XVW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C2 | doub | 1.21Å | 1.23Å | |
| C2 | N3 | sing | 1.35Å | 1.43Å | |
| C2 | C21 | sing | 1.51Å | 1.54Å | |
| N3 | C4 | sing | 1.47Å | 1.48Å | |
| N3 | C20 | sing | 1.47Å | 1.47Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C5 | C6 | sing | 1.53Å | 1.58Å | |
| C6 | S7 | sing | 1.81Å | 1.89Å | |
| C6 | C19 | sing | 1.53Å | 1.54Å | |
| S7 | C8 | sing | 1.76Å | 1.74Å | |
| C8 | C9 | doub | 1.39Å | 1.38Å | Aromatic |
| C8 | N18 | sing | 1.32Å | 1.38Å | Aromatic |
| C9 | F10 | sing | 1.35Å | 1.34Å | |
| C9 | C11 | sing | 1.38Å | 1.45Å | Aromatic |
| C11 | C12 | doub | 1.39Å | 1.42Å | Aromatic |
| C12 | S13 | sing | 1.76Å | 1.74Å | |
| C12 | C17 | sing | 1.38Å | 1.41Å | Aromatic |
| S13 | O14 | doub | 1.42Å | 1.43Å | |
| S13 | N15 | sing | 1.66Å | 1.64Å | |
| S13 | O16 | doub | 1.42Å | 1.46Å | |
| C17 | N18 | doub | 1.32Å | 1.36Å | Aromatic |
| C19 | C20 | sing | 1.53Å | 1.57Å | |
| C21 | C22 | sing | 1.53Å | 1.54Å | |
| C22 | C23 | sing | 1.51Å | 1.53Å | |
| C23 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C28 | sing | 1.38Å | 1.42Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C36 | sing | 1.51Å | 1.49Å | |
| C27 | C28 | doub | 1.38Å | 1.41Å | Aromatic |
| C28 | C29 | sing | 1.51Å | 1.50Å | |
| C29 | N30 | sing | 1.47Å | 1.43Å | |
| N30 | N31 | sing | 1.29Å | 1.36Å | Aromatic |
| N30 | N34 | sing | 1.29Å | 1.37Å | Aromatic |
| N31 | N32 | doub | 1.29Å | 1.30Å | Aromatic |
| N32 | C33 | sing | 1.33Å | 1.44Å | Aromatic |
| C33 | N34 | doub | 1.31Å | 1.36Å | Aromatic |
| C33 | C35 | sing | 1.51Å | 1.46Å | |
| C36 | F37 | sing | 1.40Å | 1.35Å | |
| C36 | F38 | sing | 1.40Å | 1.33Å | |
| C36 | F39 | sing | 1.40Å | 1.34Å | |
| C11 | H45 | sing | 1.08Å | 1.08Å | |
| C17 | H48 | sing | 1.08Å | 1.08Å | |
| C19 | H49 | sing | 1.09Å | 1.10Å | |
| C19 | H50 | sing | 1.09Å | 1.10Å | |
| C20 | H52 | sing | 1.09Å | 1.10Å | |
| C20 | H51 | sing | 1.09Å | 1.10Å | |
| C21 | H54 | sing | 1.09Å | 1.10Å | |
| C21 | H53 | sing | 1.09Å | 1.10Å | |
| C22 | H55 | sing | 1.09Å | 1.10Å | |
| C22 | H56 | sing | 1.09Å | 1.10Å | |
| C24 | H57 | sing | 1.08Å | 1.08Å | |
| C25 | H58 | sing | 1.08Å | 1.08Å | |
| C27 | H59 | sing | 1.08Å | 1.08Å | |
| C4 | H40 | sing | 1.09Å | 1.10Å | |
| C4 | H41 | sing | 1.09Å | 1.10Å | |
| C5 | H42 | sing | 1.09Å | 1.10Å | |
| C5 | H43 | sing | 1.09Å | 1.10Å | |
