4GR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N35 | C34 | doub | 1.31Å | 1.30Å | Aromatic |
| N35 | N36 | sing | 1.28Å | 1.35Å | Aromatic |
| C34 | N23 | sing | 1.35Å | 1.33Å | Aromatic |
| N36 | N37 | doub | 1.29Å | 1.30Å | Aromatic |
| N23 | N37 | sing | 1.41Å | 1.36Å | Aromatic |
| N23 | C18 | sing | 1.40Å | 1.43Å | |
| C19 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | C17 | sing | 1.40Å | 1.40Å | Aromatic |
| CL2 | C5 | sing | 1.74Å | 1.72Å | |
| C24 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| N4 | C5 | sing | 1.34Å | 1.36Å | Aromatic |
| N4 | C3 | doub | 1.31Å | 1.33Å | Aromatic |
| C20 | C21 | doub | 1.39Å | 1.38Å | Aromatic |
| C10 | C11 | sing | 1.51Å | 1.53Å | |
| C10 | C9 | sing | 1.53Å | 1.54Å | |
| C17 | C16 | sing | 1.47Å | 1.47Å | |
| C17 | C22 | doub | 1.40Å | 1.41Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C15 | doub | 1.35Å | 1.32Å | |
| C5 | C6 | doub | 1.36Å | 1.37Å | Aromatic |
| C11 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
| N12 | C9 | sing | 1.47Å | 1.47Å | |
| N12 | C13 | sing | 1.35Å | 1.38Å | |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C21 | CL1 | sing | 1.74Å | 1.75Å | |
| C3 | C9 | sing | 1.51Å | 1.50Å | |
| C3 | N7 | sing | 1.35Å | 1.35Å | Aromatic |
| C15 | C13 | sing | 1.46Å | 1.48Å | |
| C26 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C6 | N7 | sing | 1.38Å | 1.37Å | Aromatic |
| C6 | C8 | sing | 1.48Å | 1.47Å | |
| C13 | O14 | doub | 1.22Å | 1.23Å | |
| C28 | C27 | sing | 1.38Å | 1.40Å | Aromatic |
| C33 | C8 | doub | 1.40Å | 1.40Å | Aromatic |
| C33 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C29 | sing | 1.40Å | 1.39Å | Aromatic |
| C32 | C31 | doub | 1.39Å | 1.41Å | Aromatic |
| C29 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| C31 | C30 | sing | 1.39Å | 1.40Å | Aromatic |
| C31 | N38 | sing | 1.40Å | 1.42Å | |
| O40 | C39 | doub | 1.22Å | 1.21Å | |
| N38 | C39 | sing | 1.35Å | 1.37Å | |
| C39 | O41 | sing | 1.35Å | 1.35Å | |
| O41 | C42 | sing | 1.45Å | 1.47Å | |
| C16 | H49 | sing | 1.08Å | 1.08Å | |
| C15 | H48 | sing | 1.08Å | 1.08Å | |
| C19 | H50 | sing | 1.08Å | 1.08Å | |
| C20 | H51 | sing | 1.08Å | 1.08Å | |
| C22 | H52 | sing | 1.08Å | 1.08Å | |
| C24 | H53 | sing | 1.08Å | 1.08Å | |
