3Z4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C32 | N4 | sing | 1.46Å | 1.48Å | |
| N4 | C24 | sing | 1.38Å | 1.34Å | |
| C24 | N3 | doub | 1.29Å | 1.33Å | Aromatic |
| C24 | S1 | sing | 1.76Å | 1.70Å | Aromatic |
| N3 | C22 | sing | 1.35Å | 1.35Å | Aromatic |
| S1 | C23 | sing | 1.76Å | 1.70Å | Aromatic |
| C22 | C25 | doub | 1.41Å | 1.39Å | Aromatic |
| C22 | C23 | sing | 1.40Å | 1.41Å | Aromatic |
| C25 | C26 | sing | 1.36Å | 1.39Å | Aromatic |
| C23 | C28 | doub | 1.39Å | 1.40Å | Aromatic |
| C26 | C27 | doub | 1.40Å | 1.40Å | Aromatic |
| C28 | C27 | sing | 1.39Å | 1.40Å | Aromatic |
| C27 | C16 | sing | 1.48Å | 1.41Å | |
| C29 | C21 | sing | 1.51Å | 1.54Å | |
| C16 | C21 | doub | 1.39Å | 1.41Å | Aromatic |
| C16 | C17 | sing | 1.40Å | 1.40Å | Aromatic |
| C21 | C20 | sing | 1.38Å | 1.40Å | Aromatic |
| N5 | C17 | sing | 1.39Å | 1.35Å | |
| C17 | C18 | doub | 1.40Å | 1.41Å | Aromatic |
| C20 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.40Å | 1.40Å | Aromatic |
| C18 | C30 | sing | 1.48Å | 1.54Å | |
| O2 | C30 | doub | 1.22Å | 1.24Å | |
| C30 | C13 | sing | 1.46Å | 1.54Å | |
| O1 | C15 | doub | 1.22Å | 1.23Å | |
| C13 | C15 | sing | 1.47Å | 1.40Å | |
| C13 | C14 | doub | 1.40Å | 1.40Å | |
| C6 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | C1 | sing | 1.40Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | N2 | sing | 1.35Å | 1.33Å | |
| C14 | C1 | sing | 1.47Å | 1.41Å | |
| C14 | N1 | sing | 1.36Å | 1.34Å | |
| C1 | C2 | doub | 1.40Å | 1.41Å | Aromatic |
| C4 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| N2 | N1 | sing | 1.40Å | 1.25Å | |
| N2 | C7 | sing | 1.40Å | 1.35Å | |
| C2 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| N1 | C31 | sing | 1.46Å | 1.48Å | |
| C7 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.40Å | Aromatic |
| C32 | H1 | sing | 1.09Å | 1.10Å | |
| C32 | H2 | sing | 1.09Å | 1.10Å | |
| C32 | H3 | sing | 1.09Å | 1.10Å | |
| N4 | H4 | sing | 0.97Å | 1.00Å | |
| C28 | H5 | sing | 1.08Å | 1.08Å | |
| C25 | H6 | sing | 1.08Å | 1.08Å | |
| C26 | H7 | sing | 1.08Å | 1.08Å | |
| N5 | H8 | sing | 0.97Å | 1.00Å | |
| N5 | H9 | sing | 0.97Å | 1.00Å | |
| C29 | H10 | sing | 1.09Å | 1.10Å | |
| C29 | H11 | sing | 1.09Å | 1.10Å | |
| C29 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.08Å | 1.08Å | |
