C25 | C26 | 51.3° | 150.1° |
| H24A | C24 | C25 | C30 | 128.9° | 29.8° |
| C25 | C26 | C27 | H26 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 0.0° | 0.0° |
| C25 | C26 | C27 | H27 | 179.9° | 179.9° |
| C26 | C25 | C30 | C29 | 0.1° | 0.4° |
| C26 | C25 | C30 | H30 | 179.9° | 179.7° |
| C30 | C25 | C26 | C27 | 0.0° | 0.2° |
| C30 | C25 | C26 | H26 | 180.0° | 179.8° |
| C25 | C30 | C29 | C28 | 0.1° | 0.4° |
| C25 | C30 | C29 | H30 | 180.0° | 179.9° |
| C25 | C30 | C29 | H29 | 180.0° | 179.8° |
| C26 | C27 | C28 | H27 | 180.0° | 179.9° |
| C26 | C27 | C28 | C29 | 0.1° | 0.0° |
| C26 | C27 | C28 | H28 | 179.9° | 179.9° |
| H26 | C26 | C27 | C28 | 180.0° | 180.0° |
| H26 | C26 | C27 | H27 | 0.1° | 0.1° |
| C27 | C28 | C29 | H28 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 0.0° | 0.2° |
| C27 | C28 | C29 | H29 | 180.0° | 180.0° |
| H27 | C27 | C28 | C29 | 179.9° | 179.9° |
| H27 | C27 | C28 | H28 | 0.1° | 0.0° |
| C28 | C29 | C30 | H29 | 180.0° | 179.8° |
| C28 | C29 | C30 | H30 | 179.9° | 179.7° |
| H28 | C28 | C29 | C30 | 180.0° | 179.9° |
| H28 | C28 | C29 | H29 | 0.0° | 0.1° |
| H29 | C29 | C30 | H30 | 0.0° | 0.1° |
| CCA | C32 | C33 | H32 | 121.5° | 120.0° |
| CCA | C32 | C33 | H33 | 121.5° | 120.0° |
| CCA | C32 | C33 | C34 | 180.0° | 175.0° |
| CCA | C32 | C33 | O4 | 53.1° | 64.9° |
| C32 | CCA | HCA | HCAA | 115.2° | 120.0° |
| CCA | C32 | H32 | H33 | 115.2° | 119.9° |
| CCA | C32 | C33 | H34 | 64.2° | 55.0° |
| C32 | C33 | C34 | O4 | 127.0° | 120.0° |
| C32 | C33 | C34 | H34 | 115.8° | 120.0° |
| C32 | C33 | C34 | O3 | 180.0° | 175.0° |
| C32 | C33 | O4 | H34 | 113.6° | 119.9° |
| C33 | C32 | CCA | HCA | 58.5° | 60.0° |
| C33 | C32 | CCA | HCAA | 58.5° | 60.0° |
| C33 | C32 | H32 | H33 | 115.2° | 120.0° |
| C32 | C33 | C34 | H35 | 58.5° | 65.0° |
| C32 | C33 | C34 | H36 | 58.5° | 55.0° |
| C32 | C33 | O4 | H38 | 180.0° | 60.1° |
| C33 | C34 | O3 | H35 | 121.5° | 120.0° |
| C33 | C34 | O3 | H36 | 121.5° | 120.0° |
| C34 | C33 | O4 | H34 | 113.5° | 120.0° |
| C34 | C33 | C32 | H32 | 58.5° | 65.0° |
| C34 | C33 | C32 | H33 | 58.5° | 55.0° |
| C33 | C34 | H35 | H36 | 115.2° | 120.0° |
| C33 | C34 | O3 | H37 | 180.0° | 180.0° |
| C34 | C33 | O4 | H38 | 47.1° | 60.0° |
| O3 | C34 | C33 | O4 | 53.1° | 65.0° |
| O3 | C34 | C33 | H34 | 64.2° | 55.0° |
| O3 | C34 | H35 | H36 | 115.2° | 120.0° |
| O4 | C33 | C32 | H32 | 68.4° | 55.0° |
| O4 | C33 | C32 | H33 | 174.6° | 175.1° |
| O4 | C33 | C34 | H35 | 68.4° | 55.0° |
| O4 | C33 | C34 | H36 | 174.5° | 175.0° |
| HCA | CCA | C32 | H32 | 180.0° | 180.0° |
| HCA | CCA | C32 | H33 | 62.9° | 60.0° |
| HCAA | CCA | C32 | H32 | 63.0° | 60.0° |
| HCAA | CCA | C32 | H33 | 179.9° | 179.9° |
| H32 | C32 | C33 | H34 | 174.3° | 175.0° |
| H33 | C32 | C33 | H34 | 57.2° | 65.0° |
| H34 | C33 | C34 | H35 | 174.3° | 175.0° |
| H34 | C33 | C34 | H36 | 57.3° | 65.0° |
| H34 | C33 | O4 | H38 | 66.4° | 180.0° |
| H35 | C34 | O3 | H37 | 58.5° | 60.0° |
| H36 | C34 | O3 | H37 | 58.5° | 60.0° |
