NTX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C25 | sing | 1.53Å | 1.52Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| N4 | C25 | sing | 1.47Å | 1.45Å | |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| O1 | C7 | doub | 1.22Å | 1.21Å | |
| C23 | C8 | sing | 1.53Å | 1.55Å | |
| C8 | C27 | sing | 1.53Å | 1.55Å | |
| C8 | N1 | sing | 1.46Å | 1.49Å | |
| C13 | C12 | doub | 1.38Å | 1.41Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C7 | N1 | sing | 1.35Å | 1.34Å | |
| C7 | C6 | sing | 1.48Å | 1.50Å | |
| C12 | C17 | sing | 1.38Å | 1.41Å | Aromatic |
| C14 | C15 | doub | 1.39Å | 1.42Å | Aromatic |
| C1 | C6 | doub | 1.39Å | 1.42Å | Aromatic |
| C1 | C2 | sing | 1.39Å | 1.41Å | Aromatic |
| C6 | C5 | sing | 1.40Å | 1.40Å | Aromatic |
| O3 | C2 | sing | 1.36Å | 1.41Å | |
| O3 | C11 | sing | 1.43Å | 1.45Å | |
| C2 | C3 | doub | 1.39Å | 1.42Å | Aromatic |
| C17 | C11 | sing | 1.51Å | 1.54Å | |
| C17 | C16 | doub | 1.38Å | 1.41Å | Aromatic |
| C5 | C4 | doub | 1.38Å | 1.41Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.41Å | Aromatic |
| C15 | C29 | sing | 1.48Å | 1.52Å | |
| N6 | C29 | doub | 1.30Å | 1.34Å | |
| C3 | C4 | sing | 1.39Å | 1.42Å | Aromatic |
| C4 | O2 | sing | 1.36Å | 1.38Å | |
| C29 | N5 | sing | 1.38Å | 1.34Å | |
| O2 | C9 | sing | 1.43Å | 1.45Å | |
| C9 | C18 | sing | 1.51Å | 1.51Å | |
| C10 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C10 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.42Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | C20 | doub | 1.39Å | 1.40Å | Aromatic |
| C21 | C20 | sing | 1.40Å | 1.40Å | Aromatic |
| C20 | C28 | sing | 1.48Å | 1.50Å | |
| C28 | N2 | doub | 1.30Å | 1.32Å | |
| C28 | N3 | sing | 1.38Å | 1.34Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N3 | H2 | sing | 0.97Å | 1.00Å | |
| N3 | H3 | sing | 0.97Å | 1.00Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.08Å | 1.08Å | |
| C13 | H7 | sing | 1.08Å | 1.08Å | |
| C21 | H8 | sing | 1.08Å | 1.08Å | |
| C22 | H9 | sing | 1.08Å | 1.08Å | |
| C24 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.09Å | 1.10Å | |
| C26 | H13 | sing | 1.09Å | 1.10Å | |
| C23 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C25 | H16 | sing | 1.09Å | 1.10Å | |
| N4 | H17 | sing | 1.01Å | 1.00Å | |
| N4 | H18 | sing | 1.01Å | 1.00Å | |
| C27 | H20 | sing | 1.09Å | 1.10Å | |
| C27 | H21 | sing | 1.09Å | 1.10Å | |
| C9 | H22 | sing | 1.09Å | 1.10Å | |
| C9 | H23 | sing | 1.09Å | 1.10Å | |
| N2 | H24 | sing | 0.97Å | 1.00Å | |
| C19 | H25 | sing | 1.08Å | 1.08Å | |