| C6 | H44 | sing | 1.09Å | 1.10Å | |
| N15 | H47 | sing | 0.97Å | 1.00Å | |
| N15 | H46 | sing | 0.97Å | 1.00Å | |
| C29 | H61 | sing | 1.09Å | 1.10Å | |
| C29 | H60 | sing | 1.09Å | 1.10Å | |
| C35 | H62 | sing | 1.09Å | 1.10Å | |
| C35 | H64 | sing | 1.09Å | 1.10Å | |
| C35 | H63 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C2 | N3 | 119.2° | 120.0° |
| O1 | C2 | C21 | 120.6° | 120.0° |
| N3 | C2 | C21 | 120.1° | 120.0° |
| C2 | N3 | C4 | 124.9° | 120.6° |
| C2 | N3 | C20 | 125.8° | 120.7° |
| C2 | C21 | C22 | 112.9° | 109.5° |
| C2 | C21 | H54 | 108.6° | 109.4° |
| C2 | C21 | H53 | 108.6° | 109.5° |
| C4 | N3 | C20 | 109.2° | 118.7° |
| N3 | C4 | C5 | 105.8° | 108.8° |
| N3 | C4 | H40 | 110.4° | 109.6° |
| N3 | C4 | H41 | 110.4° | 109.6° |
| N3 | C20 | C19 | 107.8° | 108.8° |
| N3 | C20 | H52 | 109.9° | 109.6° |
| N3 | C20 | H51 | 109.9° | 109.6° |
| C4 | C5 | C6 | 112.4° | 109.3° |
| C5 | C4 | H40 | 110.4° | 109.5° |
| C5 | C4 | H41 | 110.4° | 109.6° |
| C4 | C5 | H42 | 108.7° | 109.5° |
| C4 | C5 | H43 | 108.7° | 109.5° |
| C5 | C6 | S7 | 99.6° | 109.4° |
| C5 | C6 | C19 | 108.7° | 109.6° |
| C6 | C5 | H42 | 108.7° | 109.5° |
| C6 | C5 | H43 | 108.8° | 109.5° |
| C5 | C6 | H44 | 109.4° | 109.5° |
| S7 | C6 | C19 | 122.4° | 109.4° |
| C6 | S7 | C8 | 131.2° | 103.0° |
| S7 | C6 | H44 | 106.0° | 109.4° |
| C6 | C19 | C20 | 106.4° | 109.3° |
| C6 | C19 | H49 | 110.2° | 109.5° |
| C6 | C19 | H50 | 110.2° | 109.5° |
| C19 | C6 | H44 | 109.9° | 109.4° |
| S7 | C8 | C9 | 129.5° | 119.7° |
| S7 | C8 | N18 | 109.9° | 119.7° |
| C9 | C8 | N18 | 118.4° | 120.6° |
| C8 | C9 | F10 | 117.6° | 120.5° |
| C8 | C9 | C11 | 120.8° | 119.1° |
| C8 | N18 | C17 | 120.5° | 121.6° |
| F10 | C9 | C11 | 121.5° | 120.5° |
| C9 | C11 | C12 | 120.4° | 118.5° |
| C9 | C11 | H45 | 119.8° | 120.8° |
| C11 | C12 | S13 | 124.4° | 120.3° |
| C11 | C12 | C17 | 113.8° | 119.3° |
| C12 | C11 | H45 | 119.8° | 120.7° |
| S13 | C12 | C17 | 121.6° | 120.3° |
| C12 | S13 | O14 | 105.5° | 106.4° |
| C12 | S13 | N15 | 104.7° | 107.2° |
| C12 | S13 | O16 | 110.3° | 106.4° |
| C12 | C17 | N18 | 125.6° | 120.9° |
| C12 | C17 | H48 | 117.2° | 119.5° |
| O14 | S13 | N15 | 109.6° | 106.4° |
| O14 | S13 | O16 | 121.6° | 123.2° |
| N15 | S13 | O16 | 104.0° | 106.4° |
| S13 | N15 | H47 | 109.5° | 120.0° |
| S13 | N15 | H46 | 109.5° | 120.0° |
| N18 | C17 | H48 | 117.2° | 119.6° |
