A1BLI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N2 | sing | 1.47Å | 1.45Å | |
| N2 | N3 | sing | 1.40Å | 1.39Å | Aromatic |
| N2 | C6 | sing | 1.35Å | 1.34Å | Aromatic |
| N3 | C4 | doub | 1.31Å | 1.30Å | Aromatic |
| C4 | C5 | sing | 1.40Å | 1.39Å | Aromatic |
| C5 | C6 | doub | 1.35Å | 1.35Å | Aromatic |
| C6 | C7 | sing | 1.51Å | 1.51Å | |
| C7 | C8 | sing | 1.51Å | 1.51Å | |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.51Å | 1.50Å | |
| C11 | C16 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | N13 | sing | 1.47Å | 1.46Å | |
| N13 | C14 | sing | 1.47Å | 1.48Å | |
| N13 | C18 | sing | 1.47Å | 1.47Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.51Å | 1.51Å | |
| C16 | C17 | doub | 1.39Å | 1.38Å | Aromatic |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C18 | C23 | sing | 1.53Å | 1.55Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| C20 | N21 | sing | 1.47Å | 1.47Å | |
| N21 | C22 | sing | 1.47Å | 1.47Å | |
| N21 | C25 | sing | 1.35Å | 1.36Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C23 | O24 | sing | 1.43Å | 1.43Å | |
| C25 | O26 | doub | 1.21Å | 1.21Å | |
| C25 | C27 | sing | 1.48Å | 1.48Å | |
| C27 | C28 | doub | 1.40Å | 1.40Å | Aromatic |
| C27 | C37 | sing | 1.40Å | 1.40Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | N30 | doub | 1.32Å | 1.32Å | Aromatic |
| N30 | C31 | sing | 1.32Å | 1.32Å | Aromatic |
| C31 | N32 | sing | 1.39Å | 1.39Å | |
| C31 | C37 | doub | 1.39Å | 1.39Å | Aromatic |
| N32 | C33 | sing | 1.47Å | 1.47Å | |
| C33 | C34 | sing | 1.54Å | 1.54Å | |
| C33 | C36 | sing | 1.54Å | 1.54Å | |
| C34 | C35 | sing | 1.54Å | 1.54Å | |
| C35 | C36 | sing | 1.54Å | 1.54Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.08Å | 1.08Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H26 | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.08Å | 1.08Å | |
| C33 | H29 | sing | 1.09Å | 1.10Å | |
| C34 | H30 | sing | 1.09Å | 1.10Å | |
| C34 | H31 | sing | 1.09Å | 1.10Å | |
| C35 | H32 | sing | 1.09Å | 1.10Å | |
| C35 | H33 | sing | 1.09Å | 1.10Å | |
| C36 | H35 | sing | 1.09Å | 1.10Å | |
| C36 | H34 | sing | 1.09Å | 1.10Å | |
| C37 | H36 | sing | 1.08Å | 1.08Å | |
| C9 | H8 | sing | 1.08Å | 1.08Å | |
| N32 | H28 | sing | 0.97Å | 1.00Å | |
| O24 | H25 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N2 | N3 | 123.7° | 126.0° |
| C1 | N2 | C6 | 127.0° | 126.0° |
| N2 | C1 | H1 | 109.5° | 109.5° |
| N2 | C1 | H2 | 109.5° | 109.4° |
| N2 | C1 | H3 | 109.4° | 109.5° |
| N3 | N2 | C6 | 109.2° | 107.9° |
