6CY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N31 | C29 | doub | 1.31Å | 1.35Å | Aromatic |
| N31 | C32 | sing | 1.34Å | 1.36Å | Aromatic |
| C39 | C32 | doub | 1.40Å | 1.41Å | Aromatic |
| C39 | C37 | sing | 1.36Å | 1.40Å | Aromatic |
| C29 | N28 | sing | 1.32Å | 1.35Å | Aromatic |
| C32 | C33 | sing | 1.42Å | 1.42Å | Aromatic |
| C37 | C36 | doub | 1.40Å | 1.41Å | Aromatic |
| N28 | C27 | doub | 1.33Å | 1.36Å | Aromatic |
| C33 | C27 | sing | 1.42Å | 1.42Å | Aromatic |
| C33 | C34 | doub | 1.40Å | 1.41Å | Aromatic |
| C42 | N44 | doub | 1.32Å | 1.36Å | Aromatic |
| C42 | C41 | sing | 1.39Å | 1.40Å | Aromatic |
| C36 | C34 | sing | 1.38Å | 1.41Å | Aromatic |
| C36 | C41 | sing | 1.48Å | 1.48Å | |
| C27 | C20 | sing | 1.48Å | 1.49Å | |
| N44 | C45 | sing | 1.32Å | 1.36Å | Aromatic |
| C21 | C20 | doub | 1.40Å | 1.41Å | Aromatic |
| C21 | C23 | sing | 1.38Å | 1.41Å | Aromatic |
| C41 | C47 | doub | 1.40Å | 1.40Å | Aromatic |
| C20 | C18 | sing | 1.39Å | 1.40Å | Aromatic |
| C23 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| C45 | O51 | sing | 1.35Å | 1.40Å | |
| C45 | C46 | doub | 1.40Å | 1.41Å | Aromatic |
| C47 | C46 | sing | 1.40Å | 1.39Å | Aromatic |
| C18 | C17 | doub | 1.39Å | 1.41Å | Aromatic |
| C25 | C17 | sing | 1.40Å | 1.40Å | Aromatic |
| O51 | C52 | sing | 1.43Å | 1.44Å | |
| C46 | C49 | sing | 1.43Å | 1.44Å | |
| C9 | C12 | sing | 1.54Å | 1.55Å | |
| C9 | N8 | sing | 1.47Å | 1.48Å | |
| C17 | C15 | sing | 1.48Å | 1.52Å | |
| C12 | N1 | sing | 1.47Å | 1.48Å | |
| C58 | C56 | sing | 1.51Å | 1.52Å | |
| N8 | C15 | sing | 1.35Å | 1.38Å | |
| N8 | C5 | sing | 1.47Å | 1.47Å | |
| C15 | O16 | doub | 1.22Å | 1.22Å | |
| C49 | N50 | trip | 1.14Å | 1.15Å | |
| N1 | C56 | sing | 1.35Å | 1.38Å | |
| N1 | C2 | sing | 1.47Å | 1.48Å | |
| C56 | O57 | doub | 1.21Å | 1.23Å | |
| C5 | C2 | sing | 1.53Å | 1.55Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C42 | H3 | sing | 1.08Å | 1.08Å | |
| C47 | H4 | sing | 1.08Å | 1.08Å | |
| C52 | H5 | sing | 1.09Å | 1.10Å | |
| C52 | H6 | sing | 1.09Å | 1.10Å | |
| C52 | H7 | sing | 1.09Å | 1.10Å | |
| C58 | H8 | sing | 1.09Å | 1.10Å | |
| C58 | H9 | sing | 1.09Å | 1.10Å | |
| C58 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.08Å | 1.08Å | |
| C21 | H14 | sing | 1.08Å | 1.08Å | |
| C23 | H15 | sing | 1.08Å | 1.08Å | |
| C25 | H16 | sing | 1.08Å | 1.08Å | |
| C29 | H17 | sing | 1.08Å | 1.08Å | |
| C5 | H18 | sing | 1.09Å | 1.10Å | |
| C5 | H19 | sing | 1.09Å | 1.10Å | |
| C9 | H20 | sing | 1.09Å | 1.10Å | |
| C9 | H21 | sing | 1.09Å | 1.10Å | |