| C34 | H62 | sing | 1.08Å | 1.08Å | |
| C27 | H56 | sing | 1.08Å | 1.08Å | |
| C33 | H61 | sing | 1.08Å | 1.08Å | |
| N7 | H43 | sing | 0.97Å | 1.00Å | |
| C9 | H44 | sing | 1.09Å | 1.10Å | |
| C10 | H45 | sing | 1.09Å | 1.10Å | |
| C10 | H46 | sing | 1.09Å | 1.10Å | |
| N12 | H47 | sing | 0.97Å | 1.00Å | |
| C25 | H54 | sing | 1.08Å | 1.08Å | |
| C26 | H55 | sing | 1.08Å | 1.08Å | |
| C28 | H57 | sing | 1.08Å | 1.08Å | |
| C29 | H58 | sing | 1.08Å | 1.08Å | |
| C30 | H59 | sing | 1.08Å | 1.08Å | |
| C32 | H60 | sing | 1.08Å | 1.08Å | |
| N38 | H63 | sing | 0.97Å | 1.00Å | |
| C42 | H64 | sing | 1.09Å | 1.10Å | |
| C42 | H66 | sing | 1.09Å | 1.10Å | |
| C42 | H65 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C34 | N35 | N36 | 105.1° | 110.7° |
| N35 | C34 | N23 | 111.1° | 107.2° |
| N35 | C34 | H62 | 124.5° | 126.4° |
| N35 | N36 | N37 | 110.7° | 110.2° |
| C34 | N23 | N37 | 106.5° | 105.2° |
| C34 | N23 | C18 | 139.1° | 127.4° |
| N23 | C34 | H62 | 124.5° | 126.4° |
| N36 | N37 | N23 | 106.5° | 106.6° |
| N37 | N23 | C18 | 113.2° | 127.4° |
| N23 | C18 | C19 | 120.0° | 120.1° |
| N23 | C18 | C17 | 120.1° | 120.1° |
| C18 | C19 | C20 | 120.5° | 120.1° |
| C19 | C18 | C17 | 119.8° | 119.7° |
| C18 | C19 | H50 | 119.8° | 119.9° |
| C19 | C20 | C21 | 119.4° | 120.4° |
| C20 | C19 | H50 | 119.7° | 120.0° |
| C19 | C20 | H51 | 120.3° | 119.8° |
| C18 | C17 | C16 | 122.5° | 120.2° |
| C18 | C17 | C22 | 119.0° | 119.6° |
| CL2 | C5 | N4 | 120.6° | 126.1° |
| CL2 | C5 | C6 | 126.7° | 126.1° |
| C25 | C24 | C11 | 120.5° | 120.0° |
| C24 | C25 | C26 | 120.5° | 120.0° |
| C25 | C24 | H53 | 119.7° | 120.0° |
| C24 | C25 | H54 | 119.8° | 120.0° |
| C24 | C11 | C10 | 120.3° | 120.0° |
| C24 | C11 | C28 | 118.2° | 120.0° |
| C11 | C24 | H53 | 119.8° | 120.0° |
| C5 | N4 | C3 | 103.4° | 109.6° |
| N4 | C5 | C6 | 112.7° | 107.9° |
| N4 | C3 | C9 | 125.5° | 125.5° |
| N4 | C3 | N7 | 112.3° | 109.0° |
| C20 | C21 | C22 | 121.1° | 120.3° |
| C20 | C21 | CL1 | 119.3° | 119.8° |
| C21 | C20 | H51 | 120.3° | 119.8° |
| C11 | C10 | C9 | 108.8° | 109.5° |
| C10 | C11 | C28 | 121.1° | 120.0° |
| C11 | C10 | H45 | 109.6° | 109.5° |
| C11 | C10 | H46 | 109.6° | 109.5° |
| C10 | C9 | N12 | 113.4° | 109.5° |
| C10 | C9 | C3 | 110.0° | 109.5° |