| C3 | H26 | sing | 1.08Å | 1.08Å | |
| C1 | H27 | sing | 1.08Å | 1.08Å | |
| C11 | H28 | sing | 1.09Å | 1.10Å | |
| C11 | H29 | sing | 1.09Å | 1.10Å | |
| C16 | H30 | sing | 1.08Å | 1.08Å | |
| N5 | H31 | sing | 0.97Å | 1.00Å | |
| N5 | H32 | sing | 0.97Å | 1.00Å | |
| N6 | H33 | sing | 0.97Å | 1.00Å | |
| C14 | H34 | sing | 1.08Å | 1.08Å | |
| C12 | H35 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C24 | C23 | 107.9° | 109.5° |
| C24 | C25 | N4 | 111.9° | 109.5° |
| C24 | C25 | C26 | 106.9° | 109.5° |
| C25 | C24 | H10 | 109.8° | 109.5° |
| C25 | C24 | H11 | 109.9° | 109.5° |
| C24 | C25 | H16 | 107.9° | 109.5° |
| C24 | C23 | C8 | 113.0° | 109.5° |
| C23 | C24 | H10 | 109.9° | 109.5° |
| C23 | C24 | H11 | 109.9° | 109.5° |
| C24 | C23 | H14 | 108.6° | 109.5° |
| C24 | C23 | H15 | 108.6° | 109.4° |
| N4 | C25 | C26 | 113.3° | 109.4° |
| N4 | C25 | H16 | 108.8° | 109.5° |
| C25 | N4 | H17 | 109.5° | 111.0° |
| C25 | N4 | H18 | 109.5° | 111.0° |
| C25 | C26 | C27 | 106.5° | 109.4° |
| C25 | C26 | H12 | 110.2° | 109.5° |
| C25 | C26 | H13 | 110.2° | 109.5° |
| C26 | C25 | H16 | 107.8° | 109.5° |
| C26 | C27 | C8 | 113.4° | 109.5° |
| C27 | C26 | H12 | 110.2° | 109.5° |
| C27 | C26 | H13 | 110.2° | 109.4° |
| C26 | C27 | H20 | 108.5° | 109.5° |
| C26 | C27 | H21 | 108.5° | 109.5° |
| O1 | C7 | N1 | 120.4° | 120.0° |
| O1 | C7 | C6 | 115.1° | 120.1° |
| C23 | C8 | C27 | 113.0° | 109.5° |
| C23 | C8 | N1 | 107.5° | 109.5° |
| C23 | C8 | H5 | 108.6° | 109.4° |
| C8 | C23 | H14 | 108.6° | 109.5° |
| C8 | C23 | H15 | 108.6° | 109.5° |
| C27 | C8 | N1 | 109.7° | 109.5° |
| C27 | C8 | H5 | 108.6° | 109.5° |
| C8 | C27 | H20 | 108.5° | 109.5° |
| C8 | C27 | H21 | 108.5° | 109.4° |
| C8 | N1 | C7 | 118.5° | 120.0° |
| C8 | N1 | H1 | 120.7° | 120.0° |
| N1 | C8 | H5 | 109.4° | 109.5° |
| C12 | C13 | C14 | 119.1° | 120.1° |
| C13 | C12 | C17 | 121.4° | 120.3° |
| C12 | C13 | H7 | 120.4° | 119.9° |
| C13 | C12 | H35 | 119.3° | 119.9° |
| C13 | C14 | C15 | 120.5° | 119.9° |
| C14 | C13 | H7 | 120.4° | 120.0° |
| C13 | C14 | H34 | 119.8° | 120.1° |
| N1 | C7 | C6 | 124.5° | 120.0° |
| C7 | N1 | H1 | 120.8° | 120.0° |
| C7 | C6 | C1 | 118.8° | 120.1° |
| C7 | C6 | C5 | 120.3° | 120.1° |
| C12 | C17 | C11 | 121.1° | 119.9° |
| C12 | C17 | C16 | 119.0° | 120.2° |
| C17 | C12 | H35 | 119.3° | 119.9° |
| C14 | C15 | C16 | 119.8° | 119.7° |
| C14 | C15 | C29 | 118.5° | 120.1° |
| C15 | C14 | H34 | 119.8° | 120.1° |
| C6 | C1 | C2 | 121.8° | 120.0° |
| C1 | C6 | C5 | 120.9° | 119.8° |
| C6 | C1 | H27 | 119.1° | 120.0° |
