R9B
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | C7 | doub | 1.39Å | 1.40Å | Aromatic |
| C2 | C3 | doub | 1.39Å | 1.38Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C3 | CL5 | sing | 1.74Å | 1.71Å | |
| C4 | C6 | doub | 1.40Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.41Å | 1.41Å | Aromatic |
| C6 | C11 | sing | 1.46Å | 1.48Å | |
| C7 | N8 | sing | 1.38Å | 1.38Å | |
| N8 | C9 | sing | 1.34Å | 1.36Å | |
| C9 | C10 | sing | 1.41Å | 1.44Å | |
| C9 | O12 | doub | 1.22Å | 1.22Å | |
| C10 | C11 | doub | 1.36Å | 1.37Å | |
| C11 | C13 | sing | 1.51Å | 1.51Å | |
| C13 | N14 | sing | 1.46Å | 1.44Å | |
| N14 | C31 | sing | 1.35Å | 1.35Å | |
| C15 | C16 | sing | 1.40Å | 1.40Å | Aromatic |
| C15 | C18 | doub | 1.39Å | 1.40Å | Aromatic |
| C15 | C27 | sing | 1.48Å | 1.49Å | |
| C16 | C17 | doub | 1.36Å | 1.36Å | Aromatic |
| C17 | C20 | sing | 1.39Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C19 | C20 | doub | 1.41Å | 1.40Å | Aromatic |
| C19 | C24 | sing | 1.47Å | 1.49Å | |
| C20 | N21 | sing | 1.38Å | 1.39Å | |
| N21 | C22 | sing | 1.34Å | 1.34Å | |
| C22 | C23 | sing | 1.40Å | 1.41Å | |
| C22 | O26 | doub | 1.22Å | 1.23Å | |
| C23 | C24 | doub | 1.37Å | 1.38Å | |
| C24 | O25 | sing | 1.35Å | 1.34Å | |
| C27 | O28 | doub | 1.22Å | 1.21Å | |
| C27 | N29 | sing | 1.35Å | 1.36Å | |
| N29 | C30 | sing | 1.47Å | 1.46Å | |
| C30 | C31 | sing | 1.51Å | 1.51Å | |
| C30 | C33 | sing | 1.53Å | 1.53Å | |
| C31 | O32 | doub | 1.21Å | 1.22Å | |
| C33 | C34 | sing | 1.51Å | 1.49Å | |
| C34 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C34 | C39 | doub | 1.38Å | 1.40Å | Aromatic |
| C35 | C36 | doub | 1.38Å | 1.39Å | Aromatic |
| C36 | C37 | sing | 1.38Å | 1.40Å | Aromatic |
| C37 | C38 | doub | 1.38Å | 1.39Å | Aromatic |
| C38 | C39 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| N8 | H8 | sing | 0.97Å | 1.00Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| N14 | H14 | sing | 0.97Å | 1.00Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| N21 | H21 | sing | 0.97Å | 1.00Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| O25 | H25 | sing | 0.97Å | 0.95Å | |
| N29 | H29 | sing | 0.97Å | 1.00Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C39 | H39 | sing | 1.08Å | 1.08Å | |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C38 | H38 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C7 | 119.4° | 119.9° |
| C1 | C2 | C3 | 119.2° | 120.7° |
| C2 | C1 | H1 | 120.3° | 120.0° |
| C1 | C2 | H2 | 120.4° | 119.7° |
| C1 | C7 | C6 | 120.6° | 119.5° |
