QGF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| CL1 | C21 | sing | 1.74Å | 1.74Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | C30 | sing | 1.51Å | 1.52Å | |
| CL2 | C24 | sing | 1.74Å | 1.74Å | |
| C3 | C4 | sing | 1.53Å | 1.54Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C6 | sing | 1.53Å | 1.53Å | |
| C4 | N26 | sing | 1.46Å | 1.49Å | |
| C6 | S7 | sing | 1.81Å | 1.81Å | |
| S7 | O8 | doub | 1.42Å | 1.43Å | |
| S7 | O9 | doub | 1.42Å | 1.41Å | |
| S7 | N10 | sing | 1.66Å | 1.65Å | |
| N10 | C11 | sing | 1.47Å | 1.47Å | |
| N10 | C15 | sing | 1.47Å | 1.48Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| C13 | C14 | sing | 1.53Å | 1.54Å | |
| C13 | O16 | sing | 1.43Å | 1.44Å | |
| C14 | C15 | sing | 1.54Å | 1.55Å | |
| O16 | C17 | sing | 1.43Å | 1.43Å | |
| C17 | C18 | sing | 1.51Å | 1.51Å | |
| C18 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C24 | sing | 1.38Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C23 | sing | 1.38Å | 1.38Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| N26 | O27 | sing | 1.42Å | 1.41Å | |
| N26 | C28 | sing | 1.35Å | 1.35Å | |
| C28 | O29 | doub | 1.21Å | 1.22Å | |
| C30 | N31 | doub | 1.32Å | 1.34Å | Aromatic |
| C30 | N36 | sing | 1.32Å | 1.33Å | Aromatic |
| N31 | C32 | sing | 1.32Å | 1.32Å | Aromatic |
| C32 | C33 | doub | 1.39Å | 1.40Å | Aromatic |
| C33 | F34 | sing | 1.35Å | 1.35Å | |
| C33 | C35 | sing | 1.39Å | 1.39Å | Aromatic |
| C35 | N36 | doub | 1.32Å | 1.32Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C5 | H5B | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| O27 | HO27 | sing | 0.97Å | 0.95Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 107.3° | 109.5° |
| C1 | C2 | C30 | 108.7° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.5° | 109.5° |
| C2 | C1 | H1B | 109.5° | 109.5° |
| C1 | C2 | H2 | 112.5° | 109.5° |
| CL1 | C21 | C20 | 120.8° | 120.0° |
| CL1 | C21 | C23 | 118.8° | 120.0° |
| C3 | C2 | C30 | 112.5° | 109.5° |
| C2 | C3 | C4 | 113.6° | 109.5° |
| C3 | C2 | H2 | 108.6° | 109.4° |
| C2 | C3 | H3 | 108.1° | 109.5° |
| C2 | C3 | H3A | 108.1° | 109.4° |
| C2 | C30 | N31 | 120.5° | 119.1° |
| C2 | C30 | N36 | 117.9° | 119.1° |
| C30 | C2 | H2 | 107.3° | 109.5° |
| CL2 | C24 | C18 | 122.1° | 120.0° |
| CL2 | C24 | C23 | 117.2° | 120.0° |
| C3 | C4 | C5 | 111.1° | 109.5° |