| N2 | N3 | C4 | 107.1° | 108.2° |
| N2 | C6 | C5 | 106.6° | 107.8° |
| N2 | C6 | C7 | 125.8° | 126.1° |
| N3 | C4 | C5 | 108.9° | 108.2° |
| N3 | C4 | H4 | 125.5° | 125.9° |
| C4 | C5 | C6 | 108.2° | 107.9° |
| C5 | C4 | H4 | 125.6° | 125.9° |
| C4 | C5 | H5 | 125.9° | 126.1° |
| C5 | C6 | C7 | 127.4° | 126.1° |
| C6 | C5 | H5 | 125.9° | 126.1° |
| C6 | C7 | C8 | 120.3° | 109.5° |
| C6 | C7 | H7 | 106.7° | 109.5° |
| C6 | C7 | H6 | 106.7° | 109.5° |
| C7 | C8 | C9 | 126.5° | 120.1° |
| C7 | C8 | C17 | 114.5° | 120.1° |
| C8 | C7 | H7 | 106.7° | 109.5° |
| C8 | C7 | H6 | 106.7° | 109.5° |
| C9 | C8 | C17 | 119.0° | 119.8° |
| C8 | C9 | C10 | 119.9° | 119.8° |
| C8 | C9 | H8 | 120.1° | 120.1° |
| C8 | C17 | C16 | 121.5° | 120.4° |
| C8 | C17 | H16 | 119.3° | 119.8° |
| C9 | C10 | C11 | 120.4° | 120.4° |
| C9 | C10 | H9 | 119.8° | 119.8° |
| C10 | C9 | H8 | 120.0° | 120.1° |
| C10 | C11 | C12 | 119.5° | 118.4° |
| C10 | C11 | C16 | 119.6° | 119.7° |
| C11 | C10 | H9 | 119.8° | 119.8° |
| C12 | C11 | C16 | 120.9° | 121.9° |
| C11 | C12 | N13 | 107.2° | 110.4° |
| C11 | C12 | H10 | 110.0° | 109.3° |
| C11 | C12 | H11 | 110.1° | 109.3° |
| C11 | C16 | C15 | 123.3° | 121.6° |
| C11 | C16 | C17 | 119.6° | 119.9° |
| C12 | N13 | C14 | 113.0° | 110.5° |
| C12 | N13 | C18 | 114.6° | 111.0° |
| N13 | C12 | H10 | 110.0° | 109.3° |
| N13 | C12 | H11 | 110.1° | 109.3° |
| C14 | N13 | C18 | 116.7° | 111.0° |
| N13 | C14 | C15 | 111.5° | 108.8° |
| N13 | C14 | H12 | 109.0° | 109.3° |
| N13 | C14 | H13 | 108.9° | 109.9° |
| N13 | C18 | C19 | 103.7° | 109.4° |
| N13 | C18 | C23 | 113.6° | 109.4° |
| N13 | C18 | H17 | 109.6° | 109.4° |
| C14 | C15 | C16 | 112.4° | 109.9° |
| C14 | C15 | H14 | 108.7° | 109.4° |
| C14 | C15 | H15 | 108.7° | 109.3° |
| C15 | C14 | H12 | 109.0° | 109.7° |
| C15 | C14 | H13 | 109.0° | 109.6° |
| C15 | C16 | C17 | 117.1° | 118.5° |
| C16 | C15 | H14 | 108.7° | 109.4° |
| C16 | C15 | H15 | 108.7° | 109.4° |
| C16 | C17 | H16 | 119.2° | 119.8° |
| C19 | C18 | C23 | 112.3° | 109.5° |
| C18 | C19 | C20 | 111.2° | 109.3° |
| C19 | C18 | H17 | 108.9° | 109.5° |
| C18 | C19 | H18 | 109.0° | 109.5° |
| C18 | C19 | H19 | 109.0° | 109.6° |
| C18 | C23 | C22 | 109.9° | 109.3° |
| C18 | C23 | O24 | 110.5° | 109.5° |
| C23 | C18 | H17 | 108.7° | 109.5° |
| C18 | C23 | H24 | 108.4° | 109.5° |
| C19 | C20 | N21 | 106.0° | 108.8° |
| C19 | C20 | H20 | 110.3° | 109.6° |
| C19 | C20 | H21 | 110.4° | 109.7° |
| C20 | C19 | H18 | 109.0° | 109.5° |
| C20 | C19 | H19 | 109.0° | 109.5° |