| C34 | H22 | sing | 1.08Å | 1.08Å | |
| C37 | H23 | sing | 1.08Å | 1.08Å | |
| C39 | H24 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C29 | N31 | C32 | 120.3° | 120.5° |
| N31 | C29 | N28 | 120.4° | 123.1° |
| N31 | C29 | H17 | 119.8° | 118.5° |
| N31 | C32 | C39 | 117.9° | 121.8° |
| N31 | C32 | C33 | 121.0° | 118.6° |
| C32 | C39 | C37 | 119.7° | 119.9° |
| C39 | C32 | C33 | 121.1° | 119.6° |
| C32 | C39 | H24 | 120.1° | 120.0° |
| C39 | C37 | C36 | 119.9° | 120.9° |
| C39 | C37 | H23 | 120.0° | 119.5° |
| C37 | C39 | H24 | 120.1° | 120.1° |
| C29 | N28 | C27 | 122.5° | 121.5° |
| N28 | C29 | H17 | 119.8° | 118.5° |
| C32 | C33 | C27 | 117.1° | 118.2° |
| C32 | C33 | C34 | 118.5° | 119.8° |
| C37 | C36 | C34 | 120.2° | 120.5° |
| C37 | C36 | C41 | 119.3° | 119.7° |
| C36 | C37 | H23 | 120.0° | 119.6° |
| N28 | C27 | C33 | 118.7° | 118.1° |
| N28 | C27 | C20 | 115.4° | 120.9° |
| C27 | C33 | C34 | 124.4° | 122.0° |
| C33 | C27 | C20 | 125.9° | 120.9° |
| C33 | C34 | C36 | 120.4° | 119.3° |
| C33 | C34 | H22 | 119.8° | 120.4° |
| N44 | C42 | C41 | 120.3° | 121.0° |
| C42 | N44 | C45 | 122.3° | 122.0° |
| N44 | C42 | H3 | 119.8° | 119.5° |
| C42 | C41 | C36 | 123.2° | 120.4° |
| C42 | C41 | C47 | 118.3° | 119.2° |
| C41 | C42 | H3 | 119.8° | 119.5° |
| C34 | C36 | C41 | 120.0° | 119.7° |
| C36 | C34 | H22 | 119.8° | 120.3° |
| C36 | C41 | C47 | 118.3° | 120.4° |
| C27 | C20 | C21 | 121.7° | 120.1° |
| C27 | C20 | C18 | 119.7° | 120.1° |
| N44 | C45 | O51 | 121.2° | 119.7° |
| N44 | C45 | C46 | 119.0° | 120.7° |
| C20 | C21 | C23 | 120.7° | 120.1° |
| C21 | C20 | C18 | 118.5° | 119.9° |
| C20 | C21 | H14 | 119.6° | 119.9° |
| C21 | C23 | C25 | 120.3° | 120.3° |
| C23 | C21 | H14 | 119.6° | 119.9° |
| C21 | C23 | H15 | 119.8° | 119.9° |
| C41 | C47 | C46 | 120.5° | 118.3° |
| C41 | C47 | H4 | 119.7° | 120.9° |
| C20 | C18 | C17 | 121.3° | 119.7° |
| C20 | C18 | H13 | 119.4° | 120.2° |
| C23 | C25 | C17 | 119.4° | 120.1° |
| C25 | C23 | H15 | 119.8° | 119.8° |
| C23 | C25 | H16 | 120.3° | 119.9° |
| O51 | C45 | C46 | 119.7° | 119.7° |
| C45 | O51 | C52 | 118.1° | 117.0° |
| C45 | C46 | C47 | 119.4° | 118.9° |
| C45 | C46 | C49 | 122.6° | 120.5° |
| C47 | C46 | C49 | 117.9° | 120.6° |
| C46 | C47 | H4 | 119.7° | 120.8° |
| C18 | C17 | C25 | 119.7° | 119.9° |
| C18 | C17 | C15 | 119.0° | 120.1° |
| C17 | C18 | H13 | 119.4° | 120.2° |
| C25 | C17 | C15 | 121.1° | 120.0° |
| C17 | C25 | H16 | 120.3° | 119.9° |
| O51 | C52 | H5 | 109.5° | 109.5° |
| O51 | C52 | H6 | 109.5° | 109.4° |
