O3O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | sing | 1.51Å | 1.51Å | |
| N1 | C1 | sing | 1.35Å | 1.33Å | |
| N1 | C3 | sing | 1.47Å | 1.46Å | |
| C1 | O1 | doub | 1.21Å | 1.25Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C6 | C7 | sing | 1.53Å | 1.52Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C20 | N2 | sing | 1.47Å | 1.48Å | |
| C7 | N2 | sing | 1.47Å | 1.48Å | |
| C16 | C17 | sing | 1.53Å | 1.51Å | |
| C16 | C9 | sing | 1.53Å | 1.54Å | |
| C21 | C5 | sing | 1.53Å | 1.53Å | |
| N2 | C8 | sing | 1.35Å | 1.35Å | |
| C5 | C4 | sing | 1.53Å | 1.55Å | |
| C17 | N4 | sing | 1.47Å | 1.47Å | |
| C8 | O2 | doub | 1.21Å | 1.23Å | |
| C8 | C9 | sing | 1.51Å | 1.54Å | |
| C9 | N3 | sing | 1.47Å | 1.47Å | |
| C9 | C19 | sing | 1.53Å | 1.54Å | |
| N4 | C18 | sing | 1.47Å | 1.47Å | |
| N3 | C10 | sing | 1.40Å | 1.38Å | |
| C19 | C18 | sing | 1.53Å | 1.51Å | |
| C10 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.41Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.37Å | Aromatic |
| C13 | CL2 | sing | 1.74Å | 1.74Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | CL1 | sing | 1.80Å | 1.07Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| N1 | H13 | sing | 0.97Å | 1.00Å | |
| N3 | H14 | sing | 0.97Å | 1.00Å | |
| C11 | H15 | sing | 1.08Å | 1.08Å | |
| C12 | H16 | sing | 1.08Å | 1.08Å | |
| C14 | H17 | sing | 1.08Å | 1.08Å | |
| C15 | H18 | sing | 1.08Å | 1.08Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| N4 | H23 | sing | 1.01Å | 1.00Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C20 | H29 | sing | 1.09Å | 1.10Å | |
| C20 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C21 | H32 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | N1 | 117.1° | 120.0° |
| C2 | C1 | O1 | 119.2° | 120.0° |
| C1 | C2 | H1 | 109.5° | 109.5° |
| C1 | C2 | H2 | 109.6° | 109.5° |
| C1 | C2 | CL1 | 109.2° | 109.5° |
| C1 | N1 | C3 | 124.7° | 120.0° |
| N1 | C1 | O1 | 123.7° | 120.0° |
| C1 | N1 | H13 | 117.6° | 120.0° |
| N1 | C3 | C4 | 110.3° | 109.5° |
| N1 | C3 | H4 | 109.3° | 109.5° |
| N1 | C3 | H5 | 109.3° | 109.5° |
| C3 | N1 | H13 | 117.7° | 119.9° |
| C3 | C4 | C5 | 122.0° | 109.4° |
| C4 | C3 | H4 | 109.3° | 109.4° |
| C4 | C3 | H5 | 109.3° | 109.4° |
| C3 | C4 | H6 | 106.3° | 109.5° |
| C3 | C4 | H7 | 106.2° | 109.5° |
| C7 | C6 | C5 | 112.7° | 109.3° |
| C6 | C7 | N2 | 112.9° | 108.8° |
| C7 | C6 | H9 | 108.6° | 109.5° |
| C7 | C6 | H10 | 108.6° | 109.5° |
| C6 | C7 | H11 | 108.6° | 109.5° |
| C6 | C7 | H12 | 108.6° | 109.5° |
| C6 | C5 | C21 | 108.3° | 109.5° |
| C6 | C5 | C4 | 113.4° | 109.4° |
| C6 | C5 | H8 | 105.9° | 109.5° |
| C5 | C6 | H9 | 108.6° | 109.4° |
| C5 | C6 | H10 | 108.7° | 109.5° |
| C21 | C20 | N2 | 112.8° | 108.8° |
| C20 | C21 | C5 | 113.9° | 109.3° |
