9XH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F28 | C27 | sing | 1.35Å | 1.35Å | |
| C3 | C2 | sing | 1.38Å | 1.40Å | Aromatic |
| C3 | C4 | doub | 1.38Å | 1.40Å | Aromatic |
| C27 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | C1 | doub | 1.38Å | 1.40Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C34 | sing | 1.38Å | 1.39Å | Aromatic |
| C32 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
| C25 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| O16 | C15 | doub | 1.21Å | 1.22Å | |
| C30 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.51Å | 1.48Å | |
| C1 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C6 | doub | 1.38Å | 1.45Å | Aromatic |
| C5 | C9 | sing | 1.51Å | 1.50Å | |
| F35 | C34 | sing | 1.35Å | 1.35Å | |
| C34 | C36 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.51Å | 1.50Å | |
| C31 | C23 | sing | 1.51Å | 1.48Å | |
| C31 | C37 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | N20 | sing | 1.47Å | 1.47Å | |
| C22 | N17 | sing | 1.47Å | 1.46Å | |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C9 | N8 | sing | 1.47Å | 1.47Å | |
| N17 | C15 | sing | 1.35Å | 1.35Å | |
| N17 | C18 | sing | 1.47Å | 1.47Å | |
| C15 | C14 | sing | 1.51Å | 1.52Å | |
| C18 | C19 | sing | 1.53Å | 1.52Å | |
| C7 | N8 | sing | 1.47Å | 1.47Å | |
| N8 | C10 | sing | 1.35Å | 1.34Å | |
| C36 | C37 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C14 | sing | 1.53Å | 1.53Å | |
| C12 | C10 | sing | 1.51Å | 1.52Å | |
| C12 | N13 | sing | 1.47Å | 1.47Å | |
| N20 | C21 | sing | 1.47Å | 1.45Å | |
| N20 | C19 | sing | 1.47Å | 1.46Å | |
| C10 | O11 | doub | 1.21Å | 1.22Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| N13 | H7 | sing | 1.01Å | 1.00Å | |
| N13 | H8 | sing | 1.01Å | 1.00Å | |
| C18 | H11 | sing | 1.09Å | 1.10Å | |
| C18 | H12 | sing | 1.09Å | 1.10Å | |
| C19 | H13 | sing | 1.09Å | 1.10Å | |
| C19 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C30 | H18 | sing | 1.08Å | 1.08Å | |
| C32 | H19 | sing | 1.08Å | 1.08Å | |
| C33 | H20 | sing | 1.08Å | 1.08Å | |
| C36 | H21 | sing | 1.08Å | 1.08Å | |
| C37 | H22 | sing | 1.08Å | 1.08Å | |
| C9 | H23 | sing | 1.09Å | 1.10Å | |
| C14 | H24 | sing | 1.09Å | 1.10Å | |
| C14 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| C22 | H30 | sing | 1.09Å | 1.10Å | |
| C25 | H31 | sing | 1.08Å | 1.08Å | |
| C26 | H32 | sing | 1.08Å | 1.08Å | |
| C29 | H33 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F28 | C27 | C26 | 120.0° | 120.0° |
| F28 | C27 | C29 | 119.9° | 120.0° |