| C1 | C2 | O3 | 120.5° | 120.0° |
| C1 | C2 | C3 | 116.2° | 120.1° |
| C2 | C1 | H27 | 119.1° | 120.0° |
| C6 | C5 | C4 | 118.6° | 119.9° |
| C6 | C5 | H4 | 120.7° | 120.0° |
| C2 | O3 | C11 | 124.2° | 117.0° |
| O3 | C2 | C3 | 123.3° | 120.0° |
| O3 | C11 | C17 | 117.1° | 109.5° |
| O3 | C11 | H28 | 107.5° | 109.5° |
| O3 | C11 | H29 | 107.5° | 109.5° |
| C2 | C3 | C4 | 122.5° | 120.2° |
| C2 | C3 | H26 | 118.7° | 119.9° |
| C11 | C17 | C16 | 119.9° | 119.9° |
| C17 | C11 | H28 | 107.5° | 109.5° |
| C17 | C11 | H29 | 107.5° | 109.5° |
| C17 | C16 | C15 | 120.2° | 119.9° |
| C17 | C16 | H30 | 119.9° | 120.1° |
| C5 | C4 | C3 | 119.9° | 120.1° |
| C5 | C4 | O2 | 122.0° | 119.9° |
| C4 | C5 | H4 | 120.7° | 120.1° |
| C16 | C15 | C29 | 121.7° | 120.2° |
| C15 | C16 | H30 | 119.9° | 120.1° |
| C15 | C29 | N6 | 119.1° | 119.9° |
| C15 | C29 | N5 | 124.0° | 120.0° |
| N6 | C29 | N5 | 116.9° | 120.0° |
| C29 | N6 | H33 | 112.0° | 120.0° |
| C3 | C4 | O2 | 118.1° | 120.0° |
| C4 | C3 | H26 | 118.7° | 119.9° |
| C4 | O2 | C9 | 129.3° | 117.0° |
| C29 | N5 | H31 | 120.0° | 120.0° |
| C29 | N5 | H32 | 120.0° | 120.0° |
| O2 | C9 | C18 | 99.9° | 109.4° |
| O2 | C9 | H22 | 111.8° | 109.4° |
| O2 | C9 | H23 | 111.8° | 109.5° |
| C9 | C18 | C10 | 118.5° | 119.9° |
| C9 | C18 | C19 | 120.9° | 120.0° |
| C18 | C9 | H22 | 111.8° | 109.5° |
| C18 | C9 | H23 | 111.8° | 109.5° |
| C18 | C10 | C22 | 119.5° | 120.3° |
| C10 | C18 | C19 | 120.6° | 120.1° |
| C18 | C10 | H6 | 120.2° | 119.9° |
| C10 | C22 | C21 | 120.2° | 120.1° |
| C22 | C10 | H6 | 120.2° | 119.9° |
| C10 | C22 | H9 | 119.9° | 119.9° |
| C18 | C19 | C20 | 119.1° | 119.9° |
| C18 | C19 | H25 | 120.5° | 120.1° |
| C22 | C21 | C20 | 120.7° | 119.9° |
| C22 | C21 | H8 | 119.6° | 120.1° |
| C21 | C22 | H9 | 119.9° | 119.9° |
| C19 | C20 | C21 | 119.9° | 119.7° |
| C19 | C20 | C28 | 124.8° | 120.2° |
| C20 | C19 | H25 | 120.5° | 120.0° |
| C21 | C20 | C28 | 115.3° | 120.1° |
| C20 | C21 | H8 | 119.6° | 120.1° |
| C20 | C28 | N2 | 115.2° | 120.0° |
| C20 | C28 | N3 | 126.2° | 120.0° |
| N2 | C28 | N3 | 118.6° | 120.0° |
| C28 | N2 | H24 | 112.0° | 120.0° |
| C28 | N3 | H2 | 120.0° | 120.0° |
| C28 | N3 | H3 | 120.0° | 119.9° |
| H2 | N3 | H3 | 120.0° | 120.1° |
| H10 | C24 | H11 | 109.5° | 109.5° |
| H12 | C26 | H13 | 109.5° | 109.5° |
| H14 | C23 | H15 | 109.5° | 109.4° |
| H17 | N4 | H18 | 109.4° | 111.0° |
| H20 | C27 | H21 | 109.5° | 109.5° |
| H22 | C9 | H23 | 109.5° | 109.5° |
| H28 | C11 | H29 | 109.5° | 109.5° |