| C1 | C7 | N8 | 119.2° | 120.9° |
| C7 | C1 | H1 | 120.3° | 120.1° |
| C2 | C3 | C4 | 123.5° | 120.4° |
| C2 | C3 | CL5 | 117.2° | 119.8° |
| C3 | C2 | H2 | 120.4° | 119.7° |
| C4 | C3 | CL5 | 119.3° | 119.8° |
| C3 | C4 | C6 | 117.7° | 119.6° |
| C3 | C4 | H4 | 121.2° | 120.2° |
| C4 | C6 | C7 | 119.7° | 119.9° |
| C4 | C6 | C11 | 120.5° | 121.0° |
| C6 | C4 | H4 | 121.2° | 120.3° |
| C7 | C6 | C11 | 119.8° | 119.0° |
| C6 | C7 | N8 | 120.1° | 119.6° |
| C6 | C11 | C10 | 117.9° | 118.5° |
| C6 | C11 | C13 | 120.0° | 120.7° |
| C7 | N8 | C9 | 120.0° | 120.9° |
| C7 | N8 | H8 | 120.0° | 119.6° |
| N8 | C9 | C10 | 122.2° | 121.7° |
| N8 | C9 | O12 | 118.6° | 119.2° |
| C9 | N8 | H8 | 120.0° | 119.5° |
| C10 | C9 | O12 | 119.1° | 119.1° |
| C9 | C10 | C11 | 119.7° | 120.2° |
| C9 | C10 | H10 | 120.2° | 119.9° |
| C10 | C11 | C13 | 122.1° | 120.7° |
| C11 | C10 | H10 | 120.2° | 119.9° |
| C11 | C13 | N14 | 108.5° | 109.5° |
| C11 | C13 | H131 | 109.7° | 109.5° |
| C11 | C13 | H132 | 109.7° | 109.4° |
| C13 | N14 | C31 | 124.9° | 120.0° |
| N14 | C13 | H131 | 109.7° | 109.5° |
| N14 | C13 | H132 | 109.7° | 109.4° |
| C13 | N14 | H14 | 117.5° | 120.0° |
| N14 | C31 | C30 | 116.7° | 120.0° |
| N14 | C31 | O32 | 121.8° | 120.0° |
| C31 | N14 | H14 | 117.5° | 120.0° |
| C16 | C15 | C18 | 118.9° | 120.0° |
| C16 | C15 | C27 | 120.0° | 120.0° |
| C15 | C16 | C17 | 119.9° | 120.7° |
| C15 | C16 | H16 | 120.0° | 119.7° |
| C18 | C15 | C27 | 121.0° | 120.0° |
| C15 | C18 | C19 | 121.2° | 119.4° |
| C15 | C18 | H18 | 119.4° | 120.3° |
| C15 | C27 | O28 | 117.9° | 120.0° |
| C15 | C27 | N29 | 122.1° | 120.0° |
| C16 | C17 | C20 | 121.5° | 120.2° |
| C17 | C16 | H16 | 120.1° | 119.7° |
| C16 | C17 | H17 | 119.3° | 119.9° |
| C17 | C20 | C19 | 120.0° | 119.6° |
| C17 | C20 | N21 | 120.6° | 120.8° |
| C20 | C17 | H17 | 119.2° | 119.9° |
| C18 | C19 | C20 | 118.4° | 120.0° |
| C18 | C19 | C24 | 124.2° | 121.1° |
| C19 | C18 | H18 | 119.4° | 120.4° |
| C20 | C19 | C24 | 117.4° | 118.9° |
| C19 | C20 | N21 | 119.3° | 119.6° |
| C19 | C24 | C23 | 119.8° | 118.3° |
| C19 | C24 | O25 | 122.3° | 120.9° |
| C20 | N21 | C22 | 123.6° | 121.2° |
| C20 | N21 | H21 | 118.2° | 119.4° |
| N21 | C22 | C23 | 120.4° | 121.9° |
| N21 | C22 | O26 | 119.5° | 119.0° |
| C22 | N21 | H21 | 118.2° | 119.4° |
| C23 | C22 | O26 | 120.1° | 119.1° |
| C22 | C23 | C24 | 119.5° | 120.1° |
| C22 | C23 | H23 | 120.3° | 119.9° |
| C23 | C24 | O25 | 117.8° | 120.8° |
| C24 | C23 | H23 | 120.3° | 120.0° |