| C19 | H14 | sing | 1.08Å | 1.08Å | |
| C8 | H15 | sing | 1.08Å | 1.08Å | |
| C9 | H16 | sing | 1.08Å | 1.08Å | |
| C10 | H17 | sing | 1.08Å | 1.08Å | |
| C11 | H18 | sing | 1.08Å | 1.08Å | |
| C12 | H19 | sing | 1.08Å | 1.08Å | |
| C31 | H20 | sing | 1.09Å | 1.10Å | |
| C31 | H21 | sing | 1.09Å | 1.10Å | |
| C31 | H22 | sing | 1.09Å | 1.10Å | |
| C2 | H23 | sing | 1.08Å | 1.08Å | |
| C3 | H24 | sing | 1.08Å | 1.08Å | |
| C4 | H25 | sing | 1.08Å | 1.08Å | |
| C5 | H26 | sing | 1.08Å | 1.08Å | |
| C6 | H27 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C32 | N4 | C24 | 121.1° | 120.0° |
| N4 | C32 | H1 | 109.5° | 109.4° |
| N4 | C32 | H2 | 109.5° | 109.5° |
| N4 | C32 | H3 | 109.5° | 109.4° |
| C32 | N4 | H4 | 106.5° | 120.0° |
| N4 | C24 | N3 | 123.8° | 124.8° |
| N4 | C24 | S1 | 127.6° | 124.8° |
| C24 | N4 | H4 | 106.5° | 120.0° |
| N3 | C24 | S1 | 108.6° | 110.4° |
| C24 | N3 | C22 | 115.5° | 117.9° |
| C24 | S1 | C23 | 95.3° | 90.4° |
| N3 | C22 | C25 | 127.1° | 128.6° |
| N3 | C22 | C23 | 114.4° | 112.9° |
| S1 | C23 | C22 | 106.1° | 108.4° |
| S1 | C23 | C28 | 132.5° | 131.1° |
| C25 | C22 | C23 | 118.5° | 118.5° |
| C22 | C25 | C26 | 120.3° | 120.8° |
| C22 | C25 | H6 | 119.8° | 119.6° |
| C22 | C23 | C28 | 121.3° | 120.4° |
| C25 | C26 | C27 | 121.6° | 120.6° |
| C26 | C25 | H6 | 119.9° | 119.7° |
| C25 | C26 | H7 | 119.2° | 119.7° |
| C23 | C28 | C27 | 119.3° | 120.0° |
| C23 | C28 | H5 | 120.4° | 120.0° |
| C26 | C27 | C28 | 119.0° | 119.7° |
| C26 | C27 | C16 | 114.7° | 120.1° |
| C27 | C26 | H7 | 119.2° | 119.7° |
| C28 | C27 | C16 | 126.2° | 120.2° |
| C27 | C28 | H5 | 120.4° | 120.0° |
| C27 | C16 | C21 | 119.3° | 120.1° |
| C27 | C16 | C17 | 121.4° | 120.1° |
| C29 | C21 | C16 | 121.9° | 119.9° |
| C29 | C21 | C20 | 117.3° | 119.9° |
| C21 | C29 | H10 | 109.5° | 109.4° |
| C21 | C29 | H11 | 109.5° | 109.5° |
| C21 | C29 | H12 | 109.5° | 109.5° |
| C21 | C16 | C17 | 119.1° | 119.8° |
| C16 | C21 | C20 | 120.7° | 120.3° |
| C16 | C17 | N5 | 119.9° | 120.2° |
| C16 | C17 | C18 | 120.1° | 119.5° |
| C21 | C20 | C19 | 119.9° | 120.5° |
| C21 | C20 | H13 | 120.0° | 119.7° |
| N5 | C17 | C18 | 120.0° | 120.2° |
| C17 | N5 | H8 | 109.5° | 120.1° |
| C17 | N5 | H9 | 109.5° | 120.0° |
| C17 | C18 | C19 | 120.2° | 119.7° |
| C17 | C18 | C30 | 119.5° | 120.1° |