| C20 | C19 | H49 | 110.2° | 109.5° |
| C20 | C19 | H50 | 110.2° | 109.5° |
| C19 | C20 | H52 | 109.9° | 109.6° |
| C19 | C20 | H51 | 109.9° | 109.6° |
| C21 | C22 | C23 | 112.2° | 109.5° |
| C22 | C21 | H54 | 108.6° | 109.4° |
| C22 | C21 | H53 | 108.6° | 109.5° |
| C21 | C22 | H55 | 108.8° | 109.5° |
| C21 | C22 | H56 | 108.8° | 109.4° |
| C22 | C23 | C24 | 117.1° | 120.0° |
| C22 | C23 | C28 | 124.6° | 120.0° |
| C23 | C22 | H55 | 108.8° | 109.5° |
| C23 | C22 | H56 | 108.8° | 109.5° |
| C24 | C23 | C28 | 118.3° | 120.0° |
| C23 | C24 | C25 | 121.4° | 120.0° |
| C23 | C24 | H57 | 119.3° | 120.0° |
| C23 | C28 | C27 | 120.4° | 120.0° |
| C23 | C28 | C29 | 123.1° | 120.0° |
| C24 | C25 | C26 | 120.1° | 120.0° |
| C25 | C24 | H57 | 119.3° | 120.0° |
| C24 | C25 | H58 | 119.9° | 120.0° |
| C25 | C26 | C27 | 120.8° | 120.0° |
| C25 | C26 | C36 | 119.4° | 120.0° |
| C26 | C25 | H58 | 120.0° | 120.0° |
| C27 | C26 | C36 | 119.7° | 120.0° |
| C26 | C27 | C28 | 118.9° | 120.0° |
| C26 | C27 | H59 | 120.5° | 120.0° |
| C26 | C36 | F37 | 114.6° | 109.5° |
| C26 | C36 | F38 | 114.2° | 109.5° |
| C26 | C36 | F39 | 112.8° | 109.5° |
| C27 | C28 | C29 | 116.3° | 120.0° |
| C28 | C27 | H59 | 120.5° | 120.0° |
| C28 | C29 | N30 | 111.4° | 109.5° |
| C28 | C29 | H61 | 109.0° | 109.5° |
| C28 | C29 | H60 | 109.0° | 109.5° |
| C29 | N30 | N31 | 123.9° | 125.4° |
| C29 | N30 | N34 | 122.8° | 125.4° |
| N30 | C29 | H61 | 109.0° | 109.4° |
| N30 | C29 | H60 | 109.0° | 109.5° |
| N31 | N30 | N34 | 113.2° | 109.1° |
| N30 | N31 | N32 | 106.8° | 108.7° |
| N30 | N34 | C33 | 102.8° | 107.9° |
| N31 | N32 | C33 | 107.7° | 107.3° |
| N32 | C33 | N34 | 109.5° | 106.9° |
| N32 | C33 | C35 | 123.7° | 126.5° |
| N34 | C33 | C35 | 126.8° | 126.6° |
| C33 | C35 | H62 | 109.5° | 109.4° |
| C33 | C35 | H64 | 109.5° | 109.5° |
| C33 | C35 | H63 | 109.5° | 109.5° |
| F37 | C36 | F38 | 108.4° | 109.5° |
| F37 | C36 | F39 | 107.0° | 109.5° |
| F38 | C36 | F39 | 98.5° | 109.4° |
| H49 | C19 | H50 | 109.5° | 109.5° |
| H52 | C20 | H51 | 109.4° | 109.6° |
| H54 | C21 | H53 | 109.4° | 109.5° |
| H55 | C22 | H56 | 109.5° | 109.5° |
| H40 | C4 | H41 | 109.5° | 109.8° |
| H42 | C5 | H43 | 109.5° | 109.5° |
| H47 | N15 | H46 | 109.5° | 120.0° |
| H61 | C29 | H60 | 109.5° | 109.5° |
| H62 | C35 | H64 | 109.5° | 109.5° |
| H62 | C35 | H63 | 109.5° | 109.4° |