| C20 | N21 | C22 | 113.9° | 118.7° |
| C20 | N21 | C25 | 123.2° | 120.7° |
| N21 | C20 | H20 | 110.4° | 109.5° |
| N21 | C20 | H21 | 110.3° | 109.6° |
| C22 | N21 | C25 | 122.8° | 120.6° |
| N21 | C22 | C23 | 103.7° | 108.8° |
| N21 | C22 | H22 | 110.9° | 109.5° |
| N21 | C22 | H23 | 110.9° | 109.7° |
| N21 | C25 | O26 | 121.2° | 120.0° |
| N21 | C25 | C27 | 119.7° | 120.0° |
| C22 | C23 | O24 | 109.5° | 109.5° |
| C23 | C22 | H22 | 110.9° | 109.6° |
| C23 | C22 | H23 | 110.9° | 109.6° |
| C22 | C23 | H24 | 108.6° | 109.5° |
| O24 | C23 | H24 | 110.0° | 109.5° |
| C23 | O24 | H25 | 109.5° | 114.1° |
| O26 | C25 | C27 | 119.1° | 120.0° |
| C25 | C27 | C28 | 119.6° | 120.9° |
| C25 | C27 | C37 | 121.5° | 120.9° |
| C28 | C27 | C37 | 118.9° | 118.3° |
| C27 | C28 | C29 | 118.9° | 119.2° |
| C27 | C28 | H26 | 120.6° | 120.5° |
| C27 | C37 | C31 | 118.5° | 118.9° |
| C27 | C37 | H36 | 120.7° | 120.5° |
| C28 | C29 | N30 | 120.7° | 121.0° |
| C29 | C28 | H26 | 120.5° | 120.4° |
| C28 | C29 | H27 | 119.7° | 119.5° |
| C29 | N30 | C31 | 123.0° | 122.0° |
| N30 | C29 | H27 | 119.6° | 119.5° |
| N30 | C31 | N32 | 118.6° | 119.6° |
| N30 | C31 | C37 | 120.1° | 120.7° |
| N32 | C31 | C37 | 121.3° | 119.7° |
| C31 | N32 | C33 | 118.9° | 120.0° |
| C31 | N32 | H28 | 107.1° | 120.1° |
| C31 | C37 | H36 | 120.8° | 120.5° |
| N32 | C33 | C34 | 115.5° | 113.6° |
| N32 | C33 | C36 | 113.9° | 113.6° |
| N32 | C33 | H29 | 113.7° | 112.9° |
| C33 | N32 | H28 | 107.1° | 119.9° |
| C34 | C33 | C36 | 85.5° | 87.1° |
| C33 | C34 | C35 | 85.4° | 87.0° |
| C34 | C33 | H29 | 112.6° | 113.6° |
| C33 | C34 | H30 | 115.1° | 113.6° |
| C33 | C34 | H31 | 115.1° | 113.6° |
| C33 | C36 | C35 | 85.4° | 87.0° |
| C36 | C33 | H29 | 112.6° | 113.7° |
| C33 | C36 | H35 | 115.1° | 113.6° |
| C33 | C36 | H34 | 115.1° | 113.6° |
| C34 | C35 | C36 | 85.4° | 87.1° |
| C35 | C34 | H30 | 115.1° | 113.6° |
| C35 | C34 | H31 | 115.1° | 113.7° |
| C34 | C35 | H32 | 115.1° | 113.6° |
| C34 | C35 | H33 | 115.1° | 113.6° |
| C36 | C35 | H32 | 115.1° | 113.6° |
| C36 | C35 | H33 | 115.1° | 113.5° |
| C35 | C36 | H35 | 115.1° | 113.7° |
| C35 | C36 | H34 | 115.1° | 113.6° |
| H7 | C7 | H6 | 109.5° | 109.4° |
| H14 | C15 | H15 | 109.5° | 109.4° |
| H20 | C20 | H21 | 109.5° | 109.6° |
| H22 | C22 | H23 | 109.5° | 109.7° |
| H1 | C1 | H2 | 109.4° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.4° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H10 | C12 | H11 | 109.5° | 109.2° |
| H12 | C14 | H13 | 109.5° | 109.6° |