| C24 | O25 | H25 | 109.5° | 114.1° |
| O28 | C27 | N29 | 120.0° | 120.0° |
| C27 | N29 | C30 | 123.6° | 120.0° |
| C27 | N29 | H29 | 118.2° | 120.0° |
| N29 | C30 | C31 | 111.4° | 109.5° |
| N29 | C30 | C33 | 109.1° | 109.5° |
| C30 | N29 | H29 | 118.2° | 120.0° |
| N29 | C30 | H30 | 110.9° | 109.4° |
| C31 | C30 | C33 | 105.0° | 109.5° |
| C30 | C31 | O32 | 121.5° | 120.0° |
| C31 | C30 | H30 | 110.3° | 109.5° |
| C30 | C33 | C34 | 112.4° | 109.5° |
| C33 | C30 | H30 | 110.0° | 109.5° |
| C30 | C33 | H331 | 108.8° | 109.4° |
| C30 | C33 | H332 | 108.7° | 109.4° |
| C33 | C34 | C35 | 118.7° | 120.0° |
| C33 | C34 | C39 | 119.6° | 120.0° |
| C34 | C33 | H331 | 108.7° | 109.5° |
| C34 | C33 | H332 | 108.8° | 109.5° |
| C35 | C34 | C39 | 121.7° | 120.0° |
| C34 | C35 | C36 | 119.1° | 120.0° |
| C34 | C35 | H35 | 120.5° | 120.0° |
| C34 | C39 | C38 | 119.3° | 120.0° |
| C34 | C39 | H39 | 120.4° | 120.0° |
| C35 | C36 | C37 | 119.2° | 120.0° |
| C36 | C35 | H35 | 120.5° | 120.0° |
| C35 | C36 | H36 | 120.4° | 120.0° |
| C36 | C37 | C38 | 122.0° | 120.0° |
| C37 | C36 | H36 | 120.4° | 120.0° |
| C36 | C37 | H37 | 119.0° | 120.0° |
| C37 | C38 | C39 | 118.7° | 120.0° |
| C38 | C37 | H37 | 119.0° | 120.0° |
| C37 | C38 | H38 | 120.6° | 120.0° |
| C38 | C39 | H39 | 120.3° | 120.0° |
| C39 | C38 | H38 | 120.6° | 120.0° |
| H131 | C13 | H132 | 109.5° | 109.4° |
| H331 | C33 | H332 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C7 | H1 | 180.0° | 179.7° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 0.3° | 0.0° |
| C1 | C2 | C3 | CL5 | 179.6° | 179.9° |
| C2 | C1 | C7 | C6 | 0.0° | 0.1° |
| C2 | C1 | C7 | N8 | 177.0° | 180.0° |
| C7 | C1 | C2 | C3 | 0.1° | 0.1° |
| C1 | C7 | C6 | C4 | 0.1° | 0.0° |
| C1 | C7 | C6 | N8 | 177.0° | 180.0° |
| C1 | C7 | C6 | C11 | 179.8° | 180.0° |
| C1 | C7 | N8 | C9 | 175.1° | 180.0° |
| C7 | C1 | C2 | H2 | 179.9° | 180.0° |
| C1 | C7 | N8 | H8 | 4.9° | 0.0° |
| C2 | C3 | C4 | CL5 | 179.3° | 180.0° |
| C2 | C3 | C4 | C6 | 0.4° | 0.0° |
| C3 | C2 | C1 | H1 | 179.9° | 179.7° |
| C2 | C3 | C4 | H4 | 179.6° | 179.9° |
| C3 | C4 | C6 | H4 | 180.0° | 179.9° |
| C3 | C4 | C6 | C7 | 0.3° | 0.0° |
| C3 | C4 | C6 | C11 | 179.7° | 180.0° |
| C4 | C3 | C2 | H2 | 179.7° | 179.9° |
| CL5 | C3 | C4 | C6 | 179.7° | 180.0° |
| CL5 | C3 | C2 | H2 | 0.4° | 0.0° |
| CL5 | C3 | C4 | H4 | 0.3° | 0.0° |
| C4 | C6 | C7 | C11 | 179.9° | 179.9° |
| C4 | C6 | C7 | N8 | 177.1° | 180.0° |
| C4 | C6 | C11 | C10 | 174.7° | 180.0° |
| C4 | C6 | C11 | C13 | 4.7° | 0.1° |
| C6 | C7 | N8 | C9 | 1.9° | 0.1° |