| H64 | C35 | H63 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C2 | N3 | C21 | 178.6° | 179.9° |
| O1 | C2 | N3 | C4 | 178.0° | 0.1° |
| O1 | C2 | N3 | C20 | 2.3° | 180.0° |
| O1 | C2 | C21 | C22 | 11.9° | 0.1° |
| O1 | C2 | C21 | H54 | 132.5° | 120.0° |
| O1 | C2 | C21 | H53 | 108.6° | 119.9° |
| C2 | N3 | C4 | C20 | 176.3° | 180.0° |
| C2 | N3 | C4 | C5 | 109.6° | 126.4° |
| C2 | N3 | C20 | C19 | 104.1° | 126.3° |
| N3 | C2 | C21 | C22 | 166.6° | 180.0° |
| C2 | N3 | C20 | H52 | 15.6° | 113.8° |
| C2 | N3 | C20 | H51 | 136.1° | 6.5° |
| N3 | C2 | C21 | H54 | 46.0° | 60.1° |
| N3 | C2 | C21 | H53 | 72.9° | 60.0° |
| C2 | N3 | C4 | H40 | 131.0° | 113.9° |
| C2 | N3 | C4 | H41 | 9.8° | 6.6° |
| C21 | C2 | N3 | C4 | 0.6° | 179.9° |
| C21 | C2 | N3 | C20 | 176.2° | 0.1° |
| C2 | C21 | C22 | H54 | 120.5° | 119.9° |
| C2 | C21 | C22 | H53 | 120.5° | 120.1° |
| C2 | C21 | C22 | C23 | 178.2° | 180.0° |
| C2 | C21 | H54 | H53 | 118.4° | 120.1° |
| C2 | C21 | C22 | H55 | 57.7° | 59.9° |
| C2 | C21 | C22 | H56 | 61.4° | 60.0° |
| N3 | C4 | C5 | H40 | 119.4° | 119.8° |
| N3 | C4 | C5 | H41 | 119.4° | 119.8° |
| N3 | C4 | C5 | C6 | 58.2° | 54.6° |
| C4 | N3 | C20 | C19 | 72.1° | 53.6° |
| C4 | N3 | C20 | H52 | 168.1° | 66.2° |
| C4 | N3 | C20 | H51 | 47.6° | 173.5° |
| N3 | C4 | H40 | H41 | 121.7° | 120.4° |
| N3 | C4 | C5 | H42 | 178.7° | 174.6° |
| N3 | C4 | C5 | H43 | 62.2° | 65.3° |
| C20 | N3 | C4 | C5 | 66.6° | 53.6° |
| N3 | C20 | C19 | C6 | 65.0° | 54.6° |
| N3 | C20 | C19 | H52 | 119.8° | 119.8° |
| N3 | C20 | C19 | H51 | 119.8° | 119.9° |
| N3 | C20 | C19 | H49 | 175.5° | 65.2° |
| N3 | C20 | C19 | H50 | 54.5° | 174.6° |
| N3 | C20 | H52 | H51 | 120.8° | 120.3° |
| C20 | N3 | C4 | H40 | 52.7° | 66.1° |
| C20 | N3 | C4 | H41 | 173.9° | 173.4° |
| C4 | C5 | C6 | H42 | 120.4° | 120.0° |
| C4 | C5 | C6 | H43 | 120.4° | 119.9° |
| C4 | C5 | C6 | S7 | 175.5° | 178.6° |
| C4 | C5 | C6 | C19 | 55.3° | 61.3° |
| C5 | C4 | H40 | H41 | 121.7° | 120.3° |
| C4 | C5 | H42 | H43 | 118.6° | 120.1° |
| C4 | C5 | C6 | H44 | 64.6° | 58.7° |
| C5 | C6 | S7 | C19 | 119.5° | 120.1° |
| C5 | C6 | S7 | H44 | 113.5° | 120.0° |
| C5 | C6 | C19 | H44 | 119.6° | 120.0° |
| C5 | C6 | S7 | C8 | 93.8° | 175.0° |
| C5 | C6 | C19 | C20 | 55.6° | 61.4° |
| C5 | C6 | C19 | H49 | 175.1° | 58.5° |
| C5 | C6 | C19 | H50 | 63.9° | 178.6° |
| C6 | C5 | C4 | H40 | 61.2° | 65.2° |
| C6 | C5 | C4 | H41 | 177.6° | 174.4° |