| C10 | C9 | H44 | 107.0° | 109.5° |
| C9 | C10 | H45 | 109.7° | 109.5° |
| C9 | C10 | H46 | 109.6° | 109.5° |
| C16 | C17 | C22 | 118.5° | 120.2° |
| C17 | C16 | C15 | 123.0° | 120.0° |
| C17 | C16 | H49 | 118.5° | 119.9° |
| C17 | C22 | C21 | 120.0° | 119.9° |
| C17 | C22 | H52 | 120.0° | 120.0° |
| C25 | C26 | C27 | 119.6° | 120.0° |
| C26 | C25 | H54 | 119.8° | 120.0° |
| C25 | C26 | H55 | 120.2° | 120.0° |
| C16 | C15 | C13 | 126.9° | 120.0° |
| C15 | C16 | H49 | 118.5° | 120.0° |
| C16 | C15 | H48 | 116.6° | 120.0° |
| C5 | C6 | N7 | 104.0° | 106.5° |
| C5 | C6 | C8 | 134.6° | 126.8° |
| C11 | C28 | C27 | 121.2° | 120.0° |
| C11 | C28 | H57 | 119.4° | 120.0° |
| C9 | N12 | C13 | 117.1° | 120.0° |
| N12 | C9 | C3 | 110.8° | 109.5° |
| N12 | C9 | H44 | 107.8° | 109.5° |
| C9 | N12 | H47 | 121.4° | 120.0° |
| N12 | C13 | C15 | 117.7° | 120.0° |
| N12 | C13 | O14 | 122.1° | 120.0° |
| C13 | N12 | H47 | 121.5° | 120.0° |
| C22 | C21 | CL1 | 119.6° | 119.9° |
| C21 | C22 | H52 | 120.0° | 120.1° |
| C9 | C3 | N7 | 122.0° | 125.5° |
| C3 | C9 | H44 | 107.5° | 109.4° |
| C3 | N7 | C6 | 107.6° | 107.1° |
| C3 | N7 | H43 | 126.2° | 126.5° |
| C15 | C13 | O14 | 120.1° | 120.0° |
| C13 | C15 | H48 | 116.6° | 120.0° |
| C26 | C27 | C28 | 119.9° | 120.0° |
| C26 | C27 | H56 | 120.1° | 120.0° |
| C27 | C26 | H55 | 120.2° | 120.1° |
| N7 | C6 | C8 | 121.2° | 126.8° |
| C6 | N7 | H43 | 126.2° | 126.4° |
| C6 | C8 | C33 | 121.1° | 120.0° |
| C6 | C8 | C29 | 120.1° | 120.1° |
| C28 | C27 | H56 | 120.0° | 120.0° |
| C27 | C28 | H57 | 119.4° | 120.0° |
| C8 | C33 | C32 | 120.4° | 119.9° |
| C33 | C8 | C29 | 118.8° | 119.9° |
| C8 | C33 | H61 | 119.8° | 120.0° |
| C33 | C32 | C31 | 120.1° | 120.1° |
| C32 | C33 | H61 | 119.8° | 120.0° |
| C33 | C32 | H60 | 119.9° | 120.0° |
| C8 | C29 | C30 | 121.1° | 119.9° |
| C8 | C29 | H58 | 119.4° | 120.0° |
| C32 | C31 | C30 | 118.8° | 120.2° |
| C32 | C31 | N38 | 125.5° | 120.0° |
| C31 | C32 | H60 | 120.0° | 119.9° |
| C29 | C30 | C31 | 120.6° | 120.0° |
| C30 | C29 | H58 | 119.4° | 120.0° |
| C29 | C30 | H59 | 119.7° | 119.9° |
| C30 | C31 | N38 | 115.7° | 119.9° |
| C31 | C30 | H59 | 119.7° | 120.0° |
| C31 | N38 | C39 | 127.5° | 120.0° |
| C31 | N38 | H63 | 116.3° | 120.0° |
