BLF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | CL1 | sing | 1.74Å | 1.75Å | |
| C13 | C2 | doub | 1.39Å | 1.41Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| C40 | CL2 | sing | 1.74Å | 1.75Å | |
| C5 | C3 | doub | 1.39Å | 1.40Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C10 | C5 | sing | 1.41Å | 1.38Å | Aromatic |
| C5 | N6 | sing | 1.38Å | 1.34Å | Aromatic |
| C8 | N6 | sing | 1.38Å | 1.32Å | Aromatic |
| C9 | C8 | doub | 1.39Å | 1.36Å | Aromatic |
| C46 | C8 | sing | 1.46Å | 1.47Å | |
| C15 | C9 | sing | 1.47Å | 1.49Å | |
| C9 | C10 | sing | 1.47Å | 1.51Å | Aromatic |
| C11 | C10 | doub | 1.40Å | 1.39Å | Aromatic |
| C11 | C13 | sing | 1.37Å | 1.40Å | Aromatic |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C20 | C15 | doub | 1.39Å | 1.36Å | Aromatic |
| C15 | N16 | sing | 1.38Å | 1.34Å | Aromatic |
| C17 | N16 | sing | 1.35Å | 1.31Å | Aromatic |
| N16 | C32 | sing | 1.47Å | 1.46Å | |
| N19 | C17 | doub | 1.30Å | 1.26Å | Aromatic |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| N19 | C20 | sing | 1.35Å | 1.44Å | Aromatic |
| C21 | C20 | sing | 1.48Å | 1.51Å | |
| C30 | C21 | doub | 1.40Å | 1.41Å | Aromatic |
| C22 | C21 | sing | 1.40Å | 1.40Å | Aromatic |
| C24 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C26 | C24 | sing | 1.38Å | 1.40Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C26 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C28 | C30 | sing | 1.38Å | 1.40Å | Aromatic |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C32 | C35 | sing | 1.51Å | 1.53Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C36 | C35 | doub | 1.38Å | 1.40Å | Aromatic |
| C35 | C43 | sing | 1.38Å | 1.40Å | Aromatic |
| C36 | C38 | sing | 1.38Å | 1.40Å | Aromatic |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C38 | C40 | doub | 1.38Å | 1.40Å | Aromatic |
| C38 | H38 | sing | 1.08Å | 1.08Å | |
| C40 | C41 | sing | 1.38Å | 1.41Å | Aromatic |
| C43 | C41 | doub | 1.38Å | 1.40Å | Aromatic |
| C41 | H41 | sing | 1.08Å | 1.08Å | |
| C43 | H43 | sing | 1.08Å | 1.08Å | |
| N48 | C46 | sing | 1.35Å | 1.35Å | |
| C46 | O47 | doub | 1.22Å | 1.23Å | |
| C50 | N48 | sing | 1.46Å | 1.46Å | |
| N48 | HN48 | sing | 0.97Å | 1.00Å | |
| C53 | C50 | sing | 1.53Å | 1.55Å | |
| C50 | H50 | sing | 1.09Å | 1.10Å | |