| H18 | C19 | H19 | 109.5° | 109.5° |
| H30 | C34 | H31 | 109.5° | 112.9° |
| H32 | C35 | H33 | 109.5° | 112.9° |
| H35 | C36 | H34 | 109.5° | 112.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N2 | N3 | C6 | 178.3° | 179.9° |
| C1 | N2 | N3 | C4 | 179.7° | 180.0° |
| C1 | N2 | C6 | C5 | 179.6° | 180.0° |
| C1 | N2 | C6 | C7 | 3.2° | 0.0° |
| N2 | C1 | H1 | H2 | 120.0° | 120.0° |
| N2 | C1 | H1 | H3 | 120.0° | 120.0° |
| N2 | C1 | H2 | H3 | 120.0° | 120.0° |
| N2 | N3 | C4 | C5 | 0.1° | 0.0° |
| N3 | N2 | C6 | C5 | 2.1° | 0.1° |
| N3 | N2 | C6 | C7 | 178.6° | 180.0° |
| N2 | N3 | C4 | H4 | 179.8° | 180.0° |
| N3 | N2 | C1 | H1 | 0.0° | 90.0° |
| N3 | N2 | C1 | H2 | 120.0° | 150.0° |
| N3 | N2 | C1 | H3 | 120.0° | 29.9° |
| C6 | N2 | N3 | C4 | 1.4° | 0.0° |
| N2 | C6 | C5 | C4 | 2.0° | 0.1° |
| N2 | C6 | C5 | C7 | 176.4° | 180.0° |
| N2 | C6 | C7 | C8 | 111.1° | 95.0° |
| N2 | C6 | C5 | H5 | 178.0° | 180.0° |
| N2 | C6 | C7 | H7 | 127.4° | 25.0° |
| N2 | C6 | C7 | H6 | 10.4° | 144.9° |
| C6 | N2 | C1 | H1 | 178.0° | 90.0° |
| C6 | N2 | C1 | H2 | 58.0° | 30.0° |
| C6 | N2 | C1 | H3 | 62.0° | 150.0° |
| N3 | C4 | C5 | H4 | 180.0° | 179.9° |
| N3 | C4 | C5 | C6 | 1.2° | 0.1° |
| N3 | C4 | C5 | H5 | 178.8° | 180.0° |
| C4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 178.4° | 179.9° |
| C5 | C6 | C7 | C8 | 73.2° | 85.0° |
| C6 | C5 | C4 | H4 | 178.8° | 180.0° |
| C5 | C6 | C7 | H7 | 48.3° | 154.9° |
| C5 | C6 | C7 | H6 | 165.3° | 35.0° |
| C6 | C7 | C8 | H7 | 121.5° | 120.0° |
| C6 | C7 | C8 | H6 | 121.5° | 120.0° |
| C6 | C7 | C8 | C9 | 0.0° | 90.0° |
| C6 | C7 | C8 | C17 | 178.9° | 89.7° |
| C7 | C6 | C5 | H5 | 1.6° | 0.0° |
| C6 | C7 | H7 | H6 | 115.1° | 120.0° |
| C7 | C8 | C9 | C17 | 178.9° | 179.8° |
| C7 | C8 | C9 | C10 | 178.7° | 179.9° |
| C7 | C8 | C17 | C16 | 179.5° | 180.0° |
| C8 | C7 | H7 | H6 | 115.1° | 120.0° |
| C7 | C8 | C17 | H16 | 0.5° | 0.0° |
| C7 | C8 | C9 | H8 | 1.3° | 0.2° |
| C8 | C9 | C10 | H8 | 180.0° | 179.9° |
| C8 | C9 | C10 | C11 | 0.4° | 0.0° |
| C9 | C8 | C17 | C16 | 0.5° | 0.2° |
| C9 | C8 | C7 | H7 | 121.5° | 30.0° |
| C9 | C8 | C7 | H6 | 121.5° | 149.9° |
| C8 | C9 | C10 | H9 | 179.6° | 179.7° |
| C9 | C8 | C17 | H16 | 179.5° | 179.8° |
| C17 | C8 | C9 | C10 | 0.2° | 0.3° |
| C8 | C17 | C16 | C11 | 0.8° | 0.1° |
| C8 | C17 | C16 | C15 | 178.9° | 179.8° |
| C8 | C17 | C16 | H16 | 180.0° | 180.0° |
| C17 | C8 | C7 | H7 | 57.4° | 150.2° |
| C17 | C8 | C7 | H6 | 59.6° | 30.3° |
| C17 | C8 | C9 | H8 | 179.9° | 179.6° |