| H31 | N5 | H32 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C24 | C23 | H10 | 119.7° | 120.0° |
| C25 | C24 | C23 | H11 | 119.7° | 120.0° |
| C24 | C25 | N4 | C26 | 120.9° | 120.0° |
| C24 | C25 | N4 | H16 | 119.1° | 120.0° |
| C24 | C25 | C26 | H16 | 115.8° | 120.0° |
| C24 | C25 | C26 | C27 | 69.9° | 60.0° |
| C25 | C24 | C23 | C8 | 55.7° | 60.0° |
| C25 | C24 | H10 | H11 | 120.7° | 120.0° |
| C24 | C25 | C26 | H12 | 49.7° | 60.0° |
| C24 | C25 | C26 | H13 | 170.6° | 180.0° |
| C25 | C24 | C23 | H14 | 64.8° | 180.0° |
| C25 | C24 | C23 | H15 | 176.2° | 60.1° |
| C24 | C25 | N4 | H17 | 180.0° | 180.0° |
| C24 | C25 | N4 | H18 | 60.0° | 56.0° |
| C23 | C24 | C25 | N4 | 165.5° | 180.0° |
| C23 | C24 | C25 | C26 | 69.9° | 60.0° |
| C24 | C23 | C8 | H14 | 120.6° | 120.0° |
| C24 | C23 | C8 | H15 | 120.5° | 120.0° |
| C24 | C23 | C8 | C27 | 42.7° | 60.0° |
| C24 | C23 | C8 | N1 | 163.9° | 180.0° |
| C24 | C23 | C8 | H5 | 77.9° | 60.0° |
| C23 | C24 | H10 | H11 | 120.7° | 120.0° |
| C24 | C23 | H14 | H15 | 118.4° | 120.0° |
| C23 | C24 | C25 | H16 | 45.8° | 60.0° |
| N4 | C25 | C26 | H16 | 120.5° | 120.0° |
| N4 | C25 | C26 | C27 | 166.4° | 180.0° |
| N4 | C25 | C24 | H10 | 45.7° | 60.0° |
| N4 | C25 | C24 | H11 | 74.8° | 60.0° |
| N4 | C25 | C26 | H12 | 74.1° | 60.0° |
| N4 | C25 | C26 | H13 | 46.9° | 60.0° |
| C25 | N4 | H17 | H18 | 120.0° | 123.9° |
| C25 | C26 | C27 | H12 | 119.5° | 120.0° |
| C25 | C26 | C27 | H13 | 119.6° | 120.0° |
| C25 | C26 | C27 | C8 | 56.8° | 60.0° |
| C26 | C25 | C24 | H10 | 170.3° | 60.0° |
| C26 | C25 | C24 | H11 | 49.8° | 180.0° |
| C25 | C26 | H12 | H13 | 121.4° | 120.0° |
| C26 | C25 | N4 | H17 | 59.1° | 60.0° |
| C26 | C25 | N4 | H18 | 60.9° | 64.0° |
| C25 | C26 | C27 | H20 | 177.4° | 60.0° |
| C25 | C26 | C27 | H21 | 63.7° | 180.0° |
| C26 | C27 | C8 | C23 | 43.7° | 60.0° |
| C26 | C27 | C8 | H20 | 120.6° | 120.1° |
| C26 | C27 | C8 | H21 | 120.6° | 120.0° |
| C26 | C27 | C8 | N1 | 163.6° | 180.0° |
| C26 | C27 | C8 | H5 | 76.9° | 59.9° |
| C27 | C26 | H12 | H13 | 121.4° | 120.0° |
| C27 | C26 | C25 | H16 | 45.9° | 60.0° |
| C26 | C27 | H20 | H21 | 118.2° | 120.0° |
| O1 | C7 | N1 | C8 | 1.4° | 0.3° |
| O1 | C7 | N1 | C6 | 177.3° | 180.0° |
| O1 | C7 | C6 | C1 | 30.2° | 180.0° |
| O1 | C7 | C6 | C5 | 148.5° | 0.0° |
| O1 | C7 | N1 | H1 | 178.6° | 179.9° |
| C23 | C8 | C27 | N1 | 119.9° | 120.0° |
| C23 | C8 | C27 | H5 | 120.6° | 120.0° |
| C23 | C8 | N1 | H5 | 117.8° | 120.0° |
| C23 | C8 | N1 | C7 | 122.3° | 84.7° |
| C23 | C8 | N1 | H1 | 57.7° | 95.0° |
| C8 | C23 | C24 | H10 | 175.4° | 60.0° |