| C50 | H50A | sing | 1.09Å | 1.10Å | |
| N56 | C53 | sing | 1.47Å | 1.49Å | |
| C53 | H53 | sing | 1.09Å | 1.10Å | |
| C53 | H53A | sing | 1.09Å | 1.10Å | |
| C57 | N56 | sing | 1.47Å | 1.48Å | |
| N56 | C67 | sing | 1.47Å | 1.49Å | |
| C60 | C57 | sing | 1.53Å | 1.55Å | |
| C57 | H57 | sing | 1.09Å | 1.10Å | |
| C57 | H57A | sing | 1.09Å | 1.10Å | |
| C60 | O63 | sing | 1.43Å | 1.44Å | |
| C60 | H60 | sing | 1.09Å | 1.10Å | |
| C60 | H60A | sing | 1.09Å | 1.10Å | |
| O63 | C64 | sing | 1.43Å | 1.44Å | |
| C64 | C67 | sing | 1.53Å | 1.55Å | |
| C64 | H64 | sing | 1.09Å | 1.10Å | |
| C64 | H64A | sing | 1.09Å | 1.10Å | |
| C67 | H67 | sing | 1.09Å | 1.10Å | |
| C67 | H67A | sing | 1.09Å | 1.10Å | |
| N6 | HN6 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL1 | C2 | C13 | 119.4° | 119.7° |
| CL1 | C2 | C3 | 118.7° | 119.7° |
| C13 | C2 | C3 | 121.9° | 120.6° |
| C2 | C13 | C11 | 121.1° | 120.4° |
| C2 | C13 | H13 | 119.4° | 119.7° |
| C2 | C3 | C5 | 116.2° | 119.9° |
| C2 | C3 | H3 | 121.9° | 120.1° |
| CL2 | C40 | C38 | 119.5° | 120.0° |
| CL2 | C40 | C41 | 120.0° | 120.0° |
| C5 | C3 | H3 | 121.9° | 120.1° |
| C3 | C5 | C10 | 121.7° | 119.2° |
| C3 | C5 | N6 | 129.0° | 132.7° |
| C10 | C5 | N6 | 109.3° | 108.1° |
| C5 | C10 | C9 | 103.7° | 106.5° |
| C5 | C10 | C11 | 122.7° | 120.0° |
| C5 | N6 | C8 | 111.7° | 110.2° |
| C5 | N6 | HN6 | 124.2° | 124.9° |
| N6 | C8 | C9 | 109.7° | 108.8° |
| N6 | C8 | C46 | 122.4° | 125.6° |
| C8 | N6 | HN6 | 124.2° | 124.9° |
| C9 | C8 | C46 | 127.8° | 125.6° |
| C8 | C9 | C15 | 135.9° | 126.7° |
| C8 | C9 | C10 | 105.7° | 106.4° |
| C8 | C46 | N48 | 121.2° | 120.0° |
| C8 | C46 | O47 | 115.8° | 120.0° |
| C15 | C9 | C10 | 118.3° | 126.9° |
| C9 | C15 | C20 | 129.2° | 126.9° |
| C9 | C15 | N16 | 123.1° | 127.0° |
| C9 | C10 | C11 | 133.6° | 133.5° |
| C10 | C11 | C13 | 116.4° | 119.9° |
| C10 | C11 | H11 | 121.8° | 120.0° |
| C13 | C11 | H11 | 121.8° | 120.1° |
| C11 | C13 | H13 | 119.5° | 119.8° |
| C20 | C15 | N16 | 107.5° | 106.1° |
| C15 | C20 | N19 | 103.1° | 107.3° |
| C15 | C20 | C21 | 134.7° | 126.4° |
| C15 | N16 | C17 | 110.6° | 107.4° |
| C15 | N16 | C32 | 127.0° | 126.3° |
| C17 | N16 | C32 | 122.3° | 126.3° |
| N16 | C17 | N19 | 109.1° | 109.6° |
| N16 | C17 | H17 | 125.5° | 125.2° |