| C9 | C10 | C11 | H9 | 180.0° | 179.7° |
| C9 | C10 | C11 | C12 | 179.8° | 179.5° |
| C9 | C10 | C11 | C16 | 0.1° | 0.3° |
| C10 | C11 | C12 | C16 | 179.9° | 179.9° |
| C10 | C11 | C12 | N13 | 149.9° | 162.6° |
| C10 | C11 | C16 | C15 | 179.2° | 179.5° |
| C10 | C11 | C16 | C17 | 0.6° | 0.4° |
| C10 | C11 | C12 | H10 | 30.2° | 42.4° |
| C10 | C11 | C12 | H11 | 90.5° | 77.1° |
| C11 | C10 | C9 | H8 | 179.6° | 179.9° |
| C11 | C12 | N13 | H10 | 119.6° | 120.3° |
| C11 | C12 | N13 | H11 | 119.7° | 120.2° |
| C11 | C12 | N13 | C14 | 61.1° | 52.3° |
| C11 | C12 | N13 | C18 | 162.0° | 175.9° |
| C12 | C11 | C16 | C15 | 0.7° | 0.7° |
| C12 | C11 | C16 | C17 | 179.6° | 179.4° |
| C12 | C11 | C10 | H9 | 0.2° | 0.2° |
| C11 | C12 | H10 | H11 | 121.1° | 119.5° |
| C16 | C11 | C12 | N13 | 30.0° | 17.5° |
| C11 | C16 | C15 | C14 | 0.3° | 16.9° |
| C11 | C16 | C15 | C17 | 179.7° | 179.9° |
| C16 | C11 | C10 | H9 | 179.9° | 180.0° |
| C11 | C16 | C15 | H14 | 120.7° | 103.3° |
| C11 | C16 | C15 | H15 | 120.1° | 136.9° |
| C11 | C16 | C17 | H16 | 179.2° | 179.8° |
| C16 | C11 | C12 | H10 | 149.7° | 137.8° |
| C16 | C11 | C12 | H11 | 89.6° | 102.8° |
| C12 | N13 | C14 | C18 | 135.9° | 123.6° |
| C12 | N13 | C14 | C15 | 62.5° | 71.0° |
| C12 | N13 | C18 | C19 | 131.3° | 58.9° |
| C12 | N13 | C18 | C23 | 106.6° | 61.1° |
| N13 | C12 | H10 | H11 | 121.1° | 119.6° |
| C12 | N13 | C14 | H12 | 177.2° | 48.8° |
| C12 | N13 | C14 | H13 | 57.8° | 169.1° |
| C12 | N13 | C18 | H17 | 15.2° | 178.9° |
| N13 | C14 | C15 | H12 | 120.3° | 119.5° |
| N13 | C14 | C15 | H13 | 120.3° | 120.1° |
| N13 | C14 | C15 | C16 | 28.5° | 50.2° |
| C14 | N13 | C18 | C19 | 93.5° | 64.5° |
| C14 | N13 | C18 | C23 | 28.7° | 175.5° |
| N13 | C14 | C15 | H14 | 91.9° | 70.0° |
| N13 | C14 | C15 | H15 | 149.0° | 170.2° |
| C14 | N13 | C12 | H10 | 179.3° | 172.5° |
| C14 | N13 | C12 | H11 | 58.6° | 68.0° |
| N13 | C14 | H12 | H13 | 119.0° | 120.5° |
| C14 | N13 | C18 | H17 | 150.4° | 55.6° |
| C18 | N13 | C14 | C15 | 161.6° | 165.4° |
| N13 | C18 | C19 | C23 | 123.0° | 120.0° |
| N13 | C18 | C19 | H17 | 116.6° | 120.0° |
| N13 | C18 | C23 | H17 | 122.2° | 120.0° |
| N13 | C18 | C19 | C20 | 172.9° | 178.6° |
| N13 | C18 | C23 | C22 | 170.7° | 178.6° |
| N13 | C18 | C23 | O24 | 68.4° | 58.7° |
| C18 | N13 | C12 | H10 | 42.4° | 63.8° |
| C18 | N13 | C12 | H11 | 78.3° | 55.7° |
| C18 | N13 | C14 | H12 | 41.3° | 74.9° |
| C18 | N13 | C14 | H13 | 78.1° | 45.4° |
| N13 | C18 | C19 | H18 | 52.7° | 58.7° |
| N13 | C18 | C19 | H19 | 66.8° | 61.4° |