| C6 | C5 | H42 | H43 | 118.7° | 120.1° |
| S7 | C6 | C19 | H44 | 125.3° | 119.9° |
| C6 | S7 | C8 | C9 | 18.5° | 180.0° |
| C6 | S7 | C8 | N18 | 144.3° | 0.5° |
| S7 | C6 | C19 | C20 | 170.7° | 178.6° |
| S7 | C6 | C19 | H49 | 69.8° | 61.5° |
| S7 | C6 | C19 | H50 | 51.2° | 58.6° |
| S7 | C6 | C5 | H42 | 55.1° | 58.6° |
| S7 | C6 | C5 | H43 | 64.0° | 61.5° |
| C19 | C6 | S7 | C8 | 25.7° | 64.9° |
| C6 | C19 | C20 | H49 | 119.5° | 119.9° |
| C6 | C19 | C20 | H50 | 119.5° | 120.0° |
| C6 | C19 | H49 | H50 | 121.4° | 120.1° |
| C6 | C19 | C20 | H52 | 175.2° | 65.2° |
| C6 | C19 | C20 | H51 | 54.8° | 174.5° |
| C19 | C6 | C5 | H42 | 175.8° | 178.7° |
| C19 | C6 | C5 | H43 | 65.1° | 58.5° |
| S7 | C8 | C9 | N18 | 161.5° | 179.4° |
| S7 | C8 | C9 | F10 | 28.8° | 0.1° |
| S7 | C8 | C9 | C11 | 155.9° | 180.0° |
| S7 | C8 | N18 | C17 | 159.1° | 179.8° |
| C8 | S7 | C6 | H44 | 152.7° | 55.0° |
| C8 | C9 | F10 | C11 | 175.3° | 179.9° |
| C8 | C9 | C11 | C12 | 0.7° | 0.0° |
| C9 | C8 | N18 | C17 | 5.8° | 0.8° |
| C8 | C9 | C11 | H45 | 179.3° | 179.7° |
| N18 | C8 | C9 | F10 | 169.7° | 179.5° |
| N18 | C8 | C9 | C11 | 5.6° | 0.6° |
| C8 | N18 | C17 | C12 | 0.9° | 0.5° |
| C8 | N18 | C17 | H48 | 179.1° | 180.0° |
| F10 | C9 | C11 | C12 | 174.4° | 180.0° |
| F10 | C9 | C11 | H45 | 5.6° | 0.2° |
| C9 | C11 | C12 | H45 | 180.0° | 179.7° |
| C9 | C11 | C12 | S13 | 171.4° | 179.8° |
| C9 | C11 | C12 | C17 | 3.8° | 0.3° |
| C11 | C12 | S13 | C17 | 174.8° | 180.0° |
| C11 | C12 | S13 | O14 | 12.0° | 156.5° |
| C11 | C12 | S13 | N15 | 127.6° | 90.0° |
| C11 | C12 | S13 | O16 | 121.0° | 23.6° |
| C11 | C12 | C17 | N18 | 3.9° | 0.1° |
| C11 | C12 | C17 | H48 | 176.1° | 179.5° |
| C12 | S13 | O14 | N15 | 112.2° | 114.1° |
| C12 | S13 | O14 | O16 | 126.4° | 122.9° |
| C12 | S13 | N15 | O16 | 115.8° | 113.5° |
| S13 | C12 | C17 | N18 | 171.5° | 180.0° |
| S13 | C12 | C11 | H45 | 8.6° | 0.0° |
| S13 | C12 | C17 | H48 | 8.5° | 0.5° |
| C12 | S13 | N15 | H47 | 180.0° | 150.0° |
| C12 | S13 | N15 | H46 | 60.0° | 29.9° |
| C17 | C12 | S13 | O14 | 173.1° | 23.5° |
| C17 | C12 | S13 | N15 | 57.5° | 90.0° |
| C17 | C12 | S13 | O16 | 53.8° | 156.4° |
| C12 | C17 | N18 | H48 | 180.0° | 179.5° |
| C17 | C12 | C11 | H45 | 176.2° | 180.0° |
| O14 | S13 | N15 | O16 | 131.5° | 132.9° |
| O14 | S13 | N15 | H47 | 67.3° | 36.4° |
| O14 | S13 | N15 | H46 | 52.7° | 143.5° |