| C2 | C3 | C4 | 121.5° | 119.9° |
| C3 | C2 | C1 | 120.7° | 120.0° |
| C3 | C2 | H2 | 119.6° | 120.0° |
| C2 | C3 | H3 | 119.2° | 120.0° |
| C3 | C4 | C5 | 118.8° | 120.1° |
| C4 | C3 | H3 | 119.3° | 120.0° |
| C3 | C4 | H4 | 120.6° | 119.9° |
| C26 | C27 | C29 | 120.1° | 120.0° |
| C27 | C26 | C25 | 120.1° | 120.0° |
| C27 | C26 | H32 | 120.0° | 120.0° |
| C27 | C29 | C30 | 119.9° | 119.9° |
| C27 | C29 | H33 | 120.1° | 120.0° |
| C26 | C25 | C24 | 119.9° | 120.0° |
| C26 | C25 | H31 | 120.0° | 120.0° |
| C25 | C26 | H32 | 120.0° | 120.0° |
| C2 | C1 | C6 | 118.3° | 120.1° |
| C2 | C1 | H1 | 120.9° | 120.0° |
| C1 | C2 | H2 | 119.6° | 120.0° |
| C4 | C5 | C6 | 119.7° | 119.9° |
| C4 | C5 | C9 | 130.1° | 131.2° |
| C5 | C4 | H4 | 120.6° | 120.0° |
| C29 | C30 | C24 | 120.1° | 120.0° |
| C29 | C30 | H18 | 120.0° | 120.0° |
| C30 | C29 | H33 | 120.1° | 120.0° |
| C32 | C33 | C34 | 119.9° | 120.0° |
| C33 | C32 | C31 | 120.1° | 120.0° |
| C33 | C32 | H19 | 119.9° | 120.0° |
| C32 | C33 | H20 | 120.0° | 120.0° |
| C33 | C34 | F35 | 120.0° | 120.1° |
| C33 | C34 | C36 | 120.0° | 119.9° |
| C34 | C33 | H20 | 120.0° | 120.0° |
| C32 | C31 | C23 | 119.8° | 119.9° |
| C32 | C31 | C37 | 119.9° | 120.1° |
| C31 | C32 | H19 | 120.0° | 120.0° |
| C25 | C24 | C30 | 120.0° | 120.1° |
| C25 | C24 | C23 | 120.2° | 120.0° |
| C24 | C25 | H31 | 120.0° | 120.0° |
| O16 | C15 | N17 | 90.8° | 120.0° |
| O16 | C15 | C14 | 121.7° | 120.0° |
| C30 | C24 | C23 | 119.8° | 120.0° |
| C24 | C30 | H18 | 120.0° | 120.0° |
| C24 | C23 | C31 | 108.9° | 109.5° |
| C24 | C23 | N20 | 108.9° | 109.5° |
| C24 | C23 | H17 | 109.5° | 109.4° |
| C1 | C6 | C5 | 120.9° | 119.9° |
| C1 | C6 | C7 | 130.2° | 131.2° |
| C6 | C1 | H1 | 120.8° | 119.9° |
| C6 | C5 | C9 | 110.2° | 108.8° |
| C5 | C6 | C7 | 108.9° | 108.8° |
| C5 | C9 | N8 | 103.2° | 107.7° |
| C5 | C9 | H23 | 111.0° | 109.8° |
| C5 | C9 | H9 | 111.0° | 109.8° |
| F35 | C34 | C36 | 120.1° | 120.0° |
| C34 | C36 | C37 | 120.1° | 120.0° |
| C34 | C36 | H21 | 120.0° | 120.0° |
| C6 | C7 | N8 | 104.2° | 107.7° |
| C6 | C7 | H5 | 110.8° | 109.8° |
| C6 | C7 | H10 | 110.8° | 109.8° |
| C23 | C31 | C37 | 120.2° | 120.0° |
| C31 | C23 | N20 | 110.2° | 109.5° |
| C31 | C23 | H17 | 109.6° | 109.4° |
| C31 | C37 | C36 | 120.0° | 120.0° |
| C31 | C37 | H22 | 120.0° | 120.0° |
| C23 | N20 | C21 | 108.6° | 111.0° |
| C23 | N20 | C19 | 110.5° | 111.0° |
| N20 | C23 | H17 | 109.7° | 109.5° |
| N17 | C22 | C21 | 108.7° | 108.5° |
| C22 | N17 | C15 | 130.5° | 120.9° |