| N13 | C18 | C23 | H24 | 52.2° | 61.4° |
| C14 | C15 | C16 | H14 | 120.4° | 120.2° |
| C14 | C15 | C16 | H15 | 120.4° | 120.0° |
| C14 | C15 | C16 | C17 | 179.4° | 163.2° |
| C14 | C15 | H14 | H15 | 118.7° | 119.7° |
| C15 | C14 | H12 | H13 | 119.1° | 120.4° |
| C16 | C15 | H14 | H15 | 118.7° | 119.8° |
| C15 | C16 | C17 | H16 | 1.1° | 0.3° |
| C16 | C15 | C14 | H12 | 148.8° | 69.3° |
| C16 | C15 | C14 | H13 | 91.8° | 170.3° |
| C17 | C16 | C15 | H14 | 59.0° | 76.6° |
| C17 | C16 | C15 | H15 | 60.1° | 43.2° |
| C19 | C18 | C23 | H17 | 120.5° | 120.1° |
| C18 | C19 | C20 | H18 | 120.3° | 120.0° |
| C18 | C19 | C20 | H19 | 120.3° | 120.0° |
| C18 | C19 | C20 | N21 | 53.6° | 54.7° |
| C19 | C18 | C23 | C22 | 53.4° | 61.4° |
| C19 | C18 | C23 | O24 | 174.3° | 178.6° |
| C18 | C19 | C20 | H20 | 173.0° | 174.4° |
| C18 | C19 | C20 | H21 | 65.9° | 65.2° |
| C18 | C19 | H18 | H19 | 119.2° | 120.2° |
| C19 | C18 | C23 | H24 | 65.1° | 58.6° |
| C23 | C18 | C19 | C20 | 49.9° | 61.4° |
| C18 | C23 | C22 | N21 | 59.7° | 54.6° |
| C18 | C23 | C22 | O24 | 121.6° | 119.9° |
| C18 | C23 | C22 | H24 | 118.4° | 120.0° |
| C18 | C23 | O24 | H24 | 119.6° | 120.1° |
| C18 | C23 | C22 | H22 | 178.8° | 65.1° |
| C18 | C23 | C22 | H23 | 59.3° | 174.5° |
| C23 | C18 | C19 | H18 | 70.3° | 178.7° |
| C23 | C18 | C19 | H19 | 170.2° | 58.5° |
| C18 | C23 | O24 | H25 | 180.0° | 179.9° |
| C19 | C20 | N21 | H20 | 119.5° | 119.7° |
| C19 | C20 | N21 | H21 | 119.5° | 119.9° |
| C19 | C20 | N21 | C22 | 68.0° | 53.6° |
| C19 | C20 | N21 | C25 | 109.1° | 126.4° |
| C19 | C20 | H20 | H21 | 121.6° | 120.5° |
| C20 | C19 | C18 | H17 | 70.5° | 58.7° |
| C20 | C19 | H18 | H19 | 119.2° | 120.0° |
| C20 | N21 | C22 | C25 | 177.1° | 180.0° |
| C20 | N21 | C22 | C23 | 71.0° | 53.6° |
| C20 | N21 | C25 | O26 | 179.1° | 3.7° |
| C20 | N21 | C25 | C27 | 2.0° | 176.3° |
| N21 | C20 | H20 | H21 | 121.6° | 120.3° |
| C20 | N21 | C22 | H22 | 169.9° | 66.1° |
| C20 | N21 | C22 | H23 | 48.0° | 173.5° |
| N21 | C20 | C19 | H18 | 66.7° | 174.6° |
| N21 | C20 | C19 | H19 | 173.8° | 65.3° |
| N21 | C22 | C23 | H22 | 119.1° | 119.7° |
| N21 | C22 | C23 | H23 | 119.1° | 119.9° |
| N21 | C22 | C23 | O24 | 178.7° | 174.6° |
| C22 | N21 | C25 | O26 | 2.3° | 176.3° |
| C22 | N21 | C25 | C27 | 178.8° | 3.7° |
| C22 | N21 | C20 | H20 | 172.6° | 173.3° |
| C22 | N21 | C20 | H21 | 51.5° | 66.3° |
| N21 | C22 | H22 | H23 | 122.7° | 120.4° |
| N21 | C22 | C23 | H24 | 58.6° | 65.4° |
| C25 | N21 | C22 | C23 | 106.0° | 126.4° |
