A1EIE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O5 | S4 | doub | 1.42Å | 1.44Å | |
| C8 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
| C8 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
| S4 | C2 | sing | 1.81Å | 1.79Å | |
| S4 | C7 | sing | 1.76Å | 1.76Å | |
| S4 | O6 | doub | 1.42Å | 1.44Å | |
| C2 | C3 | sing | 1.53Å | 1.51Å | |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| C9 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C7 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C14 | N15 | sing | 1.32Å | 1.34Å | Aromatic |
| C14 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | C13 | sing | 1.48Å | 1.48Å | |
| C10 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| N15 | C16 | doub | 1.33Å | 1.35Å | Aromatic |
| C13 | N18 | sing | 1.33Å | 1.34Å | Aromatic |
| C16 | N33 | sing | 1.39Å | 1.33Å | |
| C16 | C17 | sing | 1.41Å | 1.42Å | Aromatic |
| N18 | C17 | doub | 1.33Å | 1.34Å | Aromatic |
| C17 | C19 | sing | 1.48Å | 1.45Å | |
| C19 | C20 | doub | 1.37Å | 1.35Å | Aromatic |
| C19 | O23 | sing | 1.35Å | 1.35Å | Aromatic |
| C20 | C21 | sing | 1.42Å | 1.41Å | Aromatic |
| O23 | N22 | sing | 1.21Å | 1.41Å | Aromatic |
| C21 | N22 | doub | 1.31Å | 1.31Å | Aromatic |
| C21 | C24 | sing | 1.48Å | 1.47Å | |
| C25 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.38Å | Aromatic |
| C24 | C29 | sing | 1.39Å | 1.39Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C32 | N31 | sing | 1.47Å | 1.48Å | |
| C27 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | C30 | sing | 1.51Å | 1.50Å | |
| N31 | C30 | sing | 1.47Å | 1.49Å | |
| C8 | H1 | sing | 1.08Å | 1.08Å | |
| C20 | H2 | sing | 1.08Å | 1.08Å | |
| C26 | H3 | sing | 1.08Å | 1.08Å | |
| C28 | H4 | sing | 1.08Å | 1.08Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C1 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.08Å | 1.08Å | |
| C14 | H10 | sing | 1.08Å | 1.08Å | |
| C2 | H11 | sing | 1.09Å | 1.10Å | |
| C25 | H12 | sing | 1.08Å | 1.08Å | |
| C29 | H13 | sing | 1.08Å | 1.08Å | |
| C3 | H14 | sing | 1.09Å | 1.10Å | |
| C3 | H15 | sing | 1.09Å | 1.10Å | |
| C3 | H16 | sing | 1.09Å | 1.10Å | |
| C30 | H17 | sing | 1.09Å | 1.10Å | |
| C30 | H18 | sing | 1.09Å | 1.10Å | |
| C32 | H19 | sing | 1.09Å | 1.10Å | |
| C32 | H20 | sing | 1.09Å | 1.10Å | |
| C32 | H21 | sing | 1.09Å | 1.10Å | |
| C9 | H22 | sing | 1.08Å | 1.08Å | |