| O40 | C39 | N38 | 126.1° | 120.0° |
| O40 | C39 | O41 | 124.2° | 120.0° |
| N38 | C39 | O41 | 109.7° | 120.0° |
| C39 | N38 | H63 | 116.2° | 120.0° |
| C39 | O41 | C42 | 116.4° | 117.0° |
| O41 | C42 | H64 | 109.5° | 109.5° |
| O41 | C42 | H66 | 109.4° | 109.5° |
| O41 | C42 | H65 | 109.5° | 109.5° |
| H45 | C10 | H46 | 109.5° | 109.4° |
| H64 | C42 | H66 | 109.5° | 109.4° |
| H64 | C42 | H65 | 109.5° | 109.5° |
| H66 | C42 | H65 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N35 | C34 | N23 | H62 | 180.0° | 179.8° |
| C34 | N35 | N36 | N37 | 1.2° | 0.3° |
| N35 | C34 | N23 | N37 | 2.5° | 0.2° |
| N35 | C34 | N23 | C18 | 168.6° | 179.8° |
| N36 | N35 | C34 | N23 | 2.3° | 0.1° |
| N35 | N36 | N37 | N23 | 0.3° | 0.4° |
| N36 | N35 | C34 | H62 | 177.7° | 179.8° |
| C34 | N23 | N37 | N36 | 1.6° | 0.3° |
| C34 | N23 | N37 | C18 | 170.2° | 180.0° |
| C34 | N23 | C18 | C19 | 45.5° | 49.9° |
| C34 | N23 | C18 | C17 | 136.7° | 130.4° |
| N36 | N37 | N23 | C18 | 171.8° | 179.6° |
| N37 | N23 | C18 | C19 | 120.0° | 130.2° |
| N37 | N23 | C18 | C17 | 57.8° | 49.6° |
| N37 | N23 | C34 | H62 | 177.5° | 180.0° |
| N23 | C18 | C19 | C17 | 177.8° | 179.7° |
| N23 | C18 | C19 | C20 | 178.5° | 179.8° |
| N23 | C18 | C17 | C16 | 1.1° | 0.3° |
| N23 | C18 | C17 | C22 | 176.6° | 179.7° |
| N23 | C18 | C19 | H50 | 1.5° | 0.3° |
| C18 | N23 | C34 | H62 | 11.4° | 0.0° |
| C18 | C19 | C20 | H50 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.7° | 0.0° |
| C19 | C18 | C17 | C16 | 176.6° | 180.0° |
| C19 | C18 | C17 | C22 | 5.6° | 0.0° |
| C18 | C19 | C20 | H51 | 179.3° | 180.0° |
| C20 | C19 | C18 | C17 | 3.8° | 0.0° |
| C19 | C20 | C21 | H51 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 3.3° | 0.0° |
| C19 | C20 | C21 | CL1 | 175.6° | 180.0° |
| C18 | C17 | C16 | C22 | 177.8° | 180.0° |
| C18 | C17 | C16 | C15 | 125.5° | 175.0° |
| C18 | C17 | C22 | C21 | 3.1° | 0.0° |
| C18 | C17 | C16 | H49 | 54.5° | 5.1° |
| C17 | C18 | C19 | H50 | 176.3° | 180.0° |
| C18 | C17 | C22 | H52 | 176.9° | 180.0° |
| CL2 | C5 | N4 | C6 | 179.3° | 180.0° |
| CL2 | C5 | N4 | C3 | 178.3° | 180.0° |
| CL2 | C5 | C6 | N7 | 178.8° | 179.8° |
| CL2 | C5 | C6 | C8 | 3.1° | 0.0° |
| C25 | C24 | C11 | H53 | 180.0° | 179.8° |
| C25 | C24 | C11 | C10 | 172.7° | 180.0° |