| O51 | C52 | H7 | 109.5° | 109.5° |
| C46 | C49 | N50 | 178.2° | 180.0° |
| C12 | C9 | N8 | 108.5° | 108.6° |
| C9 | C12 | N1 | 109.8° | 108.5° |
| C9 | C12 | H11 | 109.4° | 109.8° |
| C9 | C12 | H12 | 109.4° | 109.7° |
| C12 | C9 | H20 | 109.7° | 109.6° |
| C12 | C9 | H21 | 109.7° | 109.6° |
| C9 | N8 | C15 | 123.7° | 120.6° |
| C9 | N8 | C5 | 117.2° | 118.8° |
| N8 | C9 | H20 | 109.7° | 109.5° |
| N8 | C9 | H21 | 109.7° | 109.7° |
| C17 | C15 | N8 | 124.2° | 120.0° |
| C17 | C15 | O16 | 113.1° | 120.0° |
| C12 | N1 | C56 | 122.2° | 120.6° |
| C12 | N1 | C2 | 117.9° | 118.8° |
| N1 | C12 | H11 | 109.4° | 109.6° |
| N1 | C12 | H12 | 109.4° | 109.6° |
| C58 | C56 | N1 | 124.4° | 120.0° |
| C58 | C56 | O57 | 112.8° | 120.0° |
| C56 | C58 | H8 | 109.5° | 109.5° |
| C56 | C58 | H9 | 109.4° | 109.5° |
| C56 | C58 | H10 | 109.5° | 109.5° |
| C15 | N8 | C5 | 119.2° | 120.6° |
| N8 | C15 | O16 | 122.7° | 120.0° |
| N8 | C5 | C2 | 105.0° | 108.6° |
| N8 | C5 | H18 | 110.6° | 109.6° |
| N8 | C5 | H19 | 110.6° | 109.8° |
| C56 | N1 | C2 | 119.9° | 120.6° |
| N1 | C56 | O57 | 122.8° | 120.0° |
| N1 | C2 | C5 | 107.8° | 108.8° |
| N1 | C2 | H1 | 109.9° | 109.6° |
| N1 | C2 | H2 | 109.9° | 109.6° |
| C5 | C2 | H1 | 109.9° | 109.6° |
| C5 | C2 | H2 | 109.9° | 109.6° |
| C2 | C5 | H18 | 110.6° | 109.6° |
| C2 | C5 | H19 | 110.5° | 109.6° |
| H1 | C2 | H2 | 109.5° | 109.6° |
| H5 | C52 | H6 | 109.5° | 109.5° |
| H5 | C52 | H7 | 109.5° | 109.4° |
| H6 | C52 | H7 | 109.5° | 109.5° |
| H8 | C58 | H9 | 109.5° | 109.4° |
| H8 | C58 | H10 | 109.5° | 109.5° |
| H9 | C58 | H10 | 109.5° | 109.5° |
| H11 | C12 | H12 | 109.5° | 109.6° |
| H18 | C5 | H19 | 109.5° | 109.6° |
| H20 | C9 | H21 | 109.5° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C29 | N31 | C32 | C39 | 179.1° | 179.7° |
| N31 | C29 | N28 | H17 | 180.0° | 179.9° |
| C29 | N31 | C32 | C33 | 0.3° | 0.3° |
| N31 | C29 | N28 | C27 | 0.1° | 0.1° |
| N31 | C32 | C39 | C33 | 179.3° | 180.0° |
| N31 | C32 | C39 | C37 | 179.1° | 180.0° |
| C32 | N31 | C29 | N28 | 0.3° | 0.3° |
| N31 | C32 | C33 | C27 | 0.0° | 0.0° |
| N31 | C32 | C33 | C34 | 179.9° | 180.0° |
| C32 | N31 | C29 | H17 | 179.7° | 179.8° |
| N31 | C32 | C39 | H24 | 0.9° | 0.0° |
| C32 | C39 | C37 | H24 | 180.0° | 180.0° |
| C32 | C39 | C37 | C36 | 3.4° | 0.0° |
| C39 | C32 | C33 | C27 | 179.3° | 180.0° |
| C39 | C32 | C33 | C34 | 0.7° | 0.0° |
| C32 | C39 | C37 | H23 | 176.6° | 179.9° |
| C37 | C39 | C32 | C33 | 1.6° | 0.1° |
| C39 | C37 | C36 | H23 | 180.0° | 180.0° |
| C39 | C37 | C36 | C34 | 4.4° | 0.0° |