| C20 | C19 | C18 | 120.0° | 120.2° |
| C19 | C20 | H13 | 120.0° | 119.8° |
| C20 | C19 | H14 | 120.0° | 119.9° |
| C19 | C18 | C30 | 120.3° | 120.2° |
| C18 | C19 | H14 | 120.0° | 119.9° |
| C18 | C30 | O2 | 118.5° | 120.0° |
| C18 | C30 | C13 | 123.3° | 120.1° |
| O2 | C30 | C13 | 118.1° | 119.9° |
| C30 | C13 | C15 | 129.5° | 126.7° |
| C30 | C13 | C14 | 125.6° | 126.9° |
| O1 | C15 | C13 | 127.6° | 126.6° |
| O1 | C15 | N2 | 125.0° | 126.5° |
| C15 | C13 | C14 | 104.9° | 106.4° |
| C13 | C15 | N2 | 107.4° | 107.0° |
| C13 | C14 | C1 | 127.7° | 126.0° |
| C13 | C14 | N1 | 105.6° | 108.0° |
| C5 | C6 | C1 | 119.8° | 119.8° |
| C6 | C5 | C4 | 121.1° | 120.2° |
| C6 | C5 | H26 | 119.5° | 119.9° |
| C5 | C6 | H27 | 120.1° | 120.1° |
| C6 | C1 | C14 | 123.5° | 120.2° |
| C6 | C1 | C2 | 118.9° | 119.7° |
| C1 | C6 | H27 | 120.1° | 120.1° |
| C5 | C4 | C3 | 119.5° | 120.3° |
| C5 | C4 | H25 | 120.3° | 119.9° |
| C4 | C5 | H26 | 119.4° | 119.9° |
| C15 | N2 | N1 | 109.8° | 109.0° |
| C15 | N2 | C7 | 123.4° | 125.5° |
| C1 | C14 | N1 | 126.7° | 126.0° |
| C14 | C1 | C2 | 117.6° | 120.2° |
| C14 | N1 | N2 | 112.3° | 109.6° |
| C14 | N1 | C31 | 122.0° | 125.2° |
| C1 | C2 | C3 | 121.4° | 119.8° |
| C1 | C2 | H23 | 119.3° | 120.1° |
| C4 | C3 | C2 | 119.3° | 120.2° |
| C4 | C3 | H24 | 120.3° | 119.9° |
| C3 | C4 | H25 | 120.2° | 119.8° |
| N1 | N2 | C7 | 126.6° | 125.5° |
| N2 | N1 | C31 | 125.6° | 125.2° |
| N2 | C7 | C12 | 123.5° | 120.1° |
| N2 | C7 | C8 | 117.2° | 120.1° |
| C3 | C2 | H23 | 119.3° | 120.1° |
| C2 | C3 | H24 | 120.3° | 119.9° |
| N1 | C31 | H20 | 109.5° | 109.5° |
| N1 | C31 | H21 | 109.5° | 109.4° |
| N1 | C31 | H22 | 109.4° | 109.5° |
| C12 | C7 | C8 | 119.3° | 119.9° |
| C7 | C12 | C11 | 119.7° | 119.9° |
| C7 | C12 | H19 | 120.1° | 120.0° |
| C7 | C8 | C9 | 121.4° | 119.9° |
| C7 | C8 | H15 | 119.3° | 120.0° |
| C12 | C11 | C10 | 120.8° | 120.1° |
| C12 | C11 | H18 | 119.6° | 119.9° |
| C11 | C12 | H19 | 120.1° | 120.1° |
| C8 | C9 | C10 | 118.8° | 120.1° |
| C9 | C8 | H15 | 119.3° | 120.1° |
| C8 | C9 | H16 | 120.6° | 119.9° |
| C11 | C10 | C9 | 120.0° | 120.1° |
| C11 | C10 | H17 | 120.0° | 120.0° |
| C10 | C11 | H18 | 119.6° | 119.9° |
| C10 | C9 | H16 | 120.6° | 120.0° |
| C9 | C10 | H17 | 120.0° | 119.9° |
| H1 | C32 | H2 | 109.5° | 109.5° |