| C24 | C25 | C26 | H54 | 180.0° | 180.0° |
| C25 | C24 | C11 | C28 | 1.1° | 0.0° |
| C24 | C25 | C26 | C27 | 0.2° | 0.1° |
| C24 | C25 | C26 | H55 | 179.9° | 180.0° |
| C24 | C11 | C10 | C28 | 173.6° | 180.0° |
| C24 | C11 | C10 | C9 | 113.5° | 90.0° |
| C11 | C24 | C25 | C26 | 0.7° | 0.0° |
| C24 | C11 | C28 | C27 | 1.0° | 0.0° |
| C24 | C11 | C10 | H45 | 6.5° | 150.0° |
| C24 | C11 | C10 | H46 | 126.7° | 30.1° |
| C11 | C24 | C25 | H54 | 179.3° | 180.0° |
| C24 | C11 | C28 | H57 | 179.0° | 180.0° |
| C5 | N4 | C3 | C9 | 173.7° | 180.0° |
| C5 | N4 | C3 | N7 | 1.2° | 0.3° |
| N4 | C5 | C6 | N7 | 0.5° | 0.2° |
| N4 | C5 | C6 | C8 | 176.2° | 180.0° |
| N4 | C3 | C9 | C10 | 59.1° | 54.7° |
| C3 | N4 | C5 | C6 | 1.1° | 0.0° |
| N4 | C3 | C9 | N12 | 67.0° | 174.7° |
| N4 | C3 | C9 | N7 | 174.5° | 179.6° |
| N4 | C3 | N7 | C6 | 1.0° | 0.4° |
| N4 | C3 | N7 | H43 | 179.0° | 179.8° |
| N4 | C3 | C9 | H44 | 175.4° | 65.4° |
| C20 | C21 | C22 | C17 | 1.4° | 0.0° |
| C20 | C21 | C22 | CL1 | 178.9° | 180.0° |
| C21 | C20 | C19 | H50 | 179.3° | 180.0° |
| C20 | C21 | C22 | H52 | 178.6° | 180.0° |
| C11 | C10 | C9 | H45 | 119.9° | 120.0° |
| C11 | C10 | C9 | H46 | 119.9° | 120.0° |
| C11 | C10 | C9 | N12 | 176.8° | 65.0° |
| C11 | C10 | C9 | C3 | 58.5° | 175.0° |
| C10 | C11 | C28 | C27 | 172.8° | 180.0° |
| C10 | C11 | C24 | H53 | 7.3° | 0.2° |
| C11 | C10 | C9 | H44 | 58.0° | 55.0° |
| C11 | C10 | H45 | H46 | 120.3° | 120.0° |
| C10 | C11 | C28 | H57 | 7.3° | 0.0° |
| C9 | C10 | C11 | C28 | 60.1° | 90.0° |
| C10 | C9 | N12 | C3 | 124.3° | 120.0° |
| C10 | C9 | N12 | H44 | 118.3° | 120.0° |
| C10 | C9 | N12 | C13 | 157.7° | 85.0° |
| C10 | C9 | C3 | H44 | 116.2° | 120.0° |
| C10 | C9 | C3 | N7 | 115.4° | 125.0° |
| C9 | C10 | H45 | H46 | 120.3° | 120.0° |
| C10 | C9 | N12 | H47 | 22.4° | 95.1° |
| C17 | C16 | C15 | H49 | 180.0° | 180.0° |
| C16 | C17 | C22 | C21 | 179.1° | 180.0° |
| C17 | C16 | C15 | C13 | 177.9° | 180.0° |
| C17 | C16 | C15 | H48 | 2.1° | 0.1° |
| C16 | C17 | C22 | H52 | 0.9° | 0.0° |
| C22 | C17 | C16 | C15 | 56.7° | 5.0° |
| C17 | C22 | C21 | H52 | 180.0° | 179.9° |
| C17 | C22 | C21 | CL1 | 177.5° | 180.0° |
| C22 | C17 | C16 | H49 | 123.3° | 174.9° |
| C25 | C26 | C27 | H55 | 180.0° | 179.9° |