| C3 | C4 | C6 | 103.0° | 109.5° |
| C3 | C4 | N26 | 110.1° | 109.5° |
| C4 | C3 | H3 | 108.1° | 109.5° |
| C4 | C3 | H3A | 108.1° | 109.5° |
| C5 | C4 | C6 | 109.2° | 109.5° |
| C5 | C4 | N26 | 111.2° | 109.5° |
| C4 | C5 | H5 | 109.5° | 109.5° |
| C4 | C5 | H5A | 109.4° | 109.4° |
| C4 | C5 | H5B | 109.5° | 109.5° |
| C6 | C4 | N26 | 112.0° | 109.5° |
| C4 | C6 | S7 | 117.5° | 109.5° |
| C4 | C6 | H6 | 106.9° | 109.5° |
| C4 | C6 | H6A | 106.9° | 109.5° |
| C4 | N26 | O27 | 121.2° | 120.0° |
| C4 | N26 | C28 | 123.3° | 120.0° |
| C6 | S7 | O8 | 115.2° | 110.6° |
| C6 | S7 | O9 | 108.9° | 110.5° |
| C6 | S7 | N10 | 104.3° | 104.5° |
| S7 | C6 | H6 | 106.9° | 109.5° |
| S7 | C6 | H6A | 106.9° | 109.5° |
| O8 | S7 | O9 | 119.4° | 121.1° |
| O8 | S7 | N10 | 104.7° | 104.3° |
| O9 | S7 | N10 | 102.2° | 104.2° |
| S7 | N10 | C11 | 118.9° | 120.6° |
| S7 | N10 | C15 | 121.9° | 120.7° |
| C11 | N10 | C15 | 119.2° | 118.7° |
| N10 | C11 | C12 | 108.3° | 108.8° |
| N10 | C11 | H11 | 109.9° | 109.6° |
| N10 | C11 | H11A | 109.9° | 109.6° |
| N10 | C15 | C14 | 110.4° | 108.5° |
| N10 | C15 | H15 | 109.2° | 109.6° |
| N10 | C15 | H15A | 109.2° | 109.5° |
| C11 | C12 | C13 | 110.1° | 109.3° |
| C12 | C11 | H11 | 109.9° | 109.6° |
| C12 | C11 | H11A | 109.9° | 109.6° |
| C11 | C12 | H12 | 109.3° | 109.5° |
| C11 | C12 | H12A | 109.3° | 109.5° |
| C12 | C13 | C14 | 108.6° | 109.5° |
| C12 | C13 | O16 | 107.5° | 109.5° |
| C13 | C12 | H12 | 109.3° | 109.5° |
| C13 | C12 | H12A | 109.3° | 109.5° |
| C12 | C13 | H13 | 112.4° | 109.4° |
| C14 | C13 | O16 | 112.4° | 109.5° |
| C13 | C14 | C15 | 110.8° | 109.2° |
| C14 | C13 | H13 | 107.5° | 109.5° |
| C13 | C14 | H14 | 109.1° | 109.5° |
| C13 | C14 | H14A | 109.1° | 109.5° |
| C13 | O16 | C17 | 118.1° | 114.0° |
| O16 | C13 | H13 | 108.6° | 109.4° |
| C15 | C14 | H14 | 109.0° | 109.7° |
| C15 | C14 | H14A | 109.0° | 109.4° |
| C14 | C15 | H15 | 109.2° | 109.8° |
| C14 | C15 | H15A | 109.1° | 109.7° |
| O16 | C17 | C18 | 109.8° | 109.5° |
| O16 | C17 | H17 | 109.3° | 109.5° |
| O16 | C17 | H17A | 109.3° | 109.4° |
| C17 | C18 | C19 | 118.8° | 120.0° |
| C17 | C18 | C24 | 121.3° | 120.0° |
| C18 | C17 | H17 | 109.4° | 109.5° |
| C18 | C17 | H17A | 109.4° | 109.4° |
| C19 | C18 | C24 | 119.9° | 120.0° |
| C18 | C19 | C20 | 119.1° | 120.0° |
| C18 | C19 | H19 | 120.5° | 120.0° |