| H1 | C32 | H3 | 109.5° | 109.4° |
| H2 | C32 | H3 | 109.5° | 109.5° |
| H8 | N5 | H9 | 109.5° | 120.0° |
| H10 | C29 | H11 | 109.5° | 109.5° |
| H10 | C29 | H12 | 109.5° | 109.5° |
| H11 | C29 | H12 | 109.5° | 109.5° |
| H20 | C31 | H21 | 109.5° | 109.5° |
| H20 | C31 | H22 | 109.5° | 109.5° |
| H21 | C31 | H22 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C32 | N4 | C24 | H4 | 121.7° | 180.0° |
| C32 | N4 | C24 | N3 | 175.1° | 0.1° |
| C32 | N4 | C24 | S1 | 4.4° | 179.7° |
| N4 | C32 | H1 | H2 | 120.0° | 120.1° |
| N4 | C32 | H1 | H3 | 120.0° | 119.9° |
| N4 | C32 | H2 | H3 | 120.0° | 120.0° |
| N4 | C24 | N3 | S1 | 179.5° | 179.7° |
| N4 | C24 | N3 | C22 | 179.5° | 179.9° |
| N4 | C24 | S1 | C23 | 179.7° | 180.0° |
| C24 | N4 | C32 | H1 | 180.0° | 60.1° |
| C24 | N4 | C32 | H2 | 60.0° | 60.0° |
| C24 | N4 | C32 | H3 | 60.0° | 180.0° |
| N3 | C24 | S1 | C23 | 0.7° | 0.2° |
| C24 | N3 | C22 | C25 | 179.3° | 180.0° |
| C24 | N3 | C22 | C23 | 1.1° | 0.1° |
| N3 | C24 | N4 | H4 | 53.4° | 180.0° |
| S1 | C24 | N3 | C22 | 0.1° | 0.2° |
| C24 | S1 | C23 | C22 | 1.3° | 0.2° |
| C24 | S1 | C23 | C28 | 179.1° | 180.0° |
| S1 | C24 | N4 | H4 | 126.0° | 0.3° |
| N3 | C22 | C23 | S1 | 1.5° | 0.1° |
| N3 | C22 | C25 | C23 | 179.6° | 179.9° |
| N3 | C22 | C25 | C26 | 179.8° | 180.0° |
| N3 | C22 | C23 | C28 | 179.7° | 180.0° |
| N3 | C22 | C25 | H6 | 0.2° | 0.0° |
| S1 | C23 | C22 | C25 | 178.9° | 179.8° |
| S1 | C23 | C22 | C28 | 178.2° | 179.9° |
| S1 | C23 | C28 | C27 | 177.9° | 179.9° |
| S1 | C23 | C28 | H5 | 2.1° | 0.1° |
| C22 | C25 | C26 | H6 | 180.0° | 179.9° |
| C25 | C22 | C23 | C28 | 0.7° | 0.1° |
| C22 | C25 | C26 | C27 | 0.6° | 0.1° |
| C22 | C25 | C26 | H7 | 179.4° | 180.0° |
| C23 | C22 | C25 | C26 | 0.2° | 0.1° |
| C22 | C23 | C28 | C27 | 0.3° | 0.2° |
| C22 | C23 | C28 | H5 | 179.7° | 179.8° |
| C23 | C22 | C25 | H6 | 179.8° | 179.9° |
| C25 | C26 | C27 | H7 | 180.0° | 179.9° |
| C25 | C26 | C27 | C28 | 1.0° | 0.4° |
| C25 | C26 | C27 | C16 | 178.6° | 179.9° |
| C23 | C28 | C27 | C26 | 0.5° | 0.5° |
| C23 | C28 | C27 | H5 | 180.0° | 180.0° |
| C23 | C28 | C27 | C16 | 177.8° | 179.9° |
| C26 | C27 | C28 | C16 | 177.3° | 179.5° |
| C26 | C27 | C16 | C21 | 92.7° | 65.5° |
| C26 | C27 | C16 | C17 | 82.7° | 114.8° |
| C26 | C27 | C28 | H5 | 179.5° | 179.5° |