| C22 | N17 | C18 | 117.1° | 118.2° |
| N17 | C22 | H29 | 109.7° | 109.6° |
| N17 | C22 | H30 | 109.6° | 109.6° |
| C22 | C21 | N20 | 108.7° | 109.4° |
| C22 | C21 | H15 | 109.7° | 109.5° |
| C22 | C21 | H16 | 109.7° | 109.5° |
| C21 | C22 | H29 | 109.6° | 109.7° |
| C21 | C22 | H30 | 109.7° | 109.6° |
| C9 | N8 | C7 | 113.4° | 106.9° |
| C9 | N8 | C10 | 124.6° | 126.6° |
| N8 | C9 | H23 | 111.0° | 109.9° |
| N8 | C9 | H9 | 111.0° | 109.8° |
| C15 | N17 | C18 | 112.0° | 120.9° |
| N17 | C15 | C14 | 120.5° | 120.0° |
| N17 | C18 | C19 | 110.7° | 108.6° |
| N17 | C18 | H11 | 109.2° | 109.6° |
| N17 | C18 | H12 | 109.2° | 109.8° |
| C15 | C14 | C12 | 112.2° | 109.5° |
| C15 | C14 | H24 | 108.8° | 109.5° |
| C15 | C14 | H25 | 108.8° | 109.4° |
| C18 | C19 | N20 | 110.3° | 109.3° |
| C19 | C18 | H11 | 109.2° | 109.6° |
| C19 | C18 | H12 | 109.2° | 109.6° |
| C18 | C19 | H13 | 109.3° | 109.5° |
| C18 | C19 | H14 | 109.3° | 109.6° |
| C7 | N8 | C10 | 121.9° | 126.6° |
| N8 | C7 | H5 | 110.8° | 109.8° |
| N8 | C7 | H10 | 110.8° | 109.8° |
| N8 | C10 | C12 | 115.8° | 120.0° |
| N8 | C10 | O11 | 122.7° | 120.0° |
| C37 | C36 | H21 | 119.9° | 120.0° |
| C36 | C37 | H22 | 120.0° | 120.0° |
| C14 | C12 | C10 | 112.7° | 109.5° |
| C14 | C12 | N13 | 108.2° | 109.5° |
| C14 | C12 | H6 | 108.4° | 109.5° |
| C12 | C14 | H24 | 108.8° | 109.5° |
| C12 | C14 | H25 | 108.8° | 109.5° |
| C10 | C12 | N13 | 109.7° | 109.5° |
| C12 | C10 | O11 | 121.4° | 120.0° |
| C10 | C12 | H6 | 108.6° | 109.5° |
| N13 | C12 | H6 | 109.2° | 109.4° |
| C12 | N13 | H7 | 109.5° | 110.9° |
| C12 | N13 | H8 | 109.5° | 111.0° |
| C21 | N20 | C19 | 106.1° | 111.2° |
| N20 | C21 | H15 | 109.7° | 109.5° |
| N20 | C21 | H16 | 109.7° | 109.5° |
| N20 | C19 | H13 | 109.3° | 109.5° |
| N20 | C19 | H14 | 109.3° | 109.5° |
| H5 | C7 | H10 | 109.5° | 109.9° |
| H7 | N13 | H8 | 109.5° | 111.0° |
| H11 | C18 | H12 | 109.5° | 109.6° |
| H13 | C19 | H14 | 109.5° | 109.5° |
| H15 | C21 | H16 | 109.5° | 109.4° |
| H23 | C9 | H9 | 109.5° | 109.8° |
| H24 | C14 | H25 | 109.5° | 109.5° |
| H29 | C22 | H30 | 109.5° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F28 | C27 | C26 | C29 | 180.0° | 179.7° |
| F28 | C27 | C26 | C25 | 179.9° | 179.9° |
| F28 | C27 | C29 | C30 | 180.0° | 179.9° |
| F28 | C27 | C26 | H32 | 0.1° | 0.3° |
| F28 | C27 | C29 | H33 | 0.1° | 0.3° |
| C2 | C3 | C4 | H3 | 180.0° | 180.0° |
| C3 | C2 | C1 | H2 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.3° | 0.0° |
| C3 | C2 | C1 | C6 | 0.1° | 0.0° |
| C3 | C2 | C1 | H1 | 179.9° | 179.6° |