| N16 | C32 | C35 | 113.3° | 109.4° |
| N16 | C32 | H32 | 108.5° | 109.4° |
| N16 | C32 | H32A | 108.5° | 109.5° |
| N19 | C17 | H17 | 125.4° | 125.2° |
| C17 | N19 | C20 | 109.7° | 109.6° |
| N19 | C20 | C21 | 122.2° | 126.4° |
| C20 | C21 | C30 | 121.2° | 120.1° |
| C20 | C21 | C22 | 119.0° | 120.1° |
| C30 | C21 | C22 | 119.8° | 119.8° |
| C21 | C30 | C28 | 120.2° | 119.9° |
| C21 | C30 | H30 | 119.9° | 120.0° |
| C21 | C22 | C24 | 120.2° | 119.8° |
| C21 | C22 | H22 | 119.9° | 120.1° |
| C24 | C22 | H22 | 119.9° | 120.1° |
| C22 | C24 | C26 | 119.5° | 120.2° |
| C22 | C24 | H24 | 120.2° | 119.9° |
| C26 | C24 | H24 | 120.2° | 119.9° |
| C24 | C26 | C28 | 120.6° | 120.3° |
| C24 | C26 | H26 | 119.7° | 119.8° |
| C28 | C26 | H26 | 119.7° | 119.9° |
| C26 | C28 | C30 | 119.7° | 120.1° |
| C26 | C28 | H28 | 120.2° | 119.9° |
| C30 | C28 | H28 | 120.2° | 119.9° |
| C28 | C30 | H30 | 119.9° | 120.1° |
| C35 | C32 | H32 | 108.5° | 109.5° |
| C35 | C32 | H32A | 108.5° | 109.5° |
| C32 | C35 | C36 | 121.7° | 120.0° |
| C32 | C35 | C43 | 117.7° | 120.0° |
| H32 | C32 | H32A | 109.5° | 109.5° |
| C36 | C35 | C43 | 120.6° | 120.0° |
| C35 | C36 | C38 | 120.0° | 120.0° |
| C35 | C36 | H36 | 120.0° | 120.0° |
| C35 | C43 | C41 | 119.5° | 120.0° |
| C35 | C43 | H43 | 120.2° | 120.0° |
| C38 | C36 | H36 | 120.0° | 120.0° |
| C36 | C38 | C40 | 119.5° | 120.0° |
| C36 | C38 | H38 | 120.2° | 120.0° |
| C40 | C38 | H38 | 120.3° | 120.0° |
| C38 | C40 | C41 | 120.6° | 119.9° |
| C40 | C41 | C43 | 119.9° | 120.0° |
| C40 | C41 | H41 | 120.1° | 120.0° |
| C43 | C41 | H41 | 120.0° | 120.0° |
| C41 | C43 | H43 | 120.3° | 120.0° |
| N48 | C46 | O47 | 123.0° | 120.0° |
| C46 | N48 | C50 | 120.9° | 120.0° |
| C46 | N48 | HN48 | 119.5° | 120.0° |
| C50 | N48 | HN48 | 119.5° | 120.1° |
| N48 | C50 | C53 | 108.7° | 109.4° |
| N48 | C50 | H50 | 109.6° | 109.5° |
| N48 | C50 | H50A | 109.7° | 109.5° |
| C53 | C50 | H50 | 109.7° | 109.4° |
| C53 | C50 | H50A | 109.6° | 109.5° |
| C50 | C53 | N56 | 110.2° | 109.5° |
| C50 | C53 | H53 | 109.3° | 109.5° |
| C50 | C53 | H53A | 109.3° | 109.5° |
| H50 | C50 | H50A | 109.5° | 109.5° |
| N56 | C53 | H53 | 109.3° | 109.4° |
| N56 | C53 | H53A | 109.3° | 109.5° |
| C53 | N56 | C57 | 114.6° | 111.0° |
| C53 | N56 | C67 | 115.0° | 111.0° |