| C18 | C24 | C23 | 120.7° | 120.0° |
| C19 | C20 | C21 | 120.6° | 120.0° |
| C20 | C19 | H19 | 120.5° | 120.0° |
| C19 | C20 | H20 | 119.7° | 120.0° |
| C20 | C21 | C23 | 120.3° | 120.0° |
| C21 | C20 | H20 | 119.7° | 120.0° |
| C21 | C23 | C24 | 119.4° | 120.0° |
| C21 | C23 | H23 | 120.3° | 120.0° |
| C24 | C23 | H23 | 120.3° | 120.0° |
| O27 | N26 | C28 | 115.5° | 120.0° |
| N26 | O27 | HO27 | 109.5° | 114.0° |
| N26 | C28 | O29 | 117.3° | 120.0° |
| N26 | C28 | H28 | 121.3° | 120.0° |
| O29 | C28 | H28 | 121.3° | 120.0° |
| N31 | C30 | N36 | 121.6° | 121.8° |
| C30 | N31 | C32 | 120.7° | 120.9° |
| C30 | N36 | C35 | 121.3° | 120.9° |
| N31 | C32 | C33 | 118.6° | 119.1° |
| N31 | C32 | H32 | 120.7° | 120.5° |
| C32 | C33 | F34 | 120.5° | 120.8° |
| C32 | C33 | C35 | 119.6° | 118.3° |
| C33 | C32 | H32 | 120.7° | 120.4° |
| F34 | C33 | C35 | 119.9° | 120.8° |
| C33 | C35 | N36 | 118.2° | 119.1° |
| C33 | C35 | H35 | 120.9° | 120.4° |
| N36 | C35 | H35 | 120.9° | 120.5° |
| H1 | C1 | H1A | 109.4° | 109.4° |
| H1 | C1 | H1B | 109.5° | 109.5° |
| H1A | C1 | H1B | 109.5° | 109.5° |
| H3 | C3 | H3A | 110.8° | 109.5° |
| H5 | C5 | H5A | 109.5° | 109.5° |
| H5 | C5 | H5B | 109.5° | 109.5° |
| H5A | C5 | H5B | 109.5° | 109.5° |
| H6 | C6 | H6A | 111.9° | 109.4° |
| H11 | C11 | H11A | 109.1° | 109.7° |
| H12 | C12 | H12A | 109.7° | 109.5° |
| H14 | C14 | H14A | 109.9° | 109.5° |
| H15 | C15 | H15A | 109.8° | 109.7° |
| H17 | C17 | H17A | 109.6° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | C30 | 119.5° | 120.0° |
| C1 | C2 | C3 | H2 | 121.9° | 120.0° |
| C1 | C2 | C30 | H2 | 121.8° | 120.0° |
| C1 | C2 | C3 | C4 | 154.9° | 172.6° |
| C1 | C2 | C30 | N31 | 58.1° | 120.0° |
| C1 | C2 | C30 | N36 | 120.9° | 60.2° |
| C2 | C1 | H1 | H1A | 120.0° | 120.0° |
| C2 | C1 | H1 | H1B | 120.0° | 120.0° |
| C2 | C1 | H1A | H1B | 120.0° | 120.0° |
| C1 | C2 | C3 | H3 | 34.9° | 52.7° |
| C1 | C2 | C3 | H3A | 85.1° | 67.4° |
| CL1 | C21 | C20 | C19 | 179.7° | 179.9° |
| CL1 | C21 | C20 | C23 | 179.6° | 180.0° |
| CL1 | C21 | C23 | C24 | 179.5° | 179.7° |
| CL1 | C21 | C20 | H20 | 0.3° | 0.0° |
| CL1 | C21 | C23 | H23 | 0.5° | 0.0° |
| C3 | C2 | C30 | H2 | 119.4° | 120.0° |
| C2 | C3 | C4 | H3 | 120.0° | 120.0° |
| C2 | C3 | C4 | H3A | 120.0° | 120.0° |
| C2 | C3 | C4 | C5 | 54.8° | 54.7° |