| C2 | C3 | C4 | H4 | 179.7° | 180.0° |
| C4 | C3 | C2 | C1 | 0.1° | 0.0° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.5° | 0.0° |
| C3 | C4 | C5 | C9 | 179.8° | 180.0° |
| C4 | C3 | C2 | H2 | 179.9° | 180.0° |
| C27 | C26 | C25 | H32 | 180.0° | 179.8° |
| C26 | C27 | C29 | C30 | 0.0° | 0.2° |
| C27 | C26 | C25 | C24 | 0.1° | 0.1° |
| C27 | C26 | C25 | H31 | 180.0° | 180.0° |
| C26 | C27 | C29 | H33 | 180.0° | 180.0° |
| C29 | C27 | C26 | C25 | 0.0° | 0.2° |
| C27 | C29 | C30 | H33 | 180.0° | 179.8° |
| C27 | C29 | C30 | C24 | 0.0° | 0.1° |
| C27 | C29 | C30 | H18 | 180.0° | 180.0° |
| C29 | C27 | C26 | H32 | 180.0° | 180.0° |
| C26 | C25 | C24 | H31 | 180.0° | 179.9° |
| C26 | C25 | C24 | C30 | 0.1° | 0.4° |
| C26 | C25 | C24 | C23 | 180.0° | 180.0° |
| C2 | C1 | C6 | H1 | 180.0° | 179.6° |
| C2 | C1 | C6 | C5 | 0.4° | 0.0° |
| C2 | C1 | C6 | C7 | 179.5° | 179.8° |
| C1 | C2 | C3 | H3 | 179.9° | 180.0° |
| C4 | C5 | C6 | C1 | 0.5° | 0.0° |
| C4 | C5 | C6 | C9 | 179.8° | 180.0° |
| C4 | C5 | C6 | C7 | 179.8° | 179.8° |
| C4 | C5 | C9 | N8 | 178.6° | 180.0° |
| C5 | C4 | C3 | H3 | 179.7° | 180.0° |
| C4 | C5 | C9 | H23 | 62.4° | 60.4° |
| C4 | C5 | C9 | H9 | 59.6° | 60.4° |
| C29 | C30 | C24 | C25 | 0.1° | 0.4° |
| C29 | C30 | C24 | H18 | 180.0° | 180.0° |
| C29 | C30 | C24 | C23 | 180.0° | 180.0° |
| C32 | C33 | C34 | H20 | 180.0° | 180.0° |
| C33 | C32 | C31 | H19 | 180.0° | 179.9° |
| C32 | C33 | C34 | F35 | 180.0° | 180.0° |
| C32 | C33 | C34 | C36 | 0.1° | 0.1° |
| C33 | C32 | C31 | C23 | 179.9° | 180.0° |
| C33 | C32 | C31 | C37 | 0.2° | 0.3° |
| C34 | C33 | C32 | C31 | 0.1° | 0.1° |
| C33 | C34 | F35 | C36 | 179.9° | 179.9° |
| C33 | C34 | C36 | C37 | 0.1° | 0.3° |
| C34 | C33 | C32 | H19 | 179.9° | 180.0° |
| C33 | C34 | C36 | H21 | 179.9° | 180.0° |
| C32 | C31 | C23 | C24 | 81.8° | 80.3° |
| C32 | C31 | C23 | C37 | 179.7° | 179.7° |
| C32 | C31 | C23 | N20 | 158.7° | 39.7° |
| C32 | C31 | C37 | C36 | 0.2° | 0.6° |
| C32 | C31 | C23 | H17 | 38.0° | 159.7° |
| C31 | C32 | C33 | H20 | 179.9° | 180.0° |
| C32 | C31 | C37 | H22 | 179.9° | 179.8° |
| C25 | C24 | C30 | C23 | 179.9° | 179.7° |
| C25 | C24 | C23 | C31 | 160.0° | 80.3° |
| C25 | C24 | C23 | N20 | 79.7° | 39.7° |
| C25 | C24 | C23 | H17 | 40.2° | 159.7° |
| C25 | C24 | C30 | H18 | 179.9° | 179.7° |
| C24 | C25 | C26 | H32 | 179.9° | 179.7° |
| O16 | C15 | N17 | C22 | 92.6° | 179.9° |
| O16 | C15 | N17 | C14 | 128.2° | 179.9° |
| O16 | C15 | N17 | C18 | 94.7° | 0.1° |