| S13 | N15 | H47 | H46 | 120.0° | 179.9° |
| O16 | S13 | N15 | H47 | 64.2° | 96.5° |
| O16 | S13 | N15 | H46 | 175.8° | 83.6° |
| C20 | C19 | H49 | H50 | 121.4° | 120.1° |
| C19 | C20 | H52 | H51 | 120.8° | 120.3° |
| C20 | C19 | C6 | H44 | 64.0° | 58.7° |
| C21 | C22 | C23 | H55 | 120.4° | 120.0° |
| C21 | C22 | C23 | H56 | 120.4° | 120.0° |
| C21 | C22 | C23 | C24 | 102.3° | 95.0° |
| C21 | C22 | C23 | C28 | 78.5° | 84.8° |
| C22 | C21 | H54 | H53 | 118.4° | 120.0° |
| C21 | C22 | H55 | H56 | 118.7° | 120.0° |
| C22 | C23 | C24 | C28 | 179.2° | 179.8° |
| C22 | C23 | C24 | C25 | 179.5° | 180.0° |
| C22 | C23 | C28 | C27 | 180.0° | 179.8° |
| C22 | C23 | C28 | C29 | 4.8° | 0.1° |
| C23 | C22 | C21 | H54 | 61.3° | 60.1° |
| C23 | C22 | C21 | H53 | 57.6° | 60.0° |
| C23 | C22 | H55 | H56 | 118.8° | 120.0° |
| C22 | C23 | C24 | H57 | 0.5° | 0.1° |
| C23 | C24 | C25 | H57 | 180.0° | 179.9° |
| C23 | C24 | C25 | C26 | 0.1° | 0.0° |
| C24 | C23 | C28 | C27 | 0.8° | 0.4° |
| C24 | C23 | C28 | C29 | 174.4° | 179.7° |
| C24 | C23 | C22 | H55 | 18.1° | 145.0° |
| C24 | C23 | C22 | H56 | 137.3° | 25.0° |
| C23 | C24 | C25 | H58 | 179.9° | 179.9° |
| C28 | C23 | C24 | C25 | 0.3° | 0.2° |
| C23 | C28 | C27 | C26 | 1.0° | 0.4° |
| C23 | C28 | C27 | C29 | 175.5° | 179.9° |
| C23 | C28 | C29 | N30 | 117.9° | 85.1° |
| C28 | C23 | C22 | H55 | 161.1° | 35.2° |
| C28 | C23 | C22 | H56 | 41.9° | 155.2° |
| C28 | C23 | C24 | H57 | 179.8° | 179.8° |
| C23 | C28 | C27 | H59 | 179.0° | 179.8° |
| C23 | C28 | C29 | H61 | 121.8° | 154.9° |
| C23 | C28 | C29 | H60 | 2.4° | 34.9° |
| C24 | C25 | C26 | H58 | 180.0° | 179.9° |
| C24 | C25 | C26 | C27 | 0.2° | 0.0° |
| C24 | C25 | C26 | C36 | 177.3° | 179.9° |
| C25 | C26 | C27 | C36 | 177.5° | 179.9° |
| C25 | C26 | C27 | C28 | 0.7° | 0.2° |
| C25 | C26 | C36 | F37 | 172.9° | 0.0° |
| C25 | C26 | C36 | F38 | 46.9° | 120.0° |
| C25 | C26 | C36 | F39 | 64.5° | 120.0° |
| C26 | C25 | C24 | H57 | 179.9° | 180.0° |
| C25 | C26 | C27 | H59 | 179.3° | 180.0° |
| C26 | C27 | C28 | H59 | 180.0° | 179.8° |
| C26 | C27 | C28 | C29 | 174.5° | 179.7° |
| C27 | C26 | C36 | F37 | 9.6° | 180.0° |
| C27 | C26 | C36 | F38 | 135.5° | 60.0° |
| C27 | C26 | C36 | F39 | 113.1° | 59.9° |
| C27 | C26 | C25 | H58 | 179.8° | 179.9° |
| C36 | C26 | C27 | C28 | 176.8° | 179.9° |
| C26 | C36 | F37 | F38 | 128.9° | 120.0° |
| C26 | C36 | F37 | F39 | 125.8° | 120.0° |