| H53 | C53 | H53A | 109.5° | 109.5° |
| C57 | N56 | C67 | 112.7° | 110.7° |
| N56 | C57 | C60 | 109.8° | 109.3° |
| N56 | C57 | H57 | 109.4° | 109.5° |
| N56 | C57 | H57A | 109.4° | 109.5° |
| N56 | C67 | C64 | 109.5° | 109.3° |
| N56 | C67 | H67 | 109.5° | 109.6° |
| N56 | C67 | H67A | 109.5° | 109.5° |
| C60 | C57 | H57 | 109.4° | 109.5° |
| C60 | C57 | H57A | 109.4° | 109.6° |
| C57 | C60 | O63 | 110.4° | 109.2° |
| C57 | C60 | H60 | 109.2° | 109.5° |
| C57 | C60 | H60A | 109.2° | 109.5° |
| H57 | C57 | H57A | 109.5° | 109.5° |
| O63 | C60 | H60 | 109.2° | 109.5° |
| O63 | C60 | H60A | 109.2° | 109.5° |
| C60 | O63 | C64 | 113.5° | 113.8° |
| H60 | C60 | H60A | 109.4° | 109.6° |
| O63 | C64 | C67 | 109.1° | 109.2° |
| O63 | C64 | H64 | 109.6° | 109.5° |
| O63 | C64 | H64A | 109.6° | 109.5° |
| C67 | C64 | H64 | 109.5° | 109.5° |
| C67 | C64 | H64A | 109.6° | 109.4° |
| C64 | C67 | H67 | 109.5° | 109.5° |
| C64 | C67 | H67A | 109.5° | 109.5° |
| H64 | C64 | H64A | 109.5° | 109.6° |
| H67 | C67 | H67A | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL1 | C2 | C13 | C3 | 179.3° | 179.8° |
| CL1 | C2 | C3 | C5 | 179.9° | 180.0° |
| CL1 | C2 | C3 | H3 | 0.1° | 0.0° |
| CL1 | C2 | C13 | C11 | 179.9° | 179.8° |
| CL1 | C2 | C13 | H13 | 0.1° | 0.2° |
| C13 | C2 | C3 | C5 | 0.8° | 0.2° |
| C13 | C2 | C3 | H3 | 179.2° | 179.8° |
| C2 | C13 | C11 | C10 | 0.6° | 0.5° |
| C2 | C13 | C11 | H13 | 180.0° | 179.6° |
| C2 | C13 | C11 | H11 | 179.3° | 179.7° |
| C2 | C3 | C5 | H3 | 180.0° | 180.0° |
| C2 | C3 | C5 | C10 | 0.7° | 0.0° |
| C2 | C3 | C5 | N6 | 179.4° | 180.0° |
| C3 | C2 | C13 | C11 | 0.8° | 0.5° |
| C3 | C2 | C13 | H13 | 179.2° | 180.0° |
| CL2 | C40 | C38 | C36 | 179.5° | 180.0° |
| CL2 | C40 | C38 | C41 | 179.9° | 179.9° |
| CL2 | C40 | C38 | H38 | 0.5° | 0.0° |
| CL2 | C40 | C41 | C43 | 179.9° | 179.7° |
| CL2 | C40 | C41 | H41 | 0.1° | 0.0° |
| C3 | C5 | C10 | N6 | 180.0° | 180.0° |
| C3 | C5 | N6 | C8 | 179.9° | 179.9° |
| C3 | C5 | C10 | C9 | 179.5° | 180.0° |
| C3 | C5 | C10 | C11 | 0.5° | 0.0° |
| C3 | C5 | N6 | HN6 | 0.1° | 0.0° |
| H3 | C3 | C5 | C10 | 179.3° | 180.0° |
| H3 | C3 | C5 | N6 | 0.6° | 0.0° |
| C10 | C5 | N6 | C8 | 0.1° | 0.0° |
| C5 | C10 | C9 | C8 | 0.9° | 0.0° |
| C5 | C10 | C9 | C15 | 178.1° | 180.0° |
| C5 | C10 | C9 | C11 | 180.0° | 180.0° |