| C2 | C3 | C4 | C6 | 171.7° | 174.7° |
| C2 | C3 | C4 | N26 | 68.8° | 65.3° |
| C3 | C2 | C30 | N31 | 60.6° | 120.0° |
| C3 | C2 | C30 | N36 | 120.4° | 59.8° |
| C3 | C2 | C1 | H1 | 180.0° | 63.4° |
| C3 | C2 | C1 | H1A | 60.0° | 176.7° |
| C3 | C2 | C1 | H1B | 60.0° | 56.6° |
| C2 | C3 | H3 | H3A | 118.3° | 120.0° |
| C30 | C2 | C3 | C4 | 85.6° | 67.3° |
| C2 | C30 | N31 | N36 | 178.9° | 179.8° |
| C2 | C30 | N31 | C32 | 178.8° | 180.0° |
| C2 | C30 | N36 | C35 | 178.9° | 179.7° |
| C30 | C2 | C1 | H1 | 58.1° | 176.6° |
| C30 | C2 | C1 | H1A | 61.9° | 56.6° |
| C30 | C2 | C1 | H1B | 178.1° | 63.4° |
| C30 | C2 | C3 | H3 | 154.4° | 172.7° |
| C30 | C2 | C3 | H3A | 34.4° | 52.6° |
| CL2 | C24 | C18 | C17 | 0.0° | 0.0° |
| CL2 | C24 | C18 | C19 | 179.9° | 179.7° |
| CL2 | C24 | C18 | C23 | 179.7° | 179.7° |
| CL2 | C24 | C23 | C21 | 180.0° | 179.7° |
| CL2 | C24 | C23 | H23 | 0.1° | 0.0° |
| C3 | C4 | C5 | C6 | 112.9° | 120.0° |
| C3 | C4 | C5 | N26 | 123.0° | 120.0° |
| C3 | C4 | C6 | N26 | 118.2° | 120.0° |
| C3 | C4 | C6 | S7 | 173.9° | 175.0° |
| C3 | C4 | N26 | O27 | 63.3° | 120.0° |
| C3 | C4 | N26 | C28 | 116.6° | 60.0° |
| C4 | C3 | C2 | H2 | 33.0° | 52.6° |
| C4 | C3 | H3 | H3A | 118.3° | 120.0° |
| C3 | C4 | C5 | H5 | 180.0° | 63.9° |
| C3 | C4 | C5 | H5A | 60.0° | 176.2° |
| C3 | C4 | C5 | H5B | 60.0° | 56.2° |
| C3 | C4 | C6 | H6 | 53.9° | 54.9° |
| C3 | C4 | C6 | H6A | 66.1° | 65.0° |
| C5 | C4 | C6 | N26 | 123.7° | 120.0° |
| C5 | C4 | C6 | S7 | 55.8° | 55.0° |
| C5 | C4 | N26 | O27 | 173.2° | 0.0° |
| C5 | C4 | N26 | C28 | 6.9° | 180.0° |
| C5 | C4 | C3 | H3 | 65.2° | 65.3° |
| C5 | C4 | C3 | H3A | 174.8° | 174.7° |
| C4 | C5 | H5 | H5A | 120.0° | 120.0° |
| C4 | C5 | H5 | H5B | 120.0° | 120.0° |
| C4 | C5 | H5A | H5B | 120.0° | 120.0° |
| C5 | C4 | C6 | H6 | 64.2° | 65.0° |
| C5 | C4 | C6 | H6A | 175.7° | 175.1° |
| C4 | C6 | S7 | H6 | 120.0° | 120.1° |
| C4 | C6 | S7 | H6A | 120.0° | 120.0° |
| C4 | C6 | S7 | O8 | 32.9° | 68.4° |
| C4 | C6 | S7 | O9 | 170.3° | 68.4° |
| C4 | C6 | S7 | N10 | 81.3° | 180.0° |
| C6 | C4 | N26 | O27 | 50.6° | 120.0° |
| C6 | C4 | N26 | C28 | 129.5° | 60.0° |
| C6 | C4 | C3 | H3 | 51.7° | 54.7° |
| C6 | C4 | C3 | H3A | 68.3° | 65.4° |
| C6 | C4 | C5 | H5 | 67.1° | 56.1° |
| C6 | C4 | C5 | H5A | 172.9° | 63.9° |
| C6 | C4 | C5 | H5B | 52.9° | 176.2° |