| N31 | H31 | sing | 1.01Å | 1.00Å | |
| N33 | H33B | sing | 0.97Å | 1.00Å | |
| N33 | H23 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O5 | S4 | C2 | 108.1° | 110.5° |
| O5 | S4 | C7 | 107.9° | 104.3° |
| O5 | S4 | O6 | 118.4° | 121.0° |
| C9 | C8 | C7 | 119.2° | 120.1° |
| C8 | C9 | C10 | 121.2° | 119.9° |
| C9 | C8 | H1 | 120.4° | 119.9° |
| C8 | C9 | H22 | 119.4° | 120.0° |
| C8 | C7 | S4 | 119.6° | 119.8° |
| C8 | C7 | C12 | 120.8° | 120.2° |
| C7 | C8 | H1 | 120.4° | 120.0° |
| C2 | S4 | C7 | 105.8° | 104.4° |
| C2 | S4 | O6 | 108.1° | 110.5° |
| S4 | C2 | C3 | 110.6° | 109.5° |
| S4 | C2 | C1 | 109.8° | 109.5° |
| S4 | C2 | H11 | 105.8° | 109.5° |
| C7 | S4 | O6 | 107.8° | 104.3° |
| S4 | C7 | C12 | 119.5° | 119.9° |
| C3 | C2 | C1 | 112.9° | 109.5° |
| C3 | C2 | H11 | 108.7° | 109.4° |
| C2 | C3 | H14 | 109.5° | 109.5° |
| C2 | C3 | H15 | 109.5° | 109.5° |
| C2 | C3 | H16 | 109.4° | 109.5° |
| C2 | C1 | H5 | 109.5° | 109.5° |
| C2 | C1 | H6 | 109.4° | 109.5° |
| C2 | C1 | H7 | 109.5° | 109.5° |
| C1 | C2 | H11 | 108.7° | 109.5° |
| C9 | C10 | C13 | 121.8° | 120.2° |
| C9 | C10 | C11 | 118.2° | 119.7° |
| C10 | C9 | H22 | 119.4° | 120.0° |
| C7 | C12 | C11 | 119.2° | 120.1° |
| C7 | C12 | H9 | 120.4° | 119.9° |
| N15 | C14 | C13 | 122.2° | 120.2° |
| C14 | N15 | C16 | 118.3° | 120.1° |
| N15 | C14 | H10 | 118.9° | 119.8° |
| C14 | C13 | C10 | 123.9° | 119.9° |
| C14 | C13 | N18 | 120.0° | 120.2° |
| C13 | C14 | H10 | 118.9° | 119.9° |
| C13 | C10 | C11 | 120.0° | 120.1° |
| C10 | C13 | N18 | 116.1° | 119.9° |
| C10 | C11 | C12 | 121.3° | 119.9° |
| C10 | C11 | H8 | 119.3° | 120.1° |
| C12 | C11 | H8 | 119.4° | 120.0° |
| C11 | C12 | H9 | 120.4° | 120.0° |
| N15 | C16 | N33 | 117.7° | 120.1° |
| N15 | C16 | C17 | 119.6° | 119.9° |
| C13 | N18 | C17 | 119.3° | 119.9° |
| N33 | C16 | C17 | 122.6° | 120.1° |
| C16 | N33 | H33B | 109.5° | 120.0° |
| C16 | N33 | H23 | 109.5° | 120.0° |
| C16 | C17 | N18 | 120.6° | 119.8° |
| C16 | C17 | C19 | 130.7° | 120.1° |
| N18 | C17 | C19 | 108.7° | 120.1° |
| C17 | C19 | C20 | 131.6° | 126.9° |
| C17 | C19 | O23 | 118.2° | 126.8° |
| C20 | C19 | O23 | 109.5° | 106.3° |
| C19 | C20 | C21 | 105.2° | 103.8° |
| C19 | C20 | H2 | 127.4° | 128.1° |
| C19 | O23 | N22 | 108.3° | 111.7° |
| C20 | C21 | N22 | 111.5° | 106.3° |
| C20 | C21 | C24 | 127.8° | 126.8° |