| C8 | C23 | C24 | H11 | 64.0° | 180.0° |
| C8 | C23 | H14 | H15 | 118.4° | 120.0° |
| C23 | C8 | C27 | H20 | 164.3° | 60.0° |
| C23 | C8 | C27 | H21 | 76.9° | 180.0° |
| C27 | C8 | N1 | H5 | 119.0° | 120.0° |
| C27 | C8 | N1 | C7 | 114.5° | 155.3° |
| C27 | C8 | N1 | H1 | 65.5° | 24.9° |
| C8 | C27 | C26 | H12 | 62.7° | 60.0° |
| C8 | C27 | C26 | H13 | 176.4° | 180.0° |
| C27 | C8 | C23 | H14 | 77.9° | 180.0° |
| C27 | C8 | C23 | H15 | 163.2° | 60.0° |
| C8 | C27 | H20 | H21 | 118.2° | 119.9° |
| C8 | N1 | C7 | H1 | 180.0° | 179.8° |
| C8 | N1 | C7 | C6 | 178.7° | 179.7° |
| N1 | C8 | C23 | H14 | 43.3° | 60.0° |
| N1 | C8 | C23 | H15 | 75.6° | 60.0° |
| N1 | C8 | C27 | H20 | 75.8° | 60.0° |
| N1 | C8 | C27 | H21 | 43.0° | 60.0° |
| C12 | C13 | C14 | H7 | 180.0° | 179.7° |
| C13 | C12 | C17 | H35 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 1.1° | 0.1° |
| C13 | C12 | C17 | C11 | 179.5° | 180.0° |
| C13 | C12 | C17 | C16 | 0.2° | 0.0° |
| C12 | C13 | C14 | H34 | 179.0° | 180.0° |
| C14 | C13 | C12 | C17 | 0.7° | 0.0° |
| C13 | C14 | C15 | H34 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 1.0° | 0.1° |
| C13 | C14 | C15 | C29 | 179.6° | 180.0° |
| C14 | C13 | C12 | H35 | 179.3° | 180.0° |
| N1 | C7 | C6 | C1 | 152.4° | 0.0° |
| N1 | C7 | C6 | C5 | 29.0° | 180.0° |
| C7 | N1 | C8 | H5 | 4.5° | 35.3° |
| C7 | C6 | C1 | C5 | 178.7° | 180.0° |
| C7 | C6 | C1 | C2 | 178.3° | 179.8° |
| C7 | C6 | C5 | C4 | 178.6° | 180.0° |
| C6 | C7 | N1 | H1 | 1.3° | 0.0° |
| C7 | C6 | C5 | H4 | 1.4° | 0.1° |
| C7 | C6 | C1 | H27 | 1.7° | 0.0° |
| C12 | C17 | C11 | O3 | 4.3° | 90.0° |
| C12 | C17 | C11 | C16 | 179.7° | 179.9° |
| C12 | C17 | C16 | C15 | 0.1° | 0.0° |
| C17 | C12 | C13 | H7 | 179.3° | 179.7° |
| C12 | C17 | C11 | H28 | 116.8° | 30.0° |
| C12 | C17 | C11 | H29 | 125.4° | 150.0° |
| C12 | C17 | C16 | H30 | 179.9° | 179.9° |
| C14 | C15 | C16 | C17 | 0.5° | 0.0° |
| C14 | C15 | C16 | C29 | 178.5° | 180.0° |
| C14 | C15 | C29 | N6 | 22.1° | 180.0° |
| C14 | C15 | C29 | N5 | 158.3° | 0.0° |
| C15 | C14 | C13 | H7 | 178.9° | 179.7° |
| C14 | C15 | C16 | H30 | 179.5° | 180.0° |
| C6 | C1 | C2 | H27 | 180.0° | 179.7° |
| C6 | C1 | C2 | O3 | 180.0° | 179.8° |
| C6 | C1 | C2 | C3 | 0.0° | 0.3° |
| C1 | C6 | C5 | C4 | 0.0° | 0.0° |
| C1 | C6 | C5 | H4 | 180.0° | 179.9° |
| C2 | C1 | C6 | C5 | 0.4° | 0.2° |
| C1 | C2 | O3 | C3 | 180.0° | 179.9° |
| C1 | C2 | O3 | C11 | 179.9° | 179.9° |
| C1 | C2 | C3 | C4 | 0.7° | 0.1° |
| C1 | C2 | C3 | H26 | 179.3° | 180.0° |