| C27 | C26 | C25 | H6 | 179.4° | 179.8° |
| C28 | C27 | C16 | C21 | 84.7° | 115.1° |
| C28 | C27 | C16 | C17 | 99.9° | 64.6° |
| C28 | C27 | C26 | H7 | 179.0° | 179.7° |
| C27 | C16 | C21 | C29 | 3.1° | 0.0° |
| C27 | C16 | C21 | C17 | 175.5° | 179.7° |
| C27 | C16 | C21 | C20 | 177.2° | 180.0° |
| C27 | C16 | C17 | N5 | 3.9° | 0.1° |
| C27 | C16 | C17 | C18 | 177.2° | 180.0° |
| C16 | C27 | C28 | H5 | 2.2° | 0.0° |
| C16 | C27 | C26 | H7 | 1.4° | 0.2° |
| C29 | C21 | C16 | C20 | 179.7° | 179.9° |
| C29 | C21 | C16 | C17 | 178.6° | 179.7° |
| C29 | C21 | C20 | C19 | 178.9° | 179.9° |
| C21 | C29 | H10 | H11 | 120.0° | 120.0° |
| C21 | C29 | H10 | H12 | 120.0° | 120.0° |
| C21 | C29 | H11 | H12 | 120.0° | 120.0° |
| C29 | C21 | C20 | H13 | 1.1° | 0.0° |
| C21 | C16 | C17 | N5 | 179.3° | 179.8° |
| C21 | C16 | C17 | C18 | 1.8° | 0.3° |
| C16 | C21 | C20 | C19 | 1.4° | 0.0° |
| C16 | C21 | C29 | H10 | 89.8° | 90.0° |
| C16 | C21 | C29 | H11 | 150.1° | 150.0° |
| C16 | C21 | C29 | H12 | 30.2° | 29.9° |
| C16 | C21 | C20 | H13 | 178.6° | 180.0° |
| C17 | C16 | C21 | C20 | 1.6° | 0.3° |
| C16 | C17 | N5 | C18 | 178.9° | 179.9° |
| C16 | C17 | C18 | C19 | 1.8° | 0.1° |
| C16 | C17 | C18 | C30 | 179.7° | 180.0° |
| C16 | C17 | N5 | H8 | 180.0° | 5.3° |
| C16 | C17 | N5 | H9 | 60.0° | 174.6° |
| C21 | C20 | C19 | H13 | 180.0° | 180.0° |
| C21 | C20 | C19 | C18 | 1.3° | 0.2° |
| C20 | C21 | C29 | H10 | 89.9° | 90.0° |
| C20 | C21 | C29 | H11 | 30.1° | 30.0° |
| C20 | C21 | C29 | H12 | 150.1° | 150.0° |
| C21 | C20 | C19 | H14 | 178.8° | 180.0° |
| N5 | C17 | C18 | C19 | 179.4° | 180.0° |
| N5 | C17 | C18 | C30 | 1.4° | 0.1° |
| C17 | N5 | H8 | H9 | 120.0° | 179.9° |
| C17 | C18 | C19 | C20 | 1.5° | 0.2° |
| C17 | C18 | C19 | C30 | 177.9° | 179.9° |
| C17 | C18 | C30 | O2 | 21.2° | 105.2° |
| C17 | C18 | C30 | C13 | 163.0° | 74.9° |
| C18 | C17 | N5 | H8 | 1.2° | 174.6° |
| C18 | C17 | N5 | H9 | 118.9° | 5.5° |
| C17 | C18 | C19 | H14 | 178.6° | 180.0° |
| C20 | C19 | C18 | H14 | 180.0° | 179.8° |
| C20 | C19 | C18 | C30 | 179.4° | 179.7° |
| C19 | C18 | C30 | O2 | 156.8° | 74.9° |
| C19 | C18 | C30 | C13 | 19.1° | 105.1° |
| C18 | C19 | C20 | H13 | 178.7° | 179.7° |
| C18 | C30 | O2 | C13 | 176.0° | 180.0° |
| C18 | C30 | C13 | C15 | 30.6° | 5.9° |