| C21 | C20 | H2 | 127.4° | 128.1° |
| O23 | N22 | C21 | 105.6° | 111.8° |
| N22 | C21 | C24 | 120.5° | 126.8° |
| C21 | C24 | C25 | 120.2° | 120.1° |
| C21 | C24 | C29 | 121.0° | 120.1° |
| C24 | C25 | C26 | 120.8° | 119.9° |
| C25 | C24 | C29 | 118.4° | 119.7° |
| C24 | C25 | H12 | 119.6° | 120.0° |
| C25 | C26 | C27 | 121.0° | 120.2° |
| C25 | C26 | H3 | 119.5° | 119.9° |
| C26 | C25 | H12 | 119.6° | 120.1° |
| C24 | C29 | C28 | 120.6° | 119.9° |
| C24 | C29 | H13 | 119.7° | 120.0° |
| C26 | C27 | C28 | 118.2° | 120.2° |
| C26 | C27 | C30 | 120.8° | 119.9° |
| C27 | C26 | H3 | 119.5° | 119.9° |
| C29 | C28 | C27 | 121.0° | 120.1° |
| C29 | C28 | H4 | 119.5° | 119.9° |
| C28 | C29 | H13 | 119.7° | 120.1° |
| C32 | N31 | C30 | 114.3° | 111.0° |
| N31 | C32 | H19 | 109.5° | 109.5° |
| N31 | C32 | H20 | 109.5° | 109.5° |
| N31 | C32 | H21 | 109.4° | 109.5° |
| C32 | N31 | H31 | 108.3° | 111.0° |
| C28 | C27 | C30 | 120.9° | 119.9° |
| C27 | C28 | H4 | 119.5° | 119.9° |
| C27 | C30 | N31 | 112.8° | 109.5° |
| C27 | C30 | H17 | 108.6° | 109.5° |
| C27 | C30 | H18 | 108.6° | 109.4° |
| N31 | C30 | H17 | 108.6° | 109.5° |
| N31 | C30 | H18 | 108.6° | 109.5° |
| C30 | N31 | H31 | 108.3° | 111.0° |
| H5 | C1 | H6 | 109.5° | 109.4° |
| H5 | C1 | H7 | 109.5° | 109.4° |
| H6 | C1 | H7 | 109.5° | 109.5° |
| H14 | C3 | H15 | 109.5° | 109.5° |
| H14 | C3 | H16 | 109.5° | 109.4° |
| H15 | C3 | H16 | 109.5° | 109.5° |
| H17 | C30 | H18 | 109.5° | 109.4° |
| H19 | C32 | H20 | 109.5° | 109.5° |
| H19 | C32 | H21 | 109.5° | 109.5° |
| H20 | C32 | H21 | 109.5° | 109.5° |
| H33B | N33 | H23 | 109.4° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O5 | S4 | C7 | C8 | 10.0° | 26.4° |
| O5 | S4 | C2 | C7 | 115.4° | 111.7° |
| O5 | S4 | C2 | O6 | 129.3° | 136.7° |
| O5 | S4 | C7 | O6 | 129.0° | 127.9° |
| O5 | S4 | C2 | C3 | 112.1° | 68.4° |
| O5 | S4 | C2 | C1 | 122.7° | 51.6° |
| O5 | S4 | C7 | C12 | 169.3° | 153.9° |
| O5 | S4 | C2 | H11 | 5.5° | 171.7° |
| C9 | C8 | C7 | H1 | 180.0° | 179.9° |
| C9 | C8 | C7 | S4 | 179.3° | 179.8° |
| C8 | C9 | C10 | H22 | 180.0° | 180.0° |
| C9 | C8 | C7 | C12 | 0.1° | 0.1° |
| C8 | C9 | C10 | C13 | 178.9° | 179.9° |
| C8 | C9 | C10 | C11 | 0.1° | 0.0° |
| C8 | C7 | S4 | C2 | 105.5° | 89.7° |
| C8 | C7 | S4 | C12 | 179.3° | 179.7° |
| C8 | C7 | S4 | O6 | 138.9° | 154.2° |
| C7 | C8 | C9 | C10 | 0.0° | 0.0° |