| C5 | C10 | C11 | C13 | 0.5° | 0.2° |
| C5 | C10 | C11 | H11 | 179.5° | 180.0° |
| C10 | C5 | N6 | HN6 | 179.9° | 179.9° |
| C5 | N6 | C8 | HN6 | 180.0° | 179.9° |
| C5 | N6 | C8 | C9 | 0.8° | 0.1° |
| C5 | N6 | C8 | C46 | 179.0° | 180.0° |
| N6 | C5 | C10 | C9 | 0.5° | 0.0° |
| N6 | C5 | C10 | C11 | 179.5° | 180.0° |
| N6 | C8 | C9 | C46 | 178.1° | 179.9° |
| N6 | C8 | C9 | C15 | 177.4° | 180.0° |
| N6 | C8 | C9 | C10 | 1.0° | 0.1° |
| N6 | C8 | C46 | N48 | 171.1° | 0.1° |
| N6 | C8 | C46 | O47 | 6.4° | 180.0° |
| C8 | C9 | C15 | C10 | 176.0° | 179.9° |
| C8 | C9 | C10 | C11 | 179.1° | 179.9° |
| C8 | C9 | C15 | C20 | 117.9° | 90.3° |
| C8 | C9 | C15 | N16 | 67.9° | 90.1° |
| C9 | C8 | C46 | N48 | 6.8° | 179.9° |
| C9 | C8 | C46 | O47 | 175.7° | 0.1° |
| C9 | C8 | N6 | HN6 | 179.2° | 180.0° |
| C46 | C8 | C9 | C15 | 4.5° | 0.1° |
| C46 | C8 | C9 | C10 | 179.1° | 180.0° |
| C8 | C46 | N48 | O47 | 177.3° | 180.0° |
| C8 | C46 | N48 | C50 | 178.7° | 179.9° |
| C8 | C46 | N48 | HN48 | 1.3° | 0.0° |
| C46 | C8 | N6 | HN6 | 1.0° | 0.1° |
| C15 | C9 | C10 | C11 | 1.9° | 0.0° |
| C9 | C15 | C20 | N16 | 174.9° | 179.6° |
| C9 | C15 | N16 | C17 | 177.6° | 179.9° |
| C9 | C15 | N16 | C32 | 5.1° | 0.2° |
| C9 | C15 | C20 | N19 | 176.8° | 179.9° |
| C9 | C15 | C20 | C21 | 5.0° | 0.4° |
| C9 | C10 | C11 | C13 | 179.5° | 179.8° |
| C9 | C10 | C11 | H11 | 0.5° | 0.0° |
| C10 | C9 | C15 | C20 | 66.1° | 89.6° |
| C10 | C9 | C15 | N16 | 108.2° | 90.0° |
| C10 | C11 | C13 | H11 | 180.0° | 179.8° |
| C10 | C11 | C13 | H13 | 179.4° | 180.0° |
| H11 | C11 | C13 | H13 | 0.6° | 0.2° |
| C20 | C15 | N16 | C17 | 2.3° | 0.3° |
| C20 | C15 | N16 | C32 | 179.6° | 179.8° |
| C15 | C20 | N19 | C17 | 0.8° | 0.5° |
| C15 | C20 | N19 | C21 | 178.5° | 179.5° |
| C15 | C20 | C21 | C30 | 155.6° | 35.9° |
| C15 | C20 | C21 | C22 | 26.5° | 144.5° |
| C15 | N16 | C17 | C32 | 177.5° | 179.9° |
| C15 | N16 | C17 | N19 | 1.8° | 0.0° |
| C15 | N16 | C17 | H17 | 178.2° | 179.9° |
| N16 | C15 | C20 | N19 | 1.8° | 0.5° |
| N16 | C15 | C20 | C21 | 180.0° | 180.0° |
| C15 | N16 | C32 | C35 | 63.3° | 85.1° |
| C15 | N16 | C32 | H32 | 57.3° | 155.0° |
| C15 | N16 | C32 | H32A | 176.1° | 35.0° |
| N16 | C17 | N19 | H17 | 180.0° | 179.9° |
| N16 | C17 | N19 | C20 | 0.5° | 0.3° |