| C18 | C30 | C13 | C14 | 149.9° | 174.4° |
| C30 | C18 | C19 | H14 | 0.6° | 0.1° |
| O2 | C30 | C13 | C15 | 153.5° | 174.1° |
| O2 | C30 | C13 | C14 | 25.9° | 5.7° |
| C30 | C13 | C15 | O1 | 0.2° | 0.1° |
| C30 | C13 | C15 | C14 | 179.5° | 179.8° |
| C30 | C13 | C15 | N2 | 180.0° | 180.0° |
| C30 | C13 | C14 | C1 | 0.5° | 0.0° |
| C30 | C13 | C14 | N1 | 179.1° | 179.9° |
| O1 | C15 | C13 | N2 | 179.8° | 179.9° |
| O1 | C15 | C13 | C14 | 179.3° | 179.7° |
| O1 | C15 | N2 | N1 | 178.4° | 180.0° |
| O1 | C15 | N2 | C7 | 2.3° | 0.1° |
| C15 | C13 | C14 | C1 | 179.1° | 179.8° |
| C15 | C13 | C14 | N1 | 0.5° | 0.3° |
| C13 | C15 | N2 | N1 | 1.3° | 0.1° |
| C13 | C15 | N2 | C7 | 177.4° | 180.0° |
| C13 | C14 | C1 | C6 | 62.2° | 129.2° |
| C14 | C13 | C15 | N2 | 0.5° | 0.2° |
| C13 | C14 | C1 | N1 | 178.3° | 179.9° |
| C13 | C14 | C1 | C2 | 119.2° | 51.1° |
| C13 | C14 | N1 | N2 | 1.4° | 0.4° |
| C13 | C14 | N1 | C31 | 178.8° | 179.9° |
| C5 | C6 | C1 | H27 | 180.0° | 179.5° |
| C6 | C5 | C4 | H26 | 180.0° | 179.8° |
| C5 | C6 | C1 | C14 | 179.2° | 179.8° |
| C5 | C6 | C1 | C2 | 0.5° | 0.5° |
| C6 | C5 | C4 | C3 | 0.3° | 0.2° |
| C6 | C5 | C4 | H25 | 179.7° | 179.8° |
| C1 | C6 | C5 | C4 | 0.2° | 0.5° |
| C6 | C1 | C14 | C2 | 178.7° | 179.7° |
| C6 | C1 | C14 | N1 | 119.5° | 51.0° |
| C6 | C1 | C2 | C3 | 0.3° | 0.3° |
| C6 | C1 | C2 | H23 | 179.7° | 179.7° |
| C1 | C6 | C5 | H26 | 179.8° | 179.7° |
| C5 | C4 | C3 | H25 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.5° | 0.0° |
| C5 | C4 | C3 | H24 | 179.5° | 180.0° |
| C4 | C5 | C6 | H27 | 179.7° | 180.0° |
| C15 | N2 | N1 | C14 | 1.7° | 0.3° |
| C15 | N2 | N1 | C7 | 175.9° | 179.9° |
| C15 | N2 | N1 | C31 | 179.0° | 180.0° |
| C15 | N2 | C7 | C12 | 74.6° | 48.3° |
| C15 | N2 | C7 | C8 | 103.3° | 131.4° |
| C1 | C14 | N1 | N2 | 180.0° | 179.7° |
| C14 | C1 | C2 | C3 | 179.0° | 180.0° |
| C1 | C14 | N1 | C31 | 2.6° | 0.0° |
| C14 | C1 | C2 | H23 | 1.0° | 0.0° |
| C14 | C1 | C6 | H27 | 0.8° | 0.3° |
| N1 | C14 | C1 | C2 | 59.2° | 128.7° |
| C14 | N1 | N2 | C31 | 177.3° | 179.7° |
| C14 | N1 | N2 | C7 | 177.7° | 179.8° |
| C14 | N1 | C31 | H20 | 180.0° | 175.0° |
| C14 | N1 | C31 | H21 | 60.0° | 55.0° |
| C14 | N1 | C31 | H22 | 60.0° | 65.0° |
| C1 | C2 | C3 | C4 | 0.2° | 0.0° |
| C1 | C2 | C3 | H23 | 180.0° | 180.0° |