| C39 | C37 | C36 | C41 | 176.3° | 180.0° |
| C29 | N28 | C27 | C33 | 0.1° | 0.2° |
| C29 | N28 | C27 | C20 | 179.7° | 180.0° |
| C32 | C33 | C27 | N28 | 0.1° | 0.2° |
| C32 | C33 | C27 | C34 | 180.0° | 180.0° |
| C32 | C33 | C34 | C36 | 1.7° | 0.0° |
| C32 | C33 | C27 | C20 | 179.7° | 180.0° |
| C32 | C33 | C34 | H22 | 178.3° | 180.0° |
| C33 | C32 | C39 | H24 | 178.4° | 180.0° |
| C37 | C36 | C34 | C33 | 3.6° | 0.0° |
| C37 | C36 | C41 | C42 | 51.5° | 179.7° |
| C37 | C36 | C34 | C41 | 171.8° | 180.0° |
| C37 | C36 | C41 | C47 | 122.3° | 0.0° |
| C37 | C36 | C34 | H22 | 176.5° | 180.0° |
| C36 | C37 | C39 | H24 | 176.6° | 180.0° |
| N28 | C27 | C33 | C20 | 179.5° | 179.8° |
| N28 | C27 | C33 | C34 | 179.9° | 179.8° |
| N28 | C27 | C20 | C21 | 115.9° | 44.6° |
| N28 | C27 | C20 | C18 | 59.8° | 135.3° |
| C27 | N28 | C29 | H17 | 179.9° | 180.0° |
| C27 | C33 | C34 | C36 | 178.3° | 179.9° |
| C33 | C27 | C20 | C21 | 63.6° | 135.6° |
| C33 | C27 | C20 | C18 | 120.7° | 44.4° |
| C27 | C33 | C34 | H22 | 1.7° | 0.0° |
| C33 | C34 | C36 | H22 | 180.0° | 180.0° |
| C33 | C34 | C36 | C41 | 175.4° | 180.0° |
| C34 | C33 | C27 | C20 | 0.4° | 0.0° |
| N44 | C42 | C41 | H3 | 180.0° | 179.9° |
| N44 | C42 | C41 | C36 | 176.9° | 179.8° |
| N44 | C42 | C41 | C47 | 3.1° | 0.0° |
| C42 | N44 | C45 | O51 | 179.2° | 180.0° |
| C42 | N44 | C45 | C46 | 2.2° | 0.0° |
| C42 | C41 | C36 | C34 | 136.6° | 0.2° |
| C42 | C41 | C36 | C47 | 173.8° | 179.7° |
| C41 | C42 | N44 | C45 | 3.1° | 0.1° |
| C42 | C41 | C47 | C46 | 2.3° | 0.0° |
| C42 | C41 | C47 | H4 | 177.7° | 180.0° |
| C34 | C36 | C41 | C47 | 49.6° | 180.0° |
| C34 | C36 | C37 | H23 | 175.6° | 180.0° |
| C36 | C41 | C47 | C46 | 176.4° | 179.8° |
| C36 | C41 | C42 | H3 | 3.1° | 0.3° |
| C36 | C41 | C47 | H4 | 3.6° | 0.3° |
| C41 | C36 | C34 | H22 | 4.6° | 0.0° |
| C41 | C36 | C37 | H23 | 3.7° | 0.0° |
| C27 | C20 | C21 | C18 | 175.8° | 180.0° |
| C27 | C20 | C21 | C23 | 177.3° | 179.9° |
| C27 | C20 | C18 | C17 | 175.6° | 180.0° |
| C27 | C20 | C18 | H13 | 4.4° | 0.0° |
| C27 | C20 | C21 | H14 | 2.7° | 0.1° |
| N44 | C45 | O51 | C46 | 176.9° | 180.0° |
| N44 | C45 | C46 | C47 | 1.4° | 0.0° |
| N44 | C45 | O51 | C52 | 76.3° | 0.0° |
| N44 | C45 | C46 | C49 | 179.1° | 180.0° |
| C45 | N44 | C42 | H3 | 176.9° | 180.0° |
| C20 | C21 | C23 | H14 | 180.0° | 180.0° |
| C20 | C21 | C23 | C25 | 0.8° | 0.4° |
| C21 | C20 | C18 | C17 | 0.3° | 0.0° |
| C21 | C20 | C18 | H13 | 179.7° | 180.0° |
| C20 | C21 | C23 | H15 | 179.2° | 180.0° |
| C23 | C21 | C20 | C18 | 1.5° | 0.0° |