| C17 | N16 | C32 | C35 | 119.7° | 95.0° |
| C17 | N16 | C32 | H32 | 119.7° | 24.9° |
| C17 | N16 | C32 | H32A | 0.9° | 144.9° |
| C32 | N16 | C17 | N19 | 179.2° | 179.9° |
| C32 | N16 | C17 | H17 | 0.8° | 0.0° |
| N16 | C32 | C35 | H32 | 120.6° | 119.9° |
| N16 | C32 | C35 | H32A | 120.6° | 120.0° |
| N16 | C32 | H32 | H32A | 118.3° | 120.0° |
| N16 | C32 | C35 | C36 | 37.9° | 89.8° |
| N16 | C32 | C35 | C43 | 142.6° | 90.0° |
| C17 | N19 | C20 | C21 | 179.3° | 180.0° |
| H17 | C17 | N19 | C20 | 179.5° | 179.8° |
| N19 | C20 | C21 | C30 | 26.4° | 144.7° |
| N19 | C20 | C21 | C22 | 151.4° | 34.9° |
| C20 | C21 | C30 | C22 | 177.8° | 179.6° |
| C20 | C21 | C22 | C24 | 178.8° | 180.0° |
| C20 | C21 | C22 | H22 | 1.2° | 0.1° |
| C20 | C21 | C30 | C28 | 179.2° | 179.7° |
| C20 | C21 | C30 | H30 | 0.9° | 0.4° |
| C30 | C21 | C22 | C24 | 1.0° | 0.3° |
| C30 | C21 | C22 | H22 | 179.0° | 179.8° |
| C21 | C30 | C28 | C26 | 0.9° | 0.6° |
| C21 | C30 | C28 | H30 | 180.0° | 179.4° |
| C21 | C30 | C28 | H28 | 179.1° | 179.7° |
| C21 | C22 | C24 | H22 | 180.0° | 179.9° |
| C21 | C22 | C24 | C26 | 0.2° | 0.1° |
| C21 | C22 | C24 | H24 | 179.8° | 180.0° |
| C22 | C21 | C30 | C28 | 1.4° | 0.6° |
| C22 | C21 | C30 | H30 | 178.6° | 180.0° |
| C22 | C24 | C26 | H24 | 180.0° | 180.0° |
| C22 | C24 | C26 | C28 | 0.3° | 0.1° |
| C22 | C24 | C26 | H26 | 179.7° | 180.0° |
| H22 | C22 | C24 | C26 | 179.8° | 179.9° |
| H22 | C22 | C24 | H24 | 0.2° | 0.1° |
| C24 | C26 | C28 | H26 | 180.0° | 180.0° |
| C24 | C26 | C28 | C30 | 0.0° | 0.3° |
| C24 | C26 | C28 | H28 | 180.0° | 179.9° |
| H24 | C24 | C26 | C28 | 179.7° | 180.0° |
| H24 | C24 | C26 | H26 | 0.3° | 0.0° |
| C26 | C28 | C30 | H28 | 180.0° | 179.7° |
| C26 | C28 | C30 | H30 | 179.1° | 180.0° |
| H26 | C26 | C28 | C30 | 179.9° | 179.7° |
| H26 | C26 | C28 | H28 | 0.0° | 0.0° |
| H28 | C28 | C30 | H30 | 0.9° | 0.3° |
| C35 | C32 | H32 | H32A | 118.3° | 120.0° |
| C32 | C35 | C36 | C43 | 179.4° | 179.8° |
| C32 | C35 | C36 | C38 | 179.5° | 180.0° |
| C32 | C35 | C36 | H36 | 0.5° | 0.0° |
| C32 | C35 | C43 | C41 | 179.0° | 179.7° |
| C32 | C35 | C43 | H43 | 1.0° | 0.0° |
| H32 | C32 | C35 | C36 | 158.5° | 150.3° |
| H32 | C32 | C35 | C43 | 22.0° | 29.9° |
| H32A | C32 | C35 | C36 | 82.6° | 30.2° |
| H32A | C32 | C35 | C43 | 96.8° | 150.0° |