| C4 | C6 | H6 | H6A | 116.7° | 119.9° |
| N26 | C4 | C6 | S7 | 67.9° | 65.0° |
| C4 | N26 | O27 | C28 | 179.9° | 180.0° |
| C4 | N26 | C28 | O29 | 179.4° | 180.0° |
| N26 | C4 | C3 | H3 | 171.2° | 174.7° |
| N26 | C4 | C3 | H3A | 51.2° | 54.6° |
| N26 | C4 | C5 | H5 | 57.1° | 176.1° |
| N26 | C4 | C5 | H5A | 63.0° | 56.2° |
| N26 | C4 | C5 | H5B | 177.1° | 63.8° |
| N26 | C4 | C6 | H6 | 172.1° | 174.9° |
| N26 | C4 | C6 | H6A | 52.1° | 55.0° |
| C4 | N26 | O27 | HO27 | 179.7° | 180.0° |
| C4 | N26 | C28 | H28 | 0.7° | 0.0° |
| C6 | S7 | O8 | O9 | 132.6° | 131.6° |
| C6 | S7 | O8 | N10 | 113.9° | 111.7° |
| C6 | S7 | O9 | N10 | 109.9° | 111.7° |
| C6 | S7 | N10 | C11 | 63.6° | 90.0° |
| C6 | S7 | N10 | C15 | 117.8° | 90.3° |
| S7 | C6 | H6 | H6A | 116.7° | 120.0° |
| O8 | S7 | O9 | N10 | 114.9° | 116.7° |
| O8 | S7 | N10 | C11 | 175.1° | 26.1° |
| O8 | S7 | N10 | C15 | 3.6° | 153.6° |
| O8 | S7 | C6 | H6 | 87.1° | 171.6° |
| O8 | S7 | C6 | H6A | 152.9° | 51.6° |
| O9 | S7 | N10 | C11 | 49.8° | 153.9° |
| O9 | S7 | N10 | C15 | 128.8° | 25.8° |
| O9 | S7 | C6 | H6 | 50.3° | 51.6° |
| O9 | S7 | C6 | H6A | 69.7° | 171.6° |
| S7 | N10 | C11 | C15 | 178.7° | 179.7° |
| S7 | N10 | C11 | C12 | 126.4° | 126.4° |
| S7 | N10 | C15 | C14 | 130.2° | 126.4° |
| N10 | S7 | C6 | H6 | 158.7° | 59.9° |
| N10 | S7 | C6 | H6A | 38.7° | 60.0° |
| S7 | N10 | C11 | H11 | 6.4° | 6.6° |
| S7 | N10 | C11 | H11A | 113.6° | 113.8° |
| S7 | N10 | C15 | H15 | 109.8° | 113.8° |
| S7 | N10 | C15 | H15A | 10.2° | 6.6° |
| N10 | C11 | C12 | H11 | 120.0° | 119.8° |
| N10 | C11 | C12 | H11A | 120.0° | 119.8° |
| N10 | C11 | C12 | C13 | 57.9° | 54.6° |
| C11 | N10 | C15 | C14 | 48.5° | 53.9° |
| N10 | C11 | H11 | H11A | 120.5° | 120.4° |
| N10 | C11 | C12 | H12 | 62.1° | 65.3° |
| N10 | C11 | C12 | H12A | 177.9° | 174.6° |
| C11 | N10 | C15 | H15 | 71.5° | 65.9° |
| C11 | N10 | C15 | H15A | 168.5° | 173.7° |
| C15 | N10 | C11 | C12 | 52.3° | 53.9° |
| N10 | C15 | C14 | C13 | 49.2° | 54.9° |
| N10 | C15 | C14 | H15 | 120.0° | 119.8° |
| N10 | C15 | C14 | H15A | 120.0° | 119.7° |
| C15 | N10 | C11 | H11 | 172.3° | 173.7° |
| C15 | N10 | C11 | H11A | 67.7° | 65.9° |
| N10 | C15 | C14 | H14 | 70.8° | 65.1° |
| N10 | C15 | C14 | H14A | 169.2° | 174.7° |
| N10 | C15 | H15 | H15A | 119.7° | 120.3° |
| C11 | C12 | C13 | H12 | 120.0° | 119.9° |