| C25 | C26 | C27 | C28 | 0.0° | 0.1° |
| C26 | C25 | C24 | H53 | 179.3° | 179.8° |
| C25 | C26 | C27 | H56 | 180.0° | 180.0° |
| C16 | C15 | C13 | N12 | 5.9° | 179.7° |
| C16 | C15 | C13 | H48 | 180.0° | 179.9° |
| C16 | C15 | C13 | O14 | 172.6° | 0.1° |
| C5 | C6 | N7 | C3 | 0.3° | 0.4° |
| C5 | C6 | N7 | C8 | 176.4° | 179.8° |
| C5 | C6 | C8 | C33 | 30.0° | 45.1° |
| C5 | C6 | C8 | C29 | 148.5° | 134.9° |
| C5 | C6 | N7 | H43 | 179.7° | 179.8° |
| C11 | C28 | C27 | C26 | 0.4° | 0.0° |
| C11 | C28 | C27 | H57 | 180.0° | 180.0° |
| C28 | C11 | C24 | H53 | 178.9° | 179.8° |
| C11 | C28 | C27 | H56 | 179.6° | 180.0° |
| C28 | C11 | C10 | H45 | 179.9° | 30.0° |
| C28 | C11 | C10 | H46 | 59.7° | 150.0° |
| C9 | N12 | C13 | H47 | 180.0° | 179.9° |
| N12 | C9 | C3 | H44 | 117.6° | 120.0° |
| N12 | C9 | C3 | N7 | 118.5° | 5.0° |
| C9 | N12 | C13 | C15 | 174.4° | 179.8° |
| C9 | N12 | C13 | O14 | 7.1° | 0.1° |
| N12 | C9 | C10 | H45 | 63.3° | 175.0° |
| N12 | C9 | C10 | H46 | 56.9° | 55.0° |
| C13 | N12 | C9 | C3 | 78.0° | 154.9° |
| N12 | C13 | C15 | O14 | 178.5° | 179.8° |
| N12 | C13 | C15 | H48 | 174.1° | 0.2° |
| C13 | N12 | C9 | H44 | 39.4° | 35.0° |
| C22 | C21 | C20 | H51 | 176.7° | 180.0° |
| CL1 | C21 | C20 | H51 | 4.4° | 0.0° |
| CL1 | C21 | C22 | H52 | 2.5° | 0.1° |
| C9 | C3 | N7 | C6 | 174.2° | 179.9° |
| C9 | C3 | N7 | H43 | 5.8° | 0.1° |
| C3 | C9 | C10 | H45 | 61.4° | 55.0° |
| C3 | C9 | C10 | H46 | 178.4° | 65.0° |
| C3 | C9 | N12 | H47 | 101.9° | 25.0° |
| C3 | N7 | C6 | H43 | 180.0° | 179.8° |
| C3 | N7 | C6 | C8 | 176.1° | 179.8° |
| N7 | C3 | C9 | H44 | 0.9° | 115.0° |
| C13 | C15 | C16 | H49 | 2.1° | 0.1° |
| C15 | C13 | N12 | H47 | 5.6° | 0.2° |
| C26 | C27 | C28 | H56 | 180.0° | 180.0° |
| C27 | C26 | C25 | H54 | 179.9° | 179.9° |
| C26 | C27 | C28 | H57 | 179.6° | 180.0° |
| N7 | C6 | C8 | C33 | 155.0° | 134.7° |
| N7 | C6 | C8 | C29 | 26.6° | 45.3° |
| C6 | C8 | C33 | C29 | 178.4° | 180.0° |
| C6 | C8 | C33 | C32 | 176.1° | 180.0° |
| C6 | C8 | C29 | C30 | 178.9° | 180.0° |
| C6 | C8 | C33 | H61 | 3.9° | 0.3° |
| C8 | C6 | N7 | H43 | 3.9° | 0.0° |
| C6 | C8 | C29 | H58 | 1.1° | 0.1° |
| O14 | C13 | C15 | H48 | 7.4° | 180.0° |
| O14 | C13 | N12 | H47 | 172.9° | 180.0° |
| C28 | C27 | C26 | H55 | 180.0° | 180.0° |