| C26 | C36 | F38 | F39 | 119.8° | 120.0° |
| C36 | C26 | C25 | H58 | 2.7° | 0.0° |
| C36 | C26 | C27 | H59 | 3.2° | 0.0° |
| C27 | C28 | C29 | N30 | 66.8° | 94.8° |
| C27 | C28 | C29 | H61 | 53.5° | 25.2° |
| C27 | C28 | C29 | H60 | 172.9° | 145.2° |
| C28 | C29 | N30 | H61 | 120.3° | 120.0° |
| C28 | C29 | N30 | H60 | 120.3° | 120.0° |
| C28 | C29 | N30 | N31 | 93.3° | 90.0° |
| C28 | C29 | N30 | N34 | 90.7° | 90.3° |
| C29 | C28 | C27 | H59 | 5.5° | 0.1° |
| C28 | C29 | H61 | H60 | 119.1° | 120.0° |
| C29 | N30 | N31 | N34 | 176.3° | 179.7° |
| C29 | N30 | N31 | N32 | 175.8° | 180.0° |
| C29 | N30 | N34 | C33 | 175.6° | 179.9° |
| N30 | C29 | H61 | H60 | 119.1° | 120.0° |
| N30 | N31 | N32 | C33 | 0.0° | 0.0° |
| N31 | N30 | N34 | C33 | 0.8° | 0.4° |
| N31 | N30 | C29 | H61 | 27.0° | 30.0° |
| N31 | N30 | C29 | H60 | 146.4° | 150.0° |
| N34 | N30 | N31 | N32 | 0.5° | 0.2° |
| N30 | N34 | C33 | N32 | 0.8° | 0.4° |
| N30 | N34 | C33 | C35 | 178.6° | 179.8° |
| N34 | N30 | C29 | H61 | 149.0° | 149.7° |
| N34 | N30 | C29 | H60 | 29.6° | 29.7° |
| N31 | N32 | C33 | N34 | 0.5° | 0.2° |
| N31 | N32 | C33 | C35 | 178.8° | 179.9° |
| N32 | C33 | N34 | C35 | 179.3° | 179.8° |
| N32 | C33 | C35 | H62 | 0.0° | 90.0° |
| N32 | C33 | C35 | H64 | 120.0° | 150.0° |
| N32 | C33 | C35 | H63 | 120.0° | 29.9° |
| N34 | C33 | C35 | H62 | 179.2° | 89.8° |
| N34 | C33 | C35 | H64 | 59.2° | 30.3° |
| N34 | C33 | C35 | H63 | 60.8° | 150.3° |
| C33 | C35 | H62 | H64 | 120.0° | 120.0° |
| C33 | C35 | H62 | H63 | 120.0° | 120.0° |
| C33 | C35 | H64 | H63 | 120.0° | 120.1° |
| F37 | C36 | F38 | F39 | 111.1° | 120.0° |
| H49 | C19 | C20 | H52 | 55.7° | 174.9° |
| H49 | C19 | C20 | H51 | 64.7° | 54.6° |
| H49 | C19 | C6 | H44 | 55.5° | 178.6° |
| H50 | C19 | C20 | H52 | 65.3° | 54.8° |
| H50 | C19 | C20 | H51 | 174.3° | 65.5° |
| H50 | C19 | C6 | H44 | 176.5° | 61.3° |
| H54 | C21 | C22 | H55 | 178.3° | 60.0° |
| H54 | C21 | C22 | H56 | 59.1° | 179.9° |
| H53 | C21 | C22 | H55 | 62.8° | 180.0° |
| H53 | C21 | C22 | H56 | 178.1° | 60.0° |
| H57 | C24 | C25 | H58 | 0.1° | 0.1° |
| H40 | C4 | C5 | H42 | 59.3° | 54.8° |
| H40 | C4 | C5 | H43 | 178.4° | 174.9° |
| H41 | C4 | C5 | H42 | 61.9° | 65.6° |
| H41 | C4 | C5 | H43 | 57.2° | 54.5° |
| H42 | C5 | C6 | H44 | 55.8° | 61.3° |
| H43 | C5 | C6 | H44 | 174.9° | 178.6° |
| H62 | C35 | H64 | H63 | 120.0° | 119.9° |