| C35 | C36 | C38 | H36 | 180.0° | 180.0° |
| C35 | C36 | C38 | C40 | 0.5° | 0.0° |
| C35 | C36 | C38 | H38 | 179.5° | 180.0° |
| C36 | C35 | C43 | C41 | 0.5° | 0.5° |
| C36 | C35 | C43 | H43 | 179.6° | 179.7° |
| C43 | C35 | C36 | C38 | 0.1° | 0.2° |
| C43 | C35 | C36 | H36 | 180.0° | 179.8° |
| C35 | C43 | C41 | C40 | 0.5° | 0.6° |
| C35 | C43 | C41 | H43 | 180.0° | 179.7° |
| C35 | C43 | C41 | H41 | 179.5° | 179.7° |
| C36 | C38 | C40 | H38 | 180.0° | 180.0° |
| C36 | C38 | C40 | C41 | 0.4° | 0.1° |
| H36 | C36 | C38 | C40 | 179.5° | 180.0° |
| H36 | C36 | C38 | H38 | 0.5° | 0.0° |
| C38 | C40 | C41 | C43 | 0.1° | 0.4° |
| C38 | C40 | C41 | H41 | 179.9° | 179.9° |
| H38 | C38 | C40 | C41 | 179.6° | 179.9° |
| C40 | C41 | C43 | H41 | 180.0° | 179.7° |
| C40 | C41 | C43 | H43 | 179.5° | 179.7° |
| H41 | C41 | C43 | H43 | 0.5° | 0.0° |
| C46 | N48 | C50 | HN48 | 180.0° | 180.0° |
| C46 | N48 | C50 | C53 | 139.2° | 180.0° |
| C46 | N48 | C50 | H50 | 101.0° | 60.0° |
| C46 | N48 | C50 | H50A | 19.3° | 60.0° |
| O47 | C46 | N48 | C50 | 1.4° | 0.0° |
| O47 | C46 | N48 | HN48 | 178.6° | 180.0° |
| N48 | C50 | C53 | H50 | 119.9° | 120.0° |
| N48 | C50 | C53 | H50A | 119.9° | 120.0° |
| N48 | C50 | H50 | H50A | 120.4° | 120.1° |
| N48 | C50 | C53 | N56 | 56.4° | 180.0° |
| N48 | C50 | C53 | H53 | 176.5° | 60.0° |
| N48 | C50 | C53 | H53A | 63.7° | 60.0° |
| HN48 | N48 | C50 | C53 | 40.9° | 0.0° |
| HN48 | N48 | C50 | H50 | 79.0° | 120.0° |
| HN48 | N48 | C50 | H50A | 160.7° | 120.0° |
| C53 | C50 | H50 | H50A | 120.3° | 120.0° |
| C50 | C53 | N56 | H53 | 120.1° | 120.0° |
| C50 | C53 | N56 | H53A | 120.1° | 120.0° |
| C50 | C53 | H53 | H53A | 119.7° | 120.0° |
| C50 | C53 | N56 | C57 | 155.9° | 66.4° |
| C50 | C53 | N56 | C67 | 71.1° | 170.0° |
| H50 | C50 | C53 | N56 | 63.5° | 60.0° |
| H50 | C50 | C53 | H53 | 56.6° | 180.0° |
| H50 | C50 | C53 | H53A | 176.4° | 60.0° |
| H50A | C50 | C53 | N56 | 176.3° | 60.0° |
| H50A | C50 | C53 | H53 | 63.6° | 60.0° |
| H50A | C50 | C53 | H53A | 56.2° | 180.0° |
| N56 | C53 | H53 | H53A | 119.6° | 120.0° |
| C53 | N56 | C57 | C67 | 134.1° | 123.8° |
| C53 | N56 | C57 | C60 | 172.0° | 177.6° |
| C53 | N56 | C57 | H57 | 67.9° | 62.4° |
| C53 | N56 | C57 | H57A | 52.0° | 57.6° |
| C53 | N56 | C67 | C64 | 170.6° | 177.6° |