| C11 | C12 | C13 | H12A | 120.0° | 120.0° |
| C11 | C12 | C13 | C14 | 63.2° | 61.4° |
| C11 | C12 | C13 | O16 | 174.9° | 178.6° |
| C12 | C11 | H11 | H11A | 120.5° | 120.3° |
| C11 | C12 | H12 | H12A | 119.7° | 120.1° |
| C11 | C12 | C13 | H13 | 55.5° | 58.7° |
| C12 | C13 | C14 | O16 | 118.8° | 120.0° |
| C12 | C13 | C14 | H13 | 121.8° | 120.0° |
| C12 | C13 | O16 | H13 | 121.8° | 119.9° |
| C12 | C13 | C14 | C15 | 58.4° | 61.5° |
| C12 | C13 | O16 | C17 | 173.8° | 149.9° |
| C13 | C12 | C11 | H11 | 177.9° | 174.4° |
| C13 | C12 | C11 | H11A | 62.1° | 65.2° |
| C13 | C12 | H12 | H12A | 119.7° | 120.1° |
| C12 | C13 | C14 | H14 | 61.6° | 58.6° |
| C12 | C13 | C14 | H14A | 178.4° | 178.7° |
| C14 | C13 | O16 | H13 | 118.8° | 120.0° |
| C13 | C14 | C15 | H14 | 120.0° | 120.1° |
| C13 | C14 | C15 | H14A | 120.0° | 119.8° |
| C14 | C13 | O16 | C17 | 54.4° | 90.0° |
| C14 | C13 | C12 | H12 | 56.8° | 58.6° |
| C14 | C13 | C12 | H12A | 176.8° | 178.7° |
| C13 | C14 | H14 | H14A | 119.5° | 120.1° |
| C13 | C14 | C15 | H15 | 70.8° | 64.8° |
| C13 | C14 | C15 | H15A | 169.2° | 174.6° |
| O16 | C13 | C14 | C15 | 177.2° | 178.5° |
| C13 | O16 | C17 | C18 | 175.4° | 180.0° |
| O16 | C13 | C12 | H12 | 65.1° | 61.4° |
| O16 | C13 | C12 | H12A | 54.9° | 58.6° |
| O16 | C13 | C14 | H14 | 57.2° | 61.4° |
| O16 | C13 | C14 | H14A | 62.9° | 58.7° |
| C13 | O16 | C17 | H17 | 64.6° | 60.0° |
| C13 | O16 | C17 | H17A | 55.4° | 60.0° |
| C15 | C14 | C13 | H13 | 63.4° | 58.5° |
| C15 | C14 | H14 | H14A | 119.4° | 120.1° |
| C14 | C15 | H15 | H15A | 119.6° | 120.6° |
| O16 | C17 | C18 | H17 | 120.0° | 120.1° |
| O16 | C17 | C18 | H17A | 120.0° | 120.0° |
| O16 | C17 | C18 | C19 | 85.6° | 0.0° |
| O16 | C17 | C18 | C24 | 94.6° | 179.8° |
| C17 | O16 | C13 | H13 | 64.4° | 30.0° |
| O16 | C17 | H17 | H17A | 119.8° | 119.9° |
| C17 | C18 | C19 | C24 | 179.9° | 179.7° |
| C17 | C18 | C19 | C20 | 179.9° | 179.9° |
| C17 | C18 | C24 | C23 | 179.7° | 179.7° |
| C18 | C17 | H17 | H17A | 119.9° | 120.0° |
| C17 | C18 | C19 | H19 | 0.1° | 0.0° |
| C18 | C19 | C20 | H19 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.0° | 0.1° |
| C19 | C18 | C24 | C23 | 0.5° | 0.5° |
| C19 | C18 | C17 | H17 | 34.4° | 120.1° |
| C19 | C18 | C17 | H17A | 154.5° | 120.0° |
| C18 | C19 | C20 | H20 | 180.0° | 180.0° |
| C24 | C18 | C19 | C20 | 0.3° | 0.2° |