| O16 | C15 | C14 | C12 | 67.6° | 0.1° |
| O16 | C15 | C14 | H24 | 52.8° | 119.9° |
| O16 | C15 | C14 | H25 | 172.0° | 120.1° |
| C30 | C24 | C23 | C31 | 20.1° | 100.0° |
| C30 | C24 | C23 | N20 | 100.2° | 140.0° |
| C30 | C24 | C23 | H17 | 139.9° | 20.0° |
| C30 | C24 | C25 | H31 | 179.9° | 179.7° |
| C24 | C30 | C29 | H33 | 180.0° | 179.7° |
| C24 | C23 | C31 | N20 | 119.4° | 120.0° |
| C24 | C23 | C31 | H17 | 119.8° | 120.0° |
| C24 | C23 | C31 | C37 | 97.9° | 100.0° |
| C24 | C23 | N20 | H17 | 119.9° | 120.0° |
| C24 | C23 | N20 | C21 | 39.2° | 180.0° |
| C24 | C23 | N20 | C19 | 155.2° | 55.7° |
| C23 | C24 | C30 | H18 | 0.0° | 0.0° |
| C23 | C24 | C25 | H31 | 0.0° | 0.1° |
| C1 | C6 | C5 | C7 | 179.3° | 179.8° |
| C1 | C6 | C5 | C9 | 179.7° | 180.0° |
| C1 | C6 | C7 | N8 | 178.1° | 180.0° |
| C6 | C1 | C2 | H2 | 179.8° | 180.0° |
| C1 | C6 | C7 | H5 | 59.0° | 60.5° |
| C1 | C6 | C7 | H10 | 62.7° | 60.4° |
| C6 | C5 | C9 | N8 | 1.6° | 0.1° |
| C5 | C6 | C7 | N8 | 1.1° | 0.2° |
| C5 | C6 | C1 | H1 | 179.7° | 179.6° |
| C6 | C5 | C4 | H4 | 179.5° | 179.9° |
| C5 | C6 | C7 | H5 | 120.2° | 119.3° |
| C6 | C5 | C9 | H23 | 117.4° | 119.6° |
| C6 | C5 | C9 | H9 | 120.6° | 119.6° |
| C5 | C6 | C7 | H10 | 118.1° | 119.8° |
| C9 | C5 | C6 | C7 | 0.4° | 0.2° |
| C5 | C9 | N8 | H23 | 119.0° | 119.6° |
| C5 | C9 | N8 | H9 | 119.0° | 119.5° |
| C5 | C9 | N8 | C7 | 2.4° | 0.1° |
| C5 | C9 | N8 | C10 | 175.7° | 179.8° |
| C9 | C5 | C4 | H4 | 0.3° | 0.0° |
| C5 | C9 | H23 | H9 | 122.9° | 120.8° |
| F35 | C34 | C36 | C37 | 180.0° | 179.8° |
| F35 | C34 | C33 | H20 | 0.0° | 0.1° |
| F35 | C34 | C36 | H21 | 0.0° | 0.1° |
| C34 | C36 | C37 | C31 | 0.1° | 0.6° |
| C34 | C36 | C37 | H21 | 180.0° | 179.7° |
| C36 | C34 | C33 | H20 | 180.0° | 180.0° |
| C34 | C36 | C37 | H22 | 179.9° | 179.8° |
| C6 | C7 | N8 | C9 | 2.2° | 0.2° |
| C6 | C7 | N8 | H5 | 119.2° | 119.5° |
| C6 | C7 | N8 | H10 | 119.2° | 119.6° |
| C6 | C7 | N8 | C10 | 176.0° | 179.9° |
| C7 | C6 | C1 | H1 | 0.5° | 0.1° |
| C6 | C7 | H5 | H10 | 122.4° | 120.9° |
| C31 | C23 | N20 | H17 | 120.7° | 120.0° |
| C23 | C31 | C37 | C36 | 179.9° | 179.8° |
| C31 | C23 | N20 | C21 | 158.6° | 60.0° |
| C31 | C23 | N20 | C19 | 85.4° | 175.7° |
| C23 | C31 | C32 | H19 | 0.1° | 0.1° |
| C23 | C31 | C37 | H22 | 0.1° | 0.1° |
| C37 | C31 | C23 | N20 | 21.6° | 139.9° |
| C31 | C37 | C36 | H22 | 180.0° | 179.6° |
| C37 | C31 | C23 | H17 | 142.3° | 19.9° |
| C37 | C31 | C32 | H19 | 179.9° | 179.7° |
| C31 | C37 | C36 | H21 | 179.9° | 179.7° |
| C23 | N20 | C21 | C22 | 48.6° | 172.7° |