| C53 | N56 | C67 | H67 | 50.6° | 57.7° |
| C53 | N56 | C67 | H67A | 69.4° | 62.5° |
| H53 | C53 | N56 | C57 | 84.0° | 173.6° |
| H53 | C53 | N56 | C67 | 49.0° | 50.0° |
| H53A | C53 | N56 | C57 | 35.8° | 53.6° |
| H53A | C53 | N56 | C67 | 168.8° | 70.0° |
| N56 | C57 | C60 | H57 | 120.1° | 120.0° |
| N56 | C57 | C60 | H57A | 120.1° | 120.0° |
| N56 | C57 | H57 | H57A | 119.9° | 120.1° |
| N56 | C57 | C60 | O63 | 53.7° | 56.9° |
| N56 | C57 | C60 | H60 | 173.9° | 176.7° |
| N56 | C57 | C60 | H60A | 66.4° | 63.1° |
| C57 | N56 | C67 | C64 | 55.5° | 58.6° |
| C57 | N56 | C67 | H67 | 175.5° | 178.5° |
| C57 | N56 | C67 | H67A | 64.5° | 61.3° |
| C67 | N56 | C57 | C60 | 53.9° | 58.6° |
| C67 | N56 | C57 | H57 | 66.2° | 61.3° |
| C67 | N56 | C57 | H57A | 173.9° | 178.6° |
| N56 | C67 | C64 | O63 | 56.5° | 56.8° |
| N56 | C67 | C64 | H67 | 120.0° | 120.0° |
| N56 | C67 | C64 | H67A | 120.0° | 120.0° |
| N56 | C67 | C64 | H64 | 176.4° | 176.8° |
| N56 | C67 | C64 | H64A | 63.5° | 63.1° |
| N56 | C67 | H67 | H67A | 120.0° | 120.2° |
| C60 | C57 | H57 | H57A | 119.8° | 120.1° |
| C57 | C60 | O63 | H60 | 120.1° | 119.9° |
| C57 | C60 | O63 | H60A | 120.2° | 119.9° |
| C57 | C60 | H60 | H60A | 119.5° | 120.1° |
| C57 | C60 | O63 | C64 | 58.9° | 58.7° |
| H57 | C57 | C60 | O63 | 66.3° | 63.1° |
| H57 | C57 | C60 | H60 | 53.8° | 56.8° |
| H57 | C57 | C60 | H60A | 173.5° | 177.0° |
| H57A | C57 | C60 | O63 | 173.8° | 176.8° |
| H57A | C57 | C60 | H60 | 66.1° | 63.3° |
| H57A | C57 | C60 | H60A | 53.6° | 56.9° |
| O63 | C60 | H60 | H60A | 119.6° | 120.1° |
| C60 | O63 | C64 | C67 | 60.1° | 58.6° |
| C60 | O63 | C64 | H64 | 180.0° | 178.6° |
| C60 | O63 | C64 | H64A | 59.9° | 61.2° |
| H60 | C60 | O63 | C64 | 179.1° | 178.6° |
| H60A | C60 | O63 | C64 | 61.2° | 61.2° |
| O63 | C64 | C67 | H64 | 120.0° | 120.0° |
| O63 | C64 | C67 | H64A | 120.0° | 119.9° |
| O63 | C64 | H64 | H64A | 120.2° | 120.2° |
| O63 | C64 | C67 | H67 | 176.5° | 176.8° |
| O63 | C64 | C67 | H67A | 63.5° | 63.1° |
| C67 | C64 | H64 | H64A | 120.1° | 120.0° |
| C64 | C67 | H67 | H67A | 120.0° | 120.0° |
| H64 | C64 | C67 | H67 | 63.6° | 63.2° |
| H64 | C64 | C67 | H67A | 56.4° | 56.8° |
| H64A | C64 | C67 | H67 | 56.5° | 56.9° |
| H64A | C64 | C67 | H67A | 176.5° | 176.9° |