| C6 | C5 | C4 | H4 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 0.7° | 0.3° |
| C6 | C5 | C4 | O2 | 179.8° | 179.9° |
| C5 | C6 | C1 | H27 | 179.6° | 180.0° |
| C2 | O3 | C11 | C17 | 109.6° | 180.0° |
| O3 | C2 | C3 | C4 | 179.3° | 180.0° |
| O3 | C2 | C3 | H26 | 0.7° | 0.1° |
| O3 | C2 | C1 | H27 | 0.0° | 0.0° |
| C2 | O3 | C11 | H28 | 129.3° | 60.0° |
| C2 | O3 | C11 | H29 | 11.4° | 60.0° |
| C11 | O3 | C2 | C3 | 0.1° | 0.0° |
| O3 | C11 | C17 | H28 | 121.1° | 120.0° |
| O3 | C11 | C17 | H29 | 121.1° | 120.0° |
| O3 | C11 | C17 | C16 | 176.0° | 90.0° |
| O3 | C11 | H28 | H29 | 116.5° | 120.0° |
| C2 | C3 | C4 | C5 | 1.1° | 0.2° |
| C2 | C3 | C4 | H26 | 180.0° | 180.0° |
| C2 | C3 | C4 | O2 | 179.4° | 179.9° |
| C3 | C2 | C1 | H27 | 180.0° | 179.9° |
| C11 | C17 | C16 | C15 | 179.6° | 180.0° |
| C17 | C11 | H28 | H29 | 116.5° | 120.0° |
| C11 | C17 | C16 | H30 | 0.4° | 0.0° |
| C11 | C17 | C12 | H35 | 0.5° | 0.0° |
| C17 | C16 | C15 | H30 | 180.0° | 180.0° |
| C17 | C16 | C15 | C29 | 179.0° | 180.0° |
| C16 | C17 | C11 | H28 | 62.9° | 150.0° |
| C16 | C17 | C11 | H29 | 54.9° | 30.0° |
| C16 | C17 | C12 | H35 | 179.8° | 179.9° |
| C5 | C4 | C3 | O2 | 179.5° | 179.7° |
| C5 | C4 | O2 | C9 | 13.8° | 180.0° |
| C5 | C4 | C3 | H26 | 178.9° | 179.8° |
| C16 | C15 | C29 | N6 | 156.5° | 0.0° |
| C16 | C15 | C29 | N5 | 23.2° | 180.0° |
| C16 | C15 | C14 | H34 | 179.1° | 180.0° |
| C15 | C29 | N6 | N5 | 179.7° | 180.0° |
| C29 | C15 | C16 | H30 | 1.0° | 0.0° |
| C15 | C29 | N5 | H31 | 179.7° | 0.0° |
| C15 | C29 | N5 | H32 | 0.4° | 180.0° |
| C15 | C29 | N6 | H33 | 179.7° | 180.0° |
| C29 | C15 | C14 | H34 | 0.5° | 0.0° |
| N6 | C29 | N5 | H31 | 0.0° | 180.0° |
| N6 | C29 | N5 | H32 | 180.0° | 0.0° |
| C3 | C4 | O2 | C9 | 166.7° | 0.3° |
| C3 | C4 | C5 | H4 | 179.3° | 179.7° |
| C4 | O2 | C9 | C18 | 162.9° | 179.9° |
| O2 | C4 | C5 | H4 | 0.2° | 0.0° |
| C4 | O2 | C9 | H22 | 78.7° | 60.1° |
| C4 | O2 | C9 | H23 | 44.4° | 59.9° |
| O2 | C4 | C3 | H26 | 0.6° | 0.1° |
| C29 | N5 | H31 | H32 | 180.0° | 180.0° |
| N5 | C29 | N6 | H33 | 0.0° | 0.0° |
| O2 | C9 | C18 | H22 | 118.4° | 120.0° |
| O2 | C9 | C18 | H23 | 118.4° | 120.0° |
| O2 | C9 | C18 | C10 | 93.6° | 90.0° |
| O2 | C9 | C18 | C19 | 83.0° | 90.0° |
| O2 | C9 | H22 | H23 | 124.4° | 120.0° |
| C9 | C18 | C10 | C19 | 176.6° | 179.9° |
| C9 | C18 | C10 | C22 | 178.2° | 180.0° |
| C9 | C18 | C19 | C20 | 178.0° | 180.0° |
| C9 | C18 | C10 | H6 | 1.8° | 0.2° |
| C18 | C9 | H22 | H23 | 124.5° | 120.1° |
| C9 | C18 | C19 | H25 | 2.0° | 0.1° |
| C18 | C10 | C22 | H6 | 180.0° | 179.8° |