| C23 | N20 | C19 | C18 | 51.6° | 172.8° |
| C23 | N20 | C21 | C19 | 118.9° | 124.2° |
| C23 | N20 | C19 | H13 | 68.5° | 67.3° |
| C23 | N20 | C19 | H14 | 171.7° | 52.7° |
| C23 | N20 | C21 | H15 | 168.5° | 67.3° |
| C23 | N20 | C21 | H16 | 71.3° | 52.7° |
| N17 | C22 | C21 | H29 | 119.9° | 119.7° |
| N17 | C22 | C21 | H30 | 119.9° | 119.6° |
| C22 | N17 | C15 | C18 | 172.7° | 180.0° |
| C22 | N17 | C15 | C14 | 35.5° | 0.0° |
| C22 | N17 | C18 | C19 | 43.6° | 51.2° |
| N17 | C22 | C21 | N20 | 59.8° | 53.9° |
| C22 | N17 | C18 | H11 | 76.5° | 68.5° |
| C22 | N17 | C18 | H12 | 163.8° | 171.0° |
| N17 | C22 | C21 | H15 | 60.1° | 66.1° |
| N17 | C22 | C21 | H16 | 179.7° | 173.8° |
| N17 | C22 | H29 | H30 | 120.3° | 120.5° |
| C21 | C22 | N17 | C15 | 125.2° | 128.8° |
| C21 | C22 | N17 | C18 | 47.3° | 51.2° |
| C22 | C21 | N20 | H15 | 119.9° | 120.0° |
| C22 | C21 | N20 | H16 | 119.9° | 120.0° |
| C22 | C21 | N20 | C19 | 70.2° | 63.1° |
| C22 | C21 | H15 | H16 | 120.3° | 120.1° |
| C21 | C22 | H29 | H30 | 120.4° | 120.5° |
| C9 | N8 | C7 | C10 | 178.2° | 179.7° |
| C9 | N8 | C10 | C12 | 104.8° | 0.3° |
| C9 | N8 | C10 | O11 | 76.0° | 179.7° |
| C9 | N8 | C7 | H5 | 121.4° | 119.3° |
| N8 | C9 | H23 | H9 | 122.9° | 120.9° |
| C9 | N8 | C7 | H10 | 117.0° | 119.8° |
| C15 | N17 | C18 | C19 | 130.2° | 128.8° |
| N17 | C15 | C14 | C12 | 179.9° | 180.0° |
| C15 | N17 | C18 | H11 | 109.7° | 111.5° |
| C15 | N17 | C18 | H12 | 10.0° | 9.0° |
| N17 | C15 | C14 | H24 | 59.7° | 60.0° |
| N17 | C15 | C14 | H25 | 59.5° | 60.0° |
| C15 | N17 | C22 | H29 | 5.3° | 9.1° |
| C15 | N17 | C22 | H30 | 114.9° | 111.5° |
| C18 | N17 | C15 | C14 | 137.2° | 180.0° |
| N17 | C18 | C19 | H11 | 120.2° | 119.7° |
| N17 | C18 | C19 | H12 | 120.2° | 120.0° |
| N17 | C18 | C19 | N20 | 51.8° | 53.8° |
| N17 | C18 | H11 | H12 | 119.5° | 120.6° |
| N17 | C18 | C19 | H13 | 171.9° | 66.1° |
| N17 | C18 | C19 | H14 | 68.3° | 173.8° |
| C18 | N17 | C22 | H29 | 167.1° | 170.9° |
| C18 | N17 | C22 | H30 | 72.6° | 68.5° |
| C15 | C14 | C12 | H24 | 120.4° | 120.0° |
| C15 | C14 | C12 | H25 | 120.4° | 119.9° |
| C15 | C14 | C12 | C10 | 176.7° | 174.9° |
| C15 | C14 | C12 | N13 | 61.8° | 65.0° |
| C15 | C14 | C12 | H6 | 56.5° | 54.9° |
| C15 | C14 | H24 | H25 | 118.8° | 119.9° |
| C18 | C19 | N20 | C21 | 66.0° | 63.1° |
| C18 | C19 | N20 | H13 | 120.1° | 120.0° |
| C18 | C19 | N20 | H14 | 120.1° | 120.0° |
| C19 | C18 | H11 | H12 | 119.5° | 120.4° |
| C18 | C19 | H13 | H14 | 119.6° | 120.1° |