| N21 | C25 | O26 | C27 | 178.9° | 180.0° |
| N21 | C25 | C27 | C28 | 68.3° | 49.7° |
| N21 | C25 | C27 | C37 | 110.5° | 130.3° |
| C25 | N21 | C20 | H20 | 10.4° | 6.6° |
| C25 | N21 | C20 | H21 | 131.5° | 113.7° |
| C25 | N21 | C22 | H22 | 13.1° | 113.9° |
| C25 | N21 | C22 | H23 | 134.9° | 6.5° |
| C22 | C23 | O24 | H24 | 119.2° | 120.1° |
| C23 | C22 | H22 | H23 | 122.7° | 120.4° |
| C22 | C23 | C18 | H17 | 67.1° | 58.7° |
| C22 | C23 | O24 | H25 | 58.8° | 60.0° |
| O24 | C23 | C22 | H22 | 59.6° | 54.9° |
| O24 | C23 | C22 | H23 | 62.2° | 65.5° |
| O24 | C23 | C18 | H17 | 53.8° | 61.3° |
| O26 | C25 | C27 | C28 | 110.5° | 130.3° |
| O26 | C25 | C27 | C37 | 70.6° | 49.7° |
| C25 | C27 | C28 | C37 | 178.9° | 180.0° |
| C25 | C27 | C28 | C29 | 179.1° | 180.0° |
| C25 | C27 | C37 | C31 | 179.3° | 180.0° |
| C25 | C27 | C28 | H26 | 0.9° | 0.3° |
| C25 | C27 | C37 | H36 | 0.7° | 0.1° |
| C27 | C28 | C29 | H26 | 180.0° | 179.7° |
| C27 | C28 | C29 | N30 | 0.1° | 0.3° |
| C28 | C27 | C37 | C31 | 0.4° | 0.0° |
| C27 | C28 | C29 | H27 | 179.9° | 179.7° |
| C28 | C27 | C37 | H36 | 179.6° | 179.9° |
| C37 | C27 | C28 | C29 | 0.2° | 0.0° |
| C27 | C37 | C31 | N30 | 0.4° | 0.2° |
| C27 | C37 | C31 | N32 | 179.6° | 180.0° |
| C27 | C37 | C31 | H36 | 180.0° | 179.9° |
| C37 | C27 | C28 | H26 | 179.8° | 179.7° |
| C28 | C29 | N30 | H27 | 180.0° | 180.0° |
| C28 | C29 | N30 | C31 | 0.0° | 0.5° |
| C29 | N30 | C31 | N32 | 179.8° | 179.7° |
| C29 | N30 | C31 | C37 | 0.2° | 0.5° |
| N30 | C29 | C28 | H26 | 179.9° | 180.0° |
| N30 | C31 | N32 | C37 | 180.0° | 179.8° |
| N30 | C31 | N32 | C33 | 6.3° | 179.7° |
| C31 | N30 | C29 | H27 | 180.0° | 179.5° |
| N30 | C31 | C37 | H36 | 179.6° | 179.7° |
| N30 | C31 | N32 | H28 | 115.1° | 0.3° |
| C31 | N32 | C33 | H28 | 121.3° | 180.0° |
| C31 | N32 | C33 | C34 | 152.3° | 155.0° |
| C31 | N32 | C33 | C36 | 111.0° | 107.5° |
| C31 | N32 | C33 | H29 | 19.9° | 23.8° |
| N32 | C31 | C37 | H36 | 0.4° | 0.1° |
| C37 | C31 | N32 | C33 | 173.7° | 0.1° |
| C37 | C31 | N32 | H28 | 64.9° | 179.9° |
| N32 | C33 | C34 | C36 | 114.4° | 114.5° |
| N32 | C33 | C34 | H29 | 133.0° | 130.9° |
| N32 | C33 | C36 | H29 | 131.4° | 130.9° |
| N32 | C33 | C34 | C35 | 145.9° | 140.0° |
| N32 | C33 | C36 | C35 | 147.4° | 140.0° |
| N32 | C33 | C34 | H30 | 98.5° | 105.5° |
| N32 | C33 | C34 | H31 | 30.3° | 25.4° |
| N32 | C33 | C36 | H35 | 31.8° | 25.4° |
| N32 | C33 | C36 | H34 | 96.9° | 105.5° |
| C34 | C33 | C36 | H29 | 112.7° | 114.5° |
| C33 | C34 | C35 | H30 | 115.6° | 114.5° |