| C8 | C7 | C12 | C11 | 0.1° | 0.0° |
| C8 | C7 | C12 | H9 | 179.9° | 180.0° |
| C7 | C8 | C9 | H22 | 180.0° | 180.0° |
| C2 | S4 | C7 | O6 | 115.5° | 116.1° |
| S4 | C2 | C3 | C1 | 123.5° | 120.0° |
| S4 | C2 | C3 | H11 | 115.8° | 120.0° |
| S4 | C2 | C1 | H11 | 115.3° | 120.0° |
| C2 | S4 | C7 | C12 | 75.2° | 90.0° |
| S4 | C2 | C1 | H5 | 180.0° | 60.0° |
| S4 | C2 | C1 | H6 | 60.0° | 60.0° |
| S4 | C2 | C1 | H7 | 60.0° | 180.0° |
| S4 | C2 | C3 | H14 | 180.0° | 60.1° |
| S4 | C2 | C3 | H15 | 60.0° | 60.0° |
| S4 | C2 | C3 | H16 | 60.0° | 180.0° |
| C7 | S4 | C2 | C3 | 3.3° | 180.0° |
| C7 | S4 | C2 | C1 | 122.0° | 60.0° |
| S4 | C7 | C12 | C11 | 179.4° | 179.7° |
| S4 | C7 | C8 | H1 | 0.6° | 0.3° |
| S4 | C7 | C12 | H9 | 0.6° | 0.3° |
| C7 | S4 | C2 | H11 | 120.9° | 60.0° |
| O6 | S4 | C2 | C3 | 118.6° | 68.3° |
| O6 | S4 | C2 | C1 | 6.6° | 171.6° |
| O6 | S4 | C7 | C12 | 40.4° | 26.1° |
| O6 | S4 | C2 | H11 | 123.8° | 51.6° |
| C3 | C2 | C1 | H11 | 120.7° | 120.0° |
| C3 | C2 | C1 | H5 | 56.1° | 180.0° |
| C3 | C2 | C1 | H6 | 176.0° | 60.0° |
| C3 | C2 | C1 | H7 | 64.0° | 60.0° |
| C2 | C3 | H14 | H15 | 120.0° | 120.1° |
| C2 | C3 | H14 | H16 | 120.0° | 120.0° |
| C2 | C3 | H15 | H16 | 120.0° | 120.0° |
| C2 | C1 | H5 | H6 | 120.0° | 120.0° |
| C2 | C1 | H5 | H7 | 120.0° | 120.1° |
| C2 | C1 | H6 | H7 | 120.0° | 120.1° |
| C1 | C2 | C3 | H14 | 56.5° | 60.0° |
| C1 | C2 | C3 | H15 | 63.5° | 180.0° |
| C1 | C2 | C3 | H16 | 176.5° | 60.0° |
| C9 | C10 | C13 | C14 | 8.3° | 174.8° |
| C9 | C10 | C13 | C11 | 178.9° | 179.9° |
| C9 | C10 | C11 | C12 | 0.0° | 0.1° |
| C9 | C10 | C13 | N18 | 172.5° | 4.9° |
| C10 | C9 | C8 | H1 | 180.0° | 180.0° |
| C9 | C10 | C11 | H8 | 180.0° | 179.9° |
| C7 | C12 | C11 | C10 | 0.1° | 0.1° |
| C7 | C12 | C11 | H9 | 180.0° | 180.0° |
| C12 | C7 | C8 | H1 | 179.9° | 180.0° |
| C7 | C12 | C11 | H8 | 179.9° | 180.0° |
| N15 | C14 | C13 | H10 | 180.0° | 180.0° |
| N15 | C14 | C13 | C10 | 179.1° | 179.9° |
| N15 | C14 | C13 | N18 | 0.1° | 0.3° |
| C14 | N15 | C16 | N33 | 179.0° | 179.8° |
| C14 | N15 | C16 | C17 | 0.0° | 0.3° |
| C14 | C13 | C10 | N18 | 179.2° | 179.7° |
| C14 | C13 | C10 | C11 | 172.8° | 5.3° |
| C13 | C14 | N15 | C16 | 0.0° | 0.0° |
| C14 | C13 | N18 | C17 | 0.2° | 0.3° |
| C13 | C10 | C11 | C12 | 178.9° | 180.0° |
| C10 | C13 | N18 | C17 | 179.1° | 180.0° |
| C13 | C10 | C11 | H8 | 1.0° | 0.0° |