| C21 | C23 | C25 | H15 | 180.0° | 179.6° |
| C21 | C23 | C25 | C17 | 1.7° | 0.7° |
| C21 | C23 | C25 | H16 | 178.3° | 180.0° |
| C41 | C47 | C46 | C45 | 1.4° | 0.0° |
| C41 | C47 | C46 | H4 | 180.0° | 180.0° |
| C41 | C47 | C46 | C49 | 179.0° | 180.0° |
| C47 | C41 | C42 | H3 | 176.9° | 180.0° |
| C20 | C18 | C17 | H13 | 180.0° | 180.0° |
| C20 | C18 | C17 | C25 | 2.8° | 0.3° |
| C20 | C18 | C17 | C15 | 178.1° | 180.0° |
| C18 | C20 | C21 | H14 | 178.5° | 180.0° |
| C23 | C25 | C17 | C18 | 3.5° | 0.6° |
| C23 | C25 | C17 | H16 | 180.0° | 179.4° |
| C23 | C25 | C17 | C15 | 178.7° | 179.7° |
| C25 | C23 | C21 | H14 | 179.2° | 179.6° |
| O51 | C45 | C46 | C47 | 178.3° | 180.0° |
| O51 | C45 | C46 | C49 | 2.2° | 0.0° |
| C45 | O51 | C52 | H5 | 180.0° | 60.0° |
| C45 | O51 | C52 | H6 | 60.0° | 180.0° |
| C45 | O51 | C52 | H7 | 60.0° | 60.0° |
| C45 | C46 | C47 | C49 | 179.5° | 180.0° |
| C46 | C45 | O51 | C52 | 106.8° | 180.0° |
| C45 | C46 | C49 | N50 | 173.7° | 82.2° |
| C45 | C46 | C47 | H4 | 178.5° | 180.0° |
| C47 | C46 | C49 | N50 | 5.8° | 97.8° |
| C18 | C17 | C25 | C15 | 175.2° | 179.7° |
| C18 | C17 | C15 | N8 | 62.9° | 146.7° |
| C18 | C17 | C15 | O16 | 115.1° | 33.2° |
| C18 | C17 | C25 | H16 | 176.5° | 180.0° |
| C25 | C17 | C15 | N8 | 121.9° | 33.6° |
| C25 | C17 | C15 | O16 | 60.1° | 146.4° |
| C25 | C17 | C18 | H13 | 177.2° | 179.7° |
| C17 | C25 | C23 | H15 | 178.3° | 179.7° |
| O51 | C52 | H5 | H6 | 120.0° | 120.0° |
| O51 | C52 | H5 | H7 | 120.0° | 120.0° |
| O51 | C52 | H6 | H7 | 120.0° | 120.1° |
| C49 | C46 | C47 | H4 | 1.0° | 0.0° |
| C12 | C9 | N8 | H20 | 119.9° | 119.7° |
| C12 | C9 | N8 | H21 | 119.8° | 119.8° |
| C9 | C12 | N1 | H11 | 120.1° | 119.9° |
| C9 | C12 | N1 | H12 | 120.1° | 119.8° |
| C12 | C9 | N8 | C15 | 123.3° | 124.8° |
| C12 | C9 | N8 | C5 | 58.2° | 55.2° |
| C9 | C12 | N1 | C56 | 129.3° | 124.9° |
| C9 | C12 | N1 | C2 | 51.1° | 55.1° |
| C9 | C12 | H11 | H12 | 119.9° | 120.5° |
| C12 | C9 | H20 | H21 | 120.4° | 120.4° |
| C9 | N8 | C15 | C17 | 4.1° | 5.4° |
| N8 | C9 | C12 | N1 | 46.0° | 49.3° |
| C9 | N8 | C15 | C5 | 178.5° | 180.0° |
| C9 | N8 | C15 | O16 | 178.1° | 174.5° |
| C9 | N8 | C5 | C2 | 63.7° | 55.2° |
| N8 | C9 | C12 | H11 | 74.1° | 169.1° |
| N8 | C9 | C12 | H12 | 166.0° | 70.5° |
| C9 | N8 | C5 | H18 | 55.6° | 175.0° |
| C9 | N8 | C5 | H19 | 177.0° | 64.5° |
| N8 | C9 | H20 | H21 | 120.4° | 120.5° |
| C17 | C15 | N8 | O16 | 177.8° | 180.0° |
| C17 | C15 | N8 | C5 | 177.4° | 174.5° |
| C15 | C17 | C18 | H13 | 1.9° | 0.0° |