| C18 | C24 | C23 | C21 | 0.3° | 0.6° |
| C24 | C18 | C17 | H17 | 145.4° | 59.7° |
| C24 | C18 | C17 | H17A | 25.4° | 60.3° |
| C24 | C18 | C19 | H19 | 179.7° | 179.8° |
| C18 | C24 | C23 | H23 | 179.6° | 179.7° |
| C19 | C20 | C21 | H20 | 180.0° | 179.9° |
| C19 | C20 | C21 | C23 | 0.2° | 0.1° |
| C20 | C21 | C23 | C24 | 0.0° | 0.3° |
| C21 | C20 | C19 | H19 | 180.0° | 179.9° |
| C20 | C21 | C23 | H23 | 179.9° | 180.0° |
| C21 | C23 | C24 | H23 | 180.0° | 179.7° |
| C23 | C21 | C20 | H20 | 179.9° | 180.0° |
| O27 | N26 | C28 | O29 | 0.7° | 0.0° |
| O27 | N26 | C28 | H28 | 179.3° | 180.0° |
| N26 | C28 | O29 | H28 | 180.0° | 180.0° |
| C28 | N26 | O27 | HO27 | 0.4° | 0.1° |
| C30 | N31 | C32 | C33 | 0.1° | 0.0° |
| N31 | C30 | N36 | C35 | 0.1° | 0.5° |
| N31 | C30 | C2 | H2 | 179.9° | 0.1° |
| C30 | N31 | C32 | H32 | 180.0° | 179.9° |
| N36 | C30 | N31 | C32 | 0.1° | 0.3° |
| C30 | N36 | C35 | C33 | 0.1° | 0.6° |
| N36 | C30 | C2 | H2 | 1.0° | 179.7° |
| C30 | N36 | C35 | H35 | 179.9° | 179.7° |
| N31 | C32 | C33 | H32 | 180.0° | 179.9° |
| N31 | C32 | C33 | F34 | 179.2° | 180.0° |
| N31 | C32 | C33 | C35 | 0.2° | 0.1° |
| C32 | C33 | F34 | C35 | 179.0° | 180.0° |
| C32 | C33 | C35 | N36 | 0.2° | 0.3° |
| C32 | C33 | C35 | H35 | 179.8° | 180.0° |
| F34 | C33 | C35 | N36 | 179.2° | 179.7° |
| F34 | C33 | C32 | H32 | 0.9° | 0.0° |
| F34 | C33 | C35 | H35 | 0.8° | 0.0° |
| C33 | C35 | N36 | H35 | 180.0° | 179.7° |
| C35 | C33 | C32 | H32 | 179.8° | 180.0° |
| H1 | C1 | H1A | H1B | 120.0° | 120.0° |
| H1 | C1 | C2 | H2 | 60.6° | 56.6° |
| H1A | C1 | C2 | H2 | 179.5° | 63.4° |
| H1B | C1 | C2 | H2 | 59.4° | 176.6° |
| H2 | C2 | C3 | H3 | 87.0° | 67.3° |
| H2 | C2 | C3 | H3A | 153.0° | 172.6° |
| H5 | C5 | H5A | H5B | 120.0° | 120.1° |
| H11 | C11 | C12 | H12 | 57.9° | 54.5° |
| H11 | C11 | C12 | H12A | 62.0° | 65.6° |
| H11A | C11 | C12 | H12 | 177.9° | 174.9° |
| H11A | C11 | C12 | H12A | 58.0° | 54.8° |
| H12 | C12 | C13 | H13 | 175.5° | 178.7° |
| H12A | C12 | C13 | H13 | 64.5° | 61.3° |
| H13 | C13 | C14 | H14 | 176.6° | 178.6° |
| H13 | C13 | C14 | H14A | 56.5° | 61.3° |
| H14 | C14 | C15 | H15 | 169.2° | 175.1° |
| H14 | C14 | C15 | H15A | 49.2° | 54.5° |
| H14A | C14 | C15 | H15 | 49.2° | 55.0° |
| H14A | C14 | C15 | H15A | 70.8° | 65.6° |
| H19 | C19 | C20 | H20 | 0.0° | 0.0° |