| C10 | C13 | C14 | H10 | 0.9° | 0.0° |
| C13 | C10 | C9 | H22 | 1.2° | 0.0° |
| C10 | C11 | C12 | H8 | 180.0° | 179.9° |
| C11 | C10 | C13 | N18 | 6.4° | 175.0° |
| C10 | C11 | C12 | H9 | 179.9° | 179.9° |
| C11 | C10 | C9 | H22 | 179.9° | 180.0° |
| N15 | C16 | N33 | C17 | 179.0° | 179.9° |
| N15 | C16 | C17 | N18 | 0.0° | 0.3° |
| N15 | C16 | C17 | C19 | 179.2° | 180.0° |
| C16 | N15 | C14 | H10 | 180.0° | 180.0° |
| N15 | C16 | N33 | H33B | 0.0° | 180.0° |
| N15 | C16 | N33 | H23 | 120.0° | 0.1° |
| C13 | N18 | C17 | C16 | 0.1° | 0.1° |
| C13 | N18 | C17 | C19 | 179.5° | 179.7° |
| N18 | C13 | C14 | H10 | 179.9° | 179.7° |
| N33 | C16 | C17 | N18 | 179.0° | 179.8° |
| N33 | C16 | C17 | C19 | 1.8° | 0.0° |
| C16 | N33 | H33B | H23 | 120.0° | 180.0° |
| C16 | C17 | N18 | C19 | 179.3° | 179.8° |
| C16 | C17 | C19 | C20 | 148.0° | 145.0° |
| C16 | C17 | C19 | O23 | 42.6° | 35.0° |
| C17 | C16 | N33 | H33B | 179.0° | 0.0° |
| C17 | C16 | N33 | H23 | 61.1° | 180.0° |
| N18 | C17 | C19 | C20 | 31.2° | 35.2° |
| N18 | C17 | C19 | O23 | 138.1° | 144.8° |
| C17 | C19 | C20 | O23 | 170.0° | 180.0° |
| C17 | C19 | C20 | C21 | 169.8° | 180.0° |
| C17 | C19 | O23 | N22 | 171.4° | 179.7° |
| C17 | C19 | C20 | H2 | 10.3° | 0.2° |
| C19 | C20 | C21 | H2 | 180.0° | 179.8° |
| C20 | C19 | O23 | N22 | 0.1° | 0.3° |
| C19 | C20 | C21 | N22 | 0.3° | 0.2° |
| C19 | C20 | C21 | C24 | 174.3° | 179.7° |
| O23 | C19 | C20 | C21 | 0.3° | 0.0° |
| C19 | O23 | N22 | C21 | 0.1° | 0.5° |
| O23 | C19 | C20 | H2 | 179.7° | 179.7° |
| C20 | C21 | N22 | O23 | 0.2° | 0.4° |
| C20 | C21 | N22 | C24 | 175.1° | 179.9° |
| C20 | C21 | C24 | C25 | 8.7° | 0.2° |
| C20 | C21 | C24 | C29 | 163.5° | 180.0° |
| O23 | N22 | C21 | C24 | 174.8° | 179.5° |
| N22 | C21 | C24 | C25 | 177.2° | 179.7° |
| N22 | C21 | C24 | C29 | 10.7° | 0.0° |
| N22 | C21 | C20 | H2 | 179.6° | 180.0° |
| C21 | C24 | C25 | C29 | 172.3° | 179.8° |
| C21 | C24 | C25 | C26 | 172.0° | 180.0° |
| C21 | C24 | C29 | C28 | 171.9° | 180.0° |
| C24 | C21 | C20 | H2 | 5.8° | 0.1° |
| C21 | C24 | C25 | H12 | 8.0° | 0.0° |
| C21 | C24 | C29 | H13 | 8.1° | 0.0° |
| C24 | C25 | C26 | H12 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 0.0° | 0.0° |
| C25 | C24 | C29 | C28 | 0.4° | 0.2° |
| C24 | C25 | C26 | H3 | 179.9° | 179.7° |
| C25 | C24 | C29 | H13 | 179.6° | 179.8° |
| C26 | C25 | C24 | C29 | 0.3° | 0.2° |