| C18 | C10 | C22 | C21 | 0.5° | 0.0° |
| C10 | C18 | C19 | C20 | 1.4° | 0.0° |
| C18 | C10 | C22 | H9 | 179.5° | 179.9° |
| C10 | C18 | C9 | H22 | 147.9° | 29.9° |
| C10 | C18 | C9 | H23 | 24.8° | 150.0° |
| C10 | C18 | C19 | H25 | 178.5° | 180.0° |
| C22 | C10 | C18 | C19 | 1.6° | 0.0° |
| C10 | C22 | C21 | H9 | 180.0° | 179.9° |
| C10 | C22 | C21 | C20 | 0.8° | 0.0° |
| C10 | C22 | C21 | H8 | 179.2° | 179.9° |
| C18 | C19 | C20 | H25 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 0.1° | 0.0° |
| C18 | C19 | C20 | C28 | 178.9° | 180.0° |
| C19 | C18 | C10 | H6 | 178.4° | 179.7° |
| C19 | C18 | C9 | H22 | 35.5° | 150.0° |
| C19 | C18 | C9 | H23 | 158.6° | 30.0° |
| C22 | C21 | C20 | C19 | 1.0° | 0.0° |
| C22 | C21 | C20 | H8 | 180.0° | 179.9° |
| C22 | C21 | C20 | C28 | 177.9° | 180.0° |
| C21 | C22 | C10 | H6 | 179.5° | 179.8° |
| C19 | C20 | C21 | C28 | 178.9° | 180.0° |
| C19 | C20 | C28 | N2 | 166.1° | 0.0° |
| C19 | C20 | C28 | N3 | 16.3° | 180.0° |
| C19 | C20 | C21 | H8 | 179.0° | 179.9° |
| C21 | C20 | C28 | N2 | 15.0° | 180.0° |
| C21 | C20 | C28 | N3 | 162.5° | 0.0° |
| C20 | C21 | C22 | H9 | 179.2° | 180.0° |
| C21 | C20 | C19 | H25 | 179.9° | 180.0° |
| C20 | C28 | N2 | N3 | 177.7° | 180.0° |
| C20 | C28 | N3 | H2 | 177.4° | 0.0° |
| C20 | C28 | N3 | H3 | 2.5° | 180.0° |
| C28 | C20 | C21 | H8 | 2.1° | 0.1° |
| C20 | C28 | N2 | H24 | 177.7° | 180.0° |
| C28 | C20 | C19 | H25 | 1.0° | 0.1° |
| N2 | C28 | N3 | H2 | 0.0° | 180.0° |
| N2 | C28 | N3 | H3 | 180.0° | 0.0° |
| C28 | N3 | H2 | H3 | 180.0° | 180.0° |
| N3 | C28 | N2 | H24 | 0.0° | 0.0° |
| H1 | N1 | C8 | H5 | 175.5° | 145.0° |
| H5 | C8 | C23 | H14 | 161.6° | 60.0° |
| H5 | C8 | C23 | H15 | 42.7° | 180.0° |
| H5 | C8 | C27 | H20 | 43.7° | NaN° |
| H5 | C8 | C27 | H21 | 162.5° | 60.1° |
| H6 | C10 | C22 | H9 | 0.5° | 0.3° |
| H7 | C13 | C14 | H34 | 1.1° | 0.3° |
| H7 | C13 | C12 | H35 | 0.7° | 0.2° |
| H8 | C21 | C22 | H9 | 0.8° | 0.1° |
| H10 | C24 | C23 | H14 | 54.9° | 60.0° |
| H10 | C24 | C23 | H15 | 64.0° | 180.0° |
| H10 | C24 | C25 | H16 | 74.0° | 180.0° |
| H11 | C24 | C23 | H14 | 175.4° | 60.0° |
| H11 | C24 | C23 | H15 | 56.5° | 60.0° |
| H11 | C24 | C25 | H16 | 165.5° | 60.0° |
| H12 | C26 | C25 | H16 | 165.4° | 180.0° |
| H12 | C26 | C27 | H20 | 57.9° | 180.0° |
| H12 | C26 | C27 | H21 | 176.8° | 60.0° |
| H13 | C26 | C25 | H16 | 73.6° | 60.0° |
| H13 | C26 | C27 | H20 | 63.0° | 59.9° |
| H13 | C26 | C27 | H21 | 55.8° | 60.1° |
| H16 | C25 | N4 | H17 | 60.9° | 60.0° |
| H16 | C25 | N4 | H18 | 179.1° | 176.1° |