| C7 | C6 | C11 | C10 | 5.2° | 0.0° |
| C7 | C6 | C11 | C13 | 175.4° | 179.9° |
| C6 | C7 | C1 | H1 | 180.0° | 179.7° |
| C7 | C6 | C4 | H4 | 179.7° | 180.0° |
| C6 | C7 | N8 | H8 | 178.1° | 180.0° |
| C11 | C6 | C7 | N8 | 2.8° | 0.1° |
| C6 | C11 | C10 | C9 | 2.9° | 0.0° |
| C6 | C11 | C10 | C13 | 179.4° | 179.9° |
| C6 | C11 | C13 | N14 | 176.5° | 85.0° |
| C11 | C6 | C4 | H4 | 0.4° | 0.1° |
| C6 | C11 | C10 | H10 | 177.1° | 180.0° |
| C6 | C11 | C13 | H131 | 63.7° | 35.1° |
| C6 | C11 | C13 | H132 | 56.6° | 155.1° |
| C7 | N8 | C9 | H8 | 180.0° | 179.9° |
| C7 | N8 | C9 | C10 | 4.3° | 0.0° |
| C7 | N8 | C9 | O12 | 177.8° | 180.0° |
| N8 | C7 | C1 | H1 | 3.0° | 0.3° |
| N8 | C9 | C10 | O12 | 177.9° | 180.0° |
| N8 | C9 | C10 | C11 | 1.8° | 0.0° |
| N8 | C9 | C10 | H10 | 178.2° | 180.0° |
| C9 | C10 | C11 | H10 | 180.0° | 180.0° |
| C9 | C10 | C11 | C13 | 177.7° | 179.9° |
| C10 | C9 | N8 | H8 | 175.7° | 180.0° |
| O12 | C9 | C10 | C11 | 179.7° | 180.0° |
| O12 | C9 | N8 | H8 | 2.2° | 0.0° |
| O12 | C9 | C10 | H10 | 0.3° | 0.0° |
| C10 | C11 | C13 | N14 | 2.9° | 94.9° |
| C10 | C11 | C13 | H131 | 116.9° | 145.0° |
| C10 | C11 | C13 | H132 | 122.8° | 25.0° |
| C11 | C13 | N14 | H131 | 119.9° | 120.1° |
| C11 | C13 | N14 | H132 | 119.9° | 119.9° |
| C11 | C13 | N14 | C31 | 107.8° | 180.0° |
| C13 | C11 | C10 | H10 | 2.3° | 0.1° |
| C11 | C13 | H131 | H132 | 120.4° | 119.9° |
| C11 | C13 | N14 | H14 | 72.2° | 0.1° |
| C13 | N14 | C31 | H14 | 180.0° | 179.9° |
| C13 | N14 | C31 | C30 | 179.6° | 180.0° |
| C13 | N14 | C31 | O32 | 2.8° | 0.0° |
| N14 | C13 | H131 | H132 | 120.4° | 120.0° |
| N14 | C31 | C30 | N29 | 179.9° | 180.0° |
| N14 | C31 | C30 | O32 | 177.5° | 180.0° |
| N14 | C31 | C30 | C33 | 62.0° | 60.0° |
| C31 | N14 | C13 | H131 | 12.1° | 60.0° |
| C31 | N14 | C13 | H132 | 132.3° | 60.0° |
| N14 | C31 | C30 | H30 | 56.4° | 60.0° |
| C16 | C15 | C18 | C27 | 177.4° | 179.8° |
| C15 | C16 | C17 | H16 | 180.0° | 179.9° |
| C15 | C16 | C17 | C20 | 1.9° | 0.1° |
| C16 | C15 | C18 | C19 | 0.7° | 0.0° |
| C16 | C15 | C27 | O28 | 159.5° | 180.0° |
| C16 | C15 | C27 | N29 | 18.7° | 0.0° |
| C16 | C15 | C18 | H18 | 179.3° | 180.0° |
| C15 | C16 | C17 | H17 | 178.1° | 180.0° |
| C18 | C15 | C16 | C17 | 1.9° | 0.1° |
| C15 | C18 | C19 | H18 | 180.0° | 180.0° |
| C15 | C18 | C19 | C20 | 0.6° | 0.0° |
| C15 | C18 | C19 | C24 | 178.7° | 179.9° |
| C18 | C15 | C27 | O28 | 17.9° | 0.3° |
| C18 | C15 | C27 | N29 | 163.9° | 179.8° |
| C18 | C15 | C16 | H16 | 178.1° | 180.0° |