| C7 | N8 | C10 | C12 | 73.1° | 180.0° |
| C7 | N8 | C10 | O11 | 106.1° | 0.0° |
| N8 | C7 | H5 | H10 | 122.4° | 120.9° |
| C7 | N8 | C9 | H23 | 116.6° | 119.7° |
| C7 | N8 | C9 | H9 | 121.4° | 119.4° |
| N8 | C10 | C12 | C14 | 131.9° | 80.0° |
| N8 | C10 | C12 | O11 | 179.2° | 180.0° |
| N8 | C10 | C12 | N13 | 107.4° | 160.0° |
| C10 | N8 | C7 | H5 | 56.8° | 60.4° |
| N8 | C10 | C12 | H6 | 11.9° | 40.0° |
| C10 | N8 | C9 | H23 | 65.3° | 60.6° |
| C10 | N8 | C9 | H9 | 56.7° | 60.3° |
| C10 | N8 | C7 | H10 | 64.9° | 60.5° |
| C14 | C12 | C10 | N13 | 120.7° | 120.0° |
| C14 | C12 | C10 | H6 | 120.1° | 120.0° |
| C14 | C12 | N13 | H6 | 117.8° | 120.0° |
| C14 | C12 | C10 | O11 | 48.8° | 100.0° |
| C14 | C12 | N13 | H7 | 180.0° | 60.0° |
| C14 | C12 | N13 | H8 | 60.0° | 63.9° |
| C12 | C14 | H24 | H25 | 118.8° | 120.1° |
| C10 | C12 | N13 | H6 | 118.9° | 120.0° |
| C10 | C12 | N13 | H7 | 56.7° | 60.0° |
| C10 | C12 | N13 | H8 | 63.3° | 176.1° |
| C10 | C12 | C14 | H24 | 56.3° | 65.1° |
| C10 | C12 | C14 | H25 | 62.9° | 55.0° |
| N13 | C12 | C10 | O11 | 71.8° | 20.0° |
| C12 | N13 | H7 | H8 | 120.0° | 123.9° |
| N13 | C12 | C14 | H24 | 177.8° | 55.0° |
| N13 | C12 | C14 | H25 | 58.6° | 175.1° |
| C21 | N20 | C19 | H13 | 173.9° | 56.9° |
| C21 | N20 | C19 | H14 | 54.1° | 176.9° |
| N20 | C21 | H15 | H16 | 120.3° | 120.0° |
| C21 | N20 | C23 | H17 | 80.7° | 60.0° |
| N20 | C21 | C22 | H29 | 179.7° | 173.6° |
| N20 | C21 | C22 | H30 | 60.0° | 65.8° |
| N20 | C19 | C18 | H11 | 68.4° | 65.9° |
| N20 | C19 | C18 | H12 | 172.0° | 173.8° |
| N20 | C19 | H13 | H14 | 119.6° | 120.0° |
| C19 | N20 | C21 | H15 | 49.7° | 56.9° |
| C19 | N20 | C21 | H16 | 169.9° | 176.9° |
| C19 | N20 | C23 | H17 | 35.3° | 64.3° |
| O11 | C10 | C12 | H6 | 168.9° | 139.9° |
| H1 | C1 | C2 | H2 | 0.2° | 0.4° |
| H2 | C2 | C3 | H3 | 0.1° | 0.0° |
| H3 | C3 | C4 | H4 | 0.3° | 0.0° |
| H6 | C12 | N13 | H7 | 62.2° | 180.0° |
| H6 | C12 | N13 | H8 | 177.8° | 56.1° |
| H6 | C12 | C14 | H24 | 63.9° | 174.9° |
| H6 | C12 | C14 | H25 | 176.9° | 65.0° |
| H11 | C18 | C19 | H13 | 51.7° | 174.2° |
| H11 | C18 | C19 | H14 | 171.5° | 54.1° |
| H12 | C18 | C19 | H13 | 67.9° | 53.9° |
| H12 | C18 | C19 | H14 | 51.9° | 66.2° |
| H15 | C21 | C22 | H29 | 59.8° | 53.5° |
| H15 | C21 | C22 | H30 | 179.9° | 174.2° |
| H16 | C21 | C22 | H29 | 60.4° | 66.5° |
| H16 | C21 | C22 | H30 | 59.9° | 54.2° |
| H18 | C30 | C29 | H33 | 0.0° | 0.2° |
| H19 | C32 | C33 | H20 | 0.1° | 0.0° |
| H21 | C36 | C37 | H22 | 0.1° | 0.1° |
| H31 | C25 | C26 | H32 | 0.0° | 0.2° |