| C25 | C26 | C27 | H3 | 180.0° | 179.7° |
| C25 | C26 | C27 | C28 | 0.4° | 0.3° |
| C25 | C26 | C27 | C30 | 175.6° | 179.7° |
| C24 | C29 | C28 | H13 | 180.0° | 180.0° |
| C24 | C29 | C28 | C27 | 0.0° | 0.0° |
| C24 | C29 | C28 | H4 | 180.0° | 179.7° |
| C29 | C24 | C25 | H12 | 179.7° | 179.8° |
| C26 | C27 | C28 | C29 | 0.4° | 0.3° |
| C26 | C27 | C28 | C30 | 176.0° | 179.9° |
| C26 | C27 | C30 | N31 | 62.4° | 90.0° |
| C26 | C27 | C28 | H4 | 179.6° | 180.0° |
| C27 | C26 | C25 | H12 | 179.9° | 180.0° |
| C26 | C27 | C30 | H17 | 177.0° | 149.9° |
| C26 | C27 | C30 | H18 | 58.1° | 30.0° |
| C29 | C28 | C27 | H4 | 180.0° | 179.7° |
| C29 | C28 | C27 | C30 | 175.6° | 179.7° |
| C32 | N31 | C30 | C27 | 7.0° | 180.0° |
| C32 | N31 | C30 | H31 | 120.7° | 124.0° |
| C32 | N31 | C30 | H17 | 113.5° | 60.0° |
| C32 | N31 | C30 | H18 | 127.5° | 60.0° |
| N31 | C32 | H19 | H20 | 120.0° | 120.0° |
| N31 | C32 | H19 | H21 | 120.0° | 120.0° |
| N31 | C32 | H20 | H21 | 120.0° | 120.0° |
| C28 | C27 | C30 | N31 | 113.4° | 90.1° |
| C28 | C27 | C26 | H3 | 179.6° | 180.0° |
| C27 | C28 | C29 | H13 | 180.0° | 180.0° |
| C28 | C27 | C30 | H17 | 7.1° | 30.0° |
| C28 | C27 | C30 | H18 | 126.1° | 149.9° |
| C27 | C30 | N31 | H17 | 120.5° | 120.0° |
| C27 | C30 | N31 | H18 | 120.5° | 120.0° |
| C30 | C27 | C26 | H3 | 4.4° | 0.0° |
| C30 | C27 | C28 | H4 | 4.4° | 0.0° |
| C27 | C30 | H17 | H18 | 118.4° | 119.9° |
| C27 | C30 | N31 | H31 | 113.7° | 56.0° |
| N31 | C30 | H17 | H18 | 118.5° | 120.0° |
| C30 | N31 | C32 | H19 | 180.0° | 60.0° |
| C30 | N31 | C32 | H20 | 60.0° | 60.0° |
| C30 | N31 | C32 | H21 | 60.0° | 180.0° |
| H1 | C8 | C9 | H22 | 0.0° | 0.0° |
| H3 | C26 | C25 | H12 | 0.1° | 0.3° |
| H4 | C28 | C29 | H13 | 0.0° | 0.3° |
| H5 | C1 | H6 | H7 | 120.0° | 119.9° |
| H5 | C1 | C2 | H11 | 64.7° | 60.0° |
| H6 | C1 | C2 | H11 | 55.3° | 180.0° |
| H7 | C1 | C2 | H11 | 175.3° | 60.0° |
| H8 | C11 | C12 | H9 | 0.1° | 0.0° |
| H11 | C2 | C3 | H14 | 64.2° | 180.0° |
| H11 | C2 | C3 | H15 | 175.8° | 60.0° |
| H11 | C2 | C3 | H16 | 55.8° | 60.1° |
| H14 | C3 | H15 | H16 | 120.0° | 119.9° |
| H17 | C30 | N31 | H31 | 125.8° | 64.0° |
| H18 | C30 | N31 | H31 | 6.8° | 176.0° |
| H19 | C32 | H20 | H21 | 120.0° | 120.0° |
| H19 | C32 | N31 | H31 | 59.3° | 64.0° |
| H20 | C32 | N31 | H31 | 60.7° | 176.0° |
| H21 | C32 | N31 | H31 | 179.3° | 56.0° |