| C27 | C15 | C16 | C17 | 179.4° | 179.7° |
| C27 | C15 | C18 | C19 | 178.1° | 179.7° |
| C15 | C27 | O28 | N29 | 178.2° | 180.0° |
| C15 | C27 | N29 | C30 | 179.5° | 180.0° |
| C27 | C15 | C16 | H16 | 0.6° | 0.2° |
| C27 | C15 | C18 | H18 | 1.9° | 0.3° |
| C15 | C27 | N29 | H29 | 0.5° | 0.1° |
| C16 | C17 | C20 | H17 | 180.0° | 180.0° |
| C16 | C17 | C20 | C19 | 0.6° | 0.0° |
| C16 | C17 | C20 | N21 | 178.8° | 180.0° |
| C17 | C20 | C19 | C18 | 0.6° | 0.0° |
| C17 | C20 | C19 | N21 | 179.4° | 180.0° |
| C17 | C20 | C19 | C24 | 178.7° | 180.0° |
| C17 | C20 | N21 | C22 | 179.2° | 180.0° |
| C20 | C17 | C16 | H16 | 178.1° | 180.0° |
| C17 | C20 | N21 | H21 | 0.8° | 0.0° |
| C18 | C19 | C20 | C24 | 179.4° | 179.9° |
| C18 | C19 | C20 | N21 | 179.9° | 180.0° |
| C18 | C19 | C24 | C23 | 180.0° | 179.9° |
| C18 | C19 | C24 | O25 | 1.0° | 0.1° |
| C19 | C20 | N21 | C22 | 0.2° | 0.0° |
| C20 | C19 | C24 | C23 | 0.7° | 0.1° |
| C20 | C19 | C24 | O25 | 178.3° | 180.0° |
| C20 | C19 | C18 | H18 | 179.4° | 180.0° |
| C19 | C20 | C17 | H17 | 179.4° | 180.0° |
| C19 | C20 | N21 | H21 | 179.7° | 180.0° |
| C24 | C19 | C20 | N21 | 0.7° | 0.1° |
| C19 | C24 | C23 | C22 | 0.2° | 0.1° |
| C19 | C24 | C23 | O25 | 179.0° | 179.9° |
| C24 | C19 | C18 | H18 | 1.3° | 0.0° |
| C19 | C24 | C23 | H23 | 179.8° | 179.9° |
| C19 | C24 | O25 | H25 | 180.0° | 180.0° |
| C20 | N21 | C22 | H21 | 180.0° | 179.9° |
| C20 | N21 | C22 | C23 | 0.3° | 0.0° |
| C20 | N21 | C22 | O26 | 179.7° | 179.9° |
| N21 | C20 | C17 | H17 | 1.2° | 0.0° |
| N21 | C22 | C23 | O26 | 179.5° | 180.0° |
| N21 | C22 | C23 | C24 | 0.3° | 0.0° |
| N21 | C22 | C23 | H23 | 179.7° | 180.0° |
| C22 | C23 | C24 | H23 | 180.0° | 180.0° |
| C22 | C23 | C24 | O25 | 178.8° | 180.0° |
| C23 | C22 | N21 | H21 | 179.7° | 180.0° |
| O26 | C22 | C23 | C24 | 179.8° | 180.0° |
| O26 | C22 | N21 | H21 | 0.3° | 0.0° |
| O26 | C22 | C23 | H23 | 0.2° | 0.0° |
| C23 | C24 | O25 | H25 | 1.0° | 0.2° |
| O25 | C24 | C23 | H23 | 1.2° | 0.0° |
| O28 | C27 | N29 | C30 | 1.4° | 0.1° |
| O28 | C27 | N29 | H29 | 178.6° | 180.0° |
| C27 | N29 | C30 | H29 | 180.0° | 179.9° |
| C27 | N29 | C30 | C31 | 123.3° | 155.0° |
| C27 | N29 | C30 | C33 | 121.3° | 84.9° |
| C27 | N29 | C30 | H30 | 0.0° | 35.1° |
| N29 | C30 | C31 | C33 | 117.9° | 120.0° |
| N29 | C30 | C31 | H30 | 123.6° | 120.0° |
| N29 | C30 | C33 | H30 | 121.8° | 120.0° |
| N29 | C30 | C31 | O32 | 2.4° | 0.0° |
| N29 | C30 | C33 | C34 | 35.7° | 65.0° |
| N29 | C30 | C33 | H331 | 84.8° | 55.1° |