| C8 | C33 | C32 | H61 | 180.0° | 179.7° |
| C8 | C33 | C32 | C31 | 2.8° | 0.0° |
| C33 | C8 | C29 | C30 | 0.4° | 0.0° |
| C33 | C8 | C29 | H58 | 179.6° | 179.9° |
| C8 | C33 | C32 | H60 | 177.2° | 179.9° |
| C32 | C33 | C8 | C29 | 2.4° | 0.0° |
| C33 | C32 | C31 | H60 | 180.0° | 179.9° |
| C33 | C32 | C31 | C30 | 0.4° | 0.0° |
| C33 | C32 | C31 | N38 | 179.6° | 180.0° |
| C8 | C29 | C30 | H58 | 180.0° | 179.9° |
| C8 | C29 | C30 | C31 | 2.8° | 0.0° |
| C29 | C8 | C33 | H61 | 177.7° | 179.7° |
| C8 | C29 | C30 | H59 | 177.2° | 180.0° |
| C32 | C31 | C30 | C29 | 2.3° | 0.0° |
| C32 | C31 | C30 | N38 | 179.2° | 180.0° |
| C32 | C31 | N38 | C39 | 1.0° | 144.8° |
| C31 | C32 | C33 | H61 | 177.2° | 179.7° |
| C32 | C31 | C30 | H59 | 177.6° | 180.0° |
| C32 | C31 | N38 | H63 | 178.9° | 35.1° |
| C29 | C30 | C31 | H59 | 180.0° | 179.9° |
| C29 | C30 | C31 | N38 | 176.9° | 180.0° |
| C30 | C31 | N38 | C39 | 178.1° | 35.2° |
| C31 | C30 | C29 | H58 | 177.2° | 179.9° |
| C30 | C31 | C32 | H60 | 179.6° | 179.9° |
| C30 | C31 | N38 | H63 | 1.9° | 144.9° |
| C31 | N38 | C39 | O40 | 2.1° | 4.5° |
| C31 | N38 | C39 | H63 | 180.0° | 180.0° |
| C31 | N38 | C39 | O41 | 176.7° | 175.6° |
| N38 | C31 | C30 | H59 | 3.2° | 0.0° |
| N38 | C31 | C32 | H60 | 0.5° | 0.1° |
| O40 | C39 | N38 | O41 | 178.7° | 179.9° |
| O40 | C39 | O41 | C42 | 3.9° | 0.1° |
| O40 | C39 | N38 | H63 | 178.0° | 175.6° |
| N38 | C39 | O41 | C42 | 174.9° | 180.0° |
| O41 | C39 | N38 | H63 | 3.3° | 4.4° |
| C39 | O41 | C42 | H64 | 180.0° | 180.0° |
| C39 | O41 | C42 | H66 | 60.0° | 60.1° |
| C39 | O41 | C42 | H65 | 60.0° | 60.0° |
| O41 | C42 | H64 | H66 | 120.0° | 120.0° |
| O41 | C42 | H64 | H65 | 120.0° | 120.0° |
| O41 | C42 | H66 | H65 | 120.0° | 120.0° |
| H49 | C16 | C15 | H48 | 177.9° | 180.0° |
| H50 | C19 | C20 | H51 | 0.7° | 0.1° |
| H53 | C24 | C25 | H54 | 0.7° | 0.2° |
| H56 | C27 | C26 | H55 | 0.0° | 0.0° |
| H56 | C27 | C28 | H57 | 0.5° | 0.0° |
| H61 | C33 | C32 | H60 | 2.8° | 0.2° |
| H44 | C9 | C10 | H45 | 177.9° | 65.0° |
| H44 | C9 | C10 | H46 | 61.9° | 175.0° |
| H44 | C9 | N12 | H47 | 140.6° | 144.9° |
| H54 | C25 | C26 | H55 | 0.1° | 0.0° |
| H58 | C29 | C30 | H59 | 2.8° | 0.0° |
| H64 | C42 | H66 | H65 | 120.0° | 120.0° |