| C33 | C34 | C35 | H31 | 115.6° | 114.5° |
| C34 | C33 | C36 | C35 | 31.5° | 25.5° |
| C33 | C34 | H30 | H31 | 131.5° | 131.2° |
| C33 | C34 | C35 | H32 | 84.2° | 89.1° |
| C33 | C34 | C35 | H33 | 147.1° | 140.0° |
| C34 | C33 | C36 | H35 | 84.1° | 89.1° |
| C34 | C33 | C36 | H34 | 147.1° | 140.0° |
| C34 | C33 | N32 | H28 | 31.0° | 25.0° |
| C33 | C36 | C35 | H35 | 115.6° | 114.6° |
| C33 | C36 | C35 | H34 | 115.7° | 114.5° |
| C36 | C33 | C34 | H30 | 147.1° | 140.0° |
| C36 | C33 | C34 | H31 | 84.1° | 89.1° |
| C33 | C36 | C35 | H32 | 84.2° | 89.1° |
| C33 | C36 | C35 | H33 | 147.1° | 140.0° |
| C33 | C36 | H35 | H34 | 131.5° | 131.2° |
| C36 | C33 | N32 | H28 | 127.7° | 72.5° |
| C34 | C35 | C36 | H32 | 115.6° | 114.6° |
| C34 | C35 | C36 | H33 | 115.6° | 114.5° |
| C35 | C34 | C33 | H29 | 81.2° | 89.1° |
| C35 | C34 | H30 | H31 | 131.5° | 131.3° |
| C34 | C35 | H32 | H33 | 131.5° | 131.2° |
| C34 | C35 | C36 | H35 | 84.2° | 89.1° |
| C34 | C35 | C36 | H34 | 147.1° | 140.0° |
| C35 | C36 | C33 | H29 | 81.2° | 89.1° |
| C36 | C35 | C34 | H30 | 147.1° | 140.0° |
| C36 | C35 | C34 | H31 | 84.2° | 89.0° |
| C36 | C35 | H32 | H33 | 131.5° | 131.2° |
| C35 | C36 | H35 | H34 | 131.5° | 131.3° |
| H4 | C4 | C5 | H5 | 1.2° | 0.1° |
| H9 | C10 | C9 | H8 | 0.4° | 0.4° |
| H14 | C15 | C14 | H12 | 28.4° | 170.5° |
| H14 | C15 | C14 | H13 | 147.8° | 50.1° |
| H15 | C15 | C14 | H12 | 90.7° | 50.7° |
| H15 | C15 | C14 | H13 | 28.7° | 69.7° |
| H20 | C20 | C19 | H18 | 52.8° | 65.6° |
| H20 | C20 | C19 | H19 | 66.7° | 54.4° |
| H21 | C20 | C19 | H18 | 173.8° | 54.8° |
| H21 | C20 | C19 | H19 | 54.4° | 174.8° |
| H22 | C22 | C23 | H24 | 60.4° | 174.9° |
| H23 | C22 | C23 | H24 | 177.7° | 54.6° |
| H26 | C28 | C29 | H27 | 0.1° | 0.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H17 | C18 | C19 | H18 | 169.3° | 61.3° |
| H17 | C18 | C19 | H19 | 49.8° | 178.6° |
| H17 | C18 | C23 | H24 | 174.4° | 178.7° |
| H24 | C23 | O24 | H25 | 60.4° | 60.1° |
| H29 | C33 | C34 | H30 | 34.5° | 25.4° |
| H29 | C33 | C34 | H31 | 163.2° | 156.3° |
| H29 | C33 | C36 | H35 | 163.2° | 156.3° |
| H29 | C33 | C36 | H34 | 34.5° | 25.5° |
| H29 | C33 | N32 | H28 | 101.4° | 156.2° |
| H30 | C34 | C35 | H32 | 31.4° | 25.4° |
| H30 | C34 | C35 | H33 | 97.3° | 105.5° |
| H31 | C34 | C35 | H32 | 160.2° | 156.4° |
| H31 | C34 | C35 | H33 | 31.5° | 25.4° |
| H32 | C35 | C36 | H35 | 160.2° | 156.3° |
| H32 | C35 | C36 | H34 | 31.5° | 25.4° |
| H33 | C35 | C36 | H35 | 31.5° | 25.4° |
| H33 | C35 | C36 | H34 | 97.3° | 105.5° |