| N29 | C30 | C33 | H332 | 156.1° | 175.0° |
| C31 | C30 | C33 | H30 | 118.7° | 120.0° |
| C31 | C30 | C33 | C34 | 155.2° | 175.0° |
| C30 | C31 | N14 | H14 | 0.4° | 0.0° |
| C31 | C30 | N29 | H29 | 56.7° | 25.1° |
| C31 | C30 | C33 | H331 | 34.7° | 64.9° |
| C31 | C30 | C33 | H332 | 84.4° | 55.0° |
| C33 | C30 | C31 | O32 | 115.5° | 120.0° |
| C30 | C33 | C34 | H331 | 120.5° | 120.0° |
| C30 | C33 | C34 | H332 | 120.4° | 120.0° |
| C30 | C33 | C34 | C35 | 102.1° | 90.0° |
| C30 | C33 | C34 | C39 | 77.6° | 90.3° |
| C33 | C30 | N29 | H29 | 58.8° | 95.0° |
| C30 | C33 | H331 | H332 | 118.6° | 119.9° |
| O32 | C31 | N14 | H14 | 177.2° | 180.0° |
| O32 | C31 | C30 | H30 | 126.0° | 120.0° |
| C33 | C34 | C35 | C39 | 179.7° | 179.7° |
| C33 | C34 | C35 | C36 | 179.8° | 179.9° |
| C33 | C34 | C39 | C38 | 179.9° | 179.8° |
| C34 | C33 | C30 | H30 | 86.2° | 55.0° |
| C34 | C33 | H331 | H332 | 118.7° | 120.1° |
| C33 | C34 | C35 | H35 | 0.2° | 0.0° |
| C33 | C34 | C39 | H39 | 0.1° | 0.1° |
| C34 | C35 | C36 | H35 | 180.0° | 179.9° |
| C34 | C35 | C36 | C37 | 0.1° | 0.1° |
| C35 | C34 | C39 | C38 | 0.2° | 0.5° |
| C35 | C34 | C33 | H331 | 18.3° | 30.0° |
| C35 | C34 | C33 | H332 | 137.5° | 150.0° |
| C35 | C34 | C39 | H39 | 179.8° | 179.8° |
| C34 | C35 | C36 | H36 | 179.9° | 180.0° |
| C39 | C34 | C35 | C36 | 0.4° | 0.3° |
| C34 | C39 | C38 | C37 | 0.3° | 0.5° |
| C34 | C39 | C38 | H39 | 180.0° | 179.7° |
| C39 | C34 | C33 | H331 | 161.9° | 149.7° |
| C39 | C34 | C33 | H332 | 42.8° | 29.7° |
| C39 | C34 | C35 | H35 | 179.5° | 179.7° |
| C34 | C39 | C38 | H38 | 179.7° | 179.7° |
| C35 | C36 | C37 | H36 | 180.0° | 179.9° |
| C35 | C36 | C37 | C38 | 0.4° | 0.1° |
| C35 | C36 | C37 | H37 | 179.6° | 179.9° |
| C36 | C37 | C38 | H37 | 180.0° | 180.0° |
| C36 | C37 | C38 | C39 | 0.6° | 0.2° |
| C37 | C36 | C35 | H35 | 179.8° | 180.0° |
| C36 | C37 | C38 | H38 | 179.4° | 179.9° |
| C37 | C38 | C39 | H38 | 180.0° | 179.8° |
| C37 | C38 | C39 | H39 | 179.7° | 179.8° |
| C38 | C37 | C36 | H36 | 179.6° | 180.0° |
| C39 | C38 | C37 | H37 | 179.4° | 179.8° |
| H1 | C1 | C2 | H2 | 0.1° | 0.4° |
| H131 | C13 | N14 | H14 | 168.0° | 120.0° |
| H132 | C13 | N14 | H14 | 47.7° | 120.0° |
| H16 | C16 | C17 | H17 | 1.9° | 0.0° |
| H29 | N29 | C30 | H30 | 180.0° | 145.0° |
| H30 | C30 | C33 | H331 | 153.4° | 175.0° |
| H30 | C30 | C33 | H332 | 34.3° | 65.1° |
| H35 | C35 | C36 | H36 | 0.2° | 0.1° |
| H39 | C39 | C38 | H38 | 0.3° | 0.0° |
| H36 | C36 | C37 | H37 | 0.4° | 0.0° |
| H37 | C37 | C38 | H38 | 0.6° | 0.0° |