| C1 | C2 | C3 | H24 | 179.8° | 180.0° |
| C2 | C1 | C6 | H27 | 179.5° | 180.0° |
| C4 | C3 | C2 | H24 | 180.0° | 180.0° |
| C4 | C3 | C2 | H23 | 179.8° | 180.0° |
| C3 | C4 | C5 | H26 | 179.7° | 180.0° |
| N1 | N2 | C7 | C12 | 110.0° | 131.7° |
| N1 | N2 | C7 | C8 | 72.1° | 48.5° |
| N2 | N1 | C31 | H20 | 3.0° | 4.7° |
| N2 | N1 | C31 | H21 | 122.9° | 124.8° |
| N2 | N1 | C31 | H22 | 117.0° | 115.3° |
| C7 | N2 | N1 | C31 | 5.0° | 0.0° |
| N2 | C7 | C12 | C8 | 177.9° | 179.7° |
| N2 | C7 | C12 | C11 | 179.2° | 179.6° |
| N2 | C7 | C8 | C9 | 179.4° | 180.0° |
| N2 | C7 | C8 | H15 | 0.7° | 0.0° |
| N2 | C7 | C12 | H19 | 0.8° | 0.0° |
| C2 | C3 | C4 | H25 | 179.5° | 180.0° |
| N1 | C31 | H20 | H21 | 120.0° | 120.0° |
| N1 | C31 | H20 | H22 | 120.0° | 120.0° |
| N1 | C31 | H21 | H22 | 120.0° | 120.0° |
| C7 | C12 | C11 | H19 | 180.0° | 179.6° |
| C12 | C7 | C8 | C9 | 1.4° | 0.2° |
| C7 | C12 | C11 | C10 | 0.9° | 0.7° |
| C12 | C7 | C8 | H15 | 178.7° | 179.7° |
| C7 | C12 | C11 | H18 | 179.1° | 179.7° |
| C8 | C7 | C12 | C11 | 1.3° | 0.6° |
| C7 | C8 | C9 | H15 | 180.0° | 179.9° |
| C7 | C8 | C9 | C10 | 1.0° | 0.1° |
| C7 | C8 | C9 | H16 | 179.0° | 180.0° |
| C8 | C7 | C12 | H19 | 178.7° | 179.8° |
| C12 | C11 | C10 | H18 | 180.0° | 179.6° |
| C12 | C11 | C10 | C9 | 0.6° | 0.3° |
| C12 | C11 | C10 | H17 | 179.5° | 179.7° |
| C8 | C9 | C10 | C11 | 0.5° | 0.1° |
| C8 | C9 | C10 | H16 | 180.0° | 179.9° |
| C8 | C9 | C10 | H17 | 179.5° | 179.9° |
| C11 | C10 | C9 | H17 | 180.0° | 180.0° |
| C11 | C10 | C9 | H16 | 179.4° | 180.0° |
| C10 | C11 | C12 | H19 | 179.1° | 179.7° |
| C10 | C9 | C8 | H15 | 179.1° | 180.0° |
| C9 | C10 | C11 | H18 | 179.5° | 180.0° |
| H1 | C32 | H2 | H3 | 120.0° | 120.0° |
| H1 | C32 | N4 | H4 | 58.4° | 120.0° |
| H2 | C32 | N4 | H4 | 61.7° | 120.0° |
| H3 | C32 | N4 | H4 | 178.4° | 0.0° |
| H6 | C25 | C26 | H7 | 0.6° | 0.1° |
| H10 | C29 | H11 | H12 | 120.0° | 120.0° |
| H13 | C20 | C19 | H14 | 1.2° | 0.1° |
| H15 | C8 | C9 | H16 | 1.0° | 0.1° |
| H16 | C9 | C10 | H17 | 0.5° | 0.1° |
| H17 | C10 | C11 | H18 | 0.5° | 0.0° |
| H18 | C11 | C12 | H19 | 0.9° | 0.1° |
| H20 | C31 | H21 | H22 | 120.0° | 120.1° |
| H23 | C2 | C3 | H24 | 0.2° | 0.1° |
| H24 | C3 | C4 | H25 | 0.5° | 0.0° |
| H25 | C4 | C5 | H26 | 0.3° | 0.0° |
| H26 | C5 | C6 | H27 | 0.2° | 0.2° |