| C15 | C17 | C25 | H16 | 1.3° | 0.3° |
| C12 | N1 | C56 | C58 | 0.2° | 174.9° |
| C12 | N1 | C56 | C2 | 179.6° | 180.0° |
| C12 | N1 | C56 | O57 | 179.5° | 5.0° |
| C12 | N1 | C2 | C5 | 57.5° | 55.3° |
| C12 | N1 | C2 | H1 | 62.3° | 64.5° |
| C12 | N1 | C2 | H2 | 177.2° | 175.1° |
| N1 | C12 | H11 | H12 | 119.8° | 120.3° |
| N1 | C12 | C9 | H20 | 73.9° | 70.3° |
| N1 | C12 | C9 | H21 | 165.8° | 169.2° |
| C58 | C56 | N1 | O57 | 179.3° | 180.0° |
| C58 | C56 | N1 | C2 | 179.8° | 5.1° |
| C56 | C58 | H8 | H9 | 120.0° | 120.0° |
| C56 | C58 | H8 | H10 | 120.0° | 120.0° |
| C56 | C58 | H9 | H10 | 120.0° | 120.0° |
| C15 | N8 | C5 | C2 | 117.7° | 124.8° |
| C15 | N8 | C5 | H18 | 123.0° | 5.0° |
| C15 | N8 | C5 | H19 | 1.6° | 115.4° |
| C15 | N8 | C9 | H20 | 116.8° | 115.5° |
| C15 | N8 | C9 | H21 | 3.5° | 5.1° |
| C5 | N8 | C15 | O16 | 0.4° | 5.5° |
| N8 | C5 | C2 | N1 | 57.7° | 49.5° |
| N8 | C5 | C2 | H18 | 119.3° | 119.7° |
| N8 | C5 | C2 | H19 | 119.3° | 119.9° |
| N8 | C5 | C2 | H1 | 62.1° | 70.4° |
| N8 | C5 | C2 | H2 | 177.4° | 169.3° |
| N8 | C5 | H18 | H19 | 122.1° | 120.6° |
| C5 | N8 | C9 | H20 | 61.7° | 64.5° |
| C5 | N8 | C9 | H21 | 178.0° | 174.9° |
| C56 | N1 | C2 | C5 | 122.9° | 124.7° |
| C56 | N1 | C2 | H1 | 117.3° | 115.5° |
| C56 | N1 | C2 | H2 | 3.2° | 4.9° |
| N1 | C56 | C58 | H8 | 179.3° | 94.1° |
| N1 | C56 | C58 | H9 | 60.7° | 25.9° |
| N1 | C56 | C58 | H10 | 59.3° | 145.9° |
| C56 | N1 | C12 | H11 | 110.6° | 5.0° |
| C56 | N1 | C12 | H12 | 9.3° | 115.3° |
| C2 | N1 | C56 | O57 | 1.0° | 174.9° |
| N1 | C2 | C5 | H1 | 119.7° | 119.9° |
| N1 | C2 | C5 | H2 | 119.8° | 119.8° |
| N1 | C2 | H1 | H2 | 120.8° | 120.4° |
| C2 | N1 | C12 | H11 | 69.0° | 175.0° |
| C2 | N1 | C12 | H12 | 171.2° | 64.7° |
| N1 | C2 | C5 | H18 | 61.6° | 169.2° |
| N1 | C2 | C5 | H19 | 177.0° | 70.4° |
| O57 | C56 | C58 | H8 | 0.0° | 85.9° |
| O57 | C56 | C58 | H9 | 120.0° | 154.1° |
| O57 | C56 | C58 | H10 | 120.0° | 34.1° |
| C5 | C2 | H1 | H2 | 120.7° | 120.3° |
| C2 | C5 | H18 | H19 | 122.0° | 120.3° |
| H1 | C2 | C5 | H18 | 178.6° | 49.4° |
| H1 | C2 | C5 | H19 | 57.2° | 169.7° |
| H2 | C2 | C5 | H18 | 58.1° | 70.9° |
| H2 | C2 | C5 | H19 | 63.3° | 49.4° |
| H5 | C52 | H6 | H7 | 120.0° | 120.0° |
| H8 | C58 | H9 | H10 | 120.0° | 119.9° |
| H11 | C12 | C9 | H20 | 166.1° | 49.4° |
| H11 | C12 | C9 | H21 | 45.8° | 71.1° |
| H12 | C12 | C9 | H20 | 46.2° | 169.9° |
| H12 | C12 | C9 | H21 | 74.1° | 49.4° |
| H14 | C21 | C23 | H15 | 0.8° | 0.0° |
| H15 | C23 | C25 | H16 | 1.7° | 0.3° |
| H23 | C37 | C39 | H24 | 3.4° | 0.0° |