| C21 | C20 | H29 | 108.6° | 109.6° |
| C21 | C20 | H30 | 108.6° | 109.6° |
| C20 | C21 | H31 | 108.4° | 109.5° |
| C20 | C21 | H32 | 108.4° | 109.5° |
| C20 | N2 | C7 | 112.5° | 118.7° |
| C20 | N2 | C8 | 127.4° | 120.7° |
| N2 | C20 | H29 | 108.6° | 109.6° |
| N2 | C20 | H30 | 108.6° | 109.6° |
| C7 | N2 | C8 | 119.9° | 120.6° |
| N2 | C7 | H11 | 108.6° | 109.6° |
| N2 | C7 | H12 | 108.6° | 109.6° |
| C17 | C16 | C9 | 110.3° | 109.3° |
| C16 | C17 | N4 | 113.7° | 109.5° |
| C17 | C16 | H19 | 109.2° | 109.5° |
| C17 | C16 | H20 | 109.3° | 109.5° |
| C16 | C17 | H21 | 108.4° | 109.5° |
| C16 | C17 | H22 | 108.4° | 109.4° |
| C16 | C9 | C8 | 109.5° | 109.5° |
| C16 | C9 | N3 | 109.2° | 109.5° |
| C16 | C9 | C19 | 108.7° | 109.2° |
| C9 | C16 | H19 | 109.3° | 109.5° |
| C9 | C16 | H20 | 109.3° | 109.5° |
| C21 | C5 | C4 | 117.1° | 109.4° |
| C21 | C5 | H8 | 105.8° | 109.5° |
| C5 | C21 | H31 | 108.4° | 109.6° |
| C5 | C21 | H32 | 108.4° | 109.5° |
| N2 | C8 | O2 | 116.6° | 120.0° |
| N2 | C8 | C9 | 125.3° | 120.0° |
| C5 | C4 | H6 | 106.3° | 109.4° |
| C5 | C4 | H7 | 106.3° | 109.5° |
| C4 | C5 | H8 | 105.6° | 109.5° |
| C17 | N4 | C18 | 112.3° | 111.2° |
| N4 | C17 | H21 | 108.4° | 109.5° |
| N4 | C17 | H22 | 108.4° | 109.5° |
| C17 | N4 | H23 | 108.8° | 111.0° |
| O2 | C8 | C9 | 118.0° | 120.0° |
| C8 | C9 | N3 | 114.4° | 109.5° |
| C8 | C9 | C19 | 108.5° | 109.5° |
| N3 | C9 | C19 | 106.2° | 109.5° |
| C9 | N3 | C10 | 124.1° | 120.0° |
| C9 | N3 | H14 | 105.7° | 120.0° |
| C9 | C19 | C18 | 110.1° | 109.3° |
| C9 | C19 | H27 | 109.3° | 109.5° |
| C9 | C19 | H28 | 109.3° | 109.5° |
| N4 | C18 | C19 | 109.7° | 109.5° |
| C18 | N4 | H23 | 108.8° | 111.0° |
| N4 | C18 | H25 | 109.4° | 109.5° |
| N4 | C18 | H26 | 109.4° | 109.5° |
| N3 | C10 | C15 | 119.1° | 120.1° |
| N3 | C10 | C11 | 122.6° | 120.1° |
| C10 | N3 | H14 | 105.7° | 120.0° |
| C19 | C18 | H25 | 109.4° | 109.5° |
| C19 | C18 | H26 | 109.4° | 109.3° |
| C18 | C19 | H27 | 109.3° | 109.6° |
| C18 | C19 | H28 | 109.3° | 109.4° |
| C15 | C10 | C11 | 118.4° | 119.9° |
| C10 | C15 | C14 | 120.6° | 119.9° |
| C10 | C15 | H18 | 119.7° | 120.0° |
| C10 | C11 | C12 | 120.5° | 119.9° |
| C10 | C11 | H15 | 119.7° | 120.0° |
| C15 | C14 | C13 | 119.5° | 120.1° |
| C15 | C14 | H17 | 120.2° | 120.0° |
| C14 | C15 | H18 | 119.7° | 120.0° |
| C11 | C12 | C13 | 119.6° | 120.1° |
| C12 | C11 | H15 | 119.7° | 120.1° |
| C11 | C12 | H16 | 120.2° | 120.0° |
| C14 | C13 | C12 | 121.4° | 120.1° |
| C14 | C13 | CL2 | 119.7° | 120.0° |
| C13 | C14 | H17 | 120.2° | 120.0° |
| C12 | C13 | CL2 | 118.8° | 119.9° |
| C13 | C12 | H16 | 120.2° | 119.9° |
| H1 | C2 | H2 | 109.5° | 109.5° |
| H1 | C2 | CL1 | 109.5° | 109.4° |
| H2 | C2 | CL1 | 109.5° | 109.5° |
| H4 | C3 | H5 | 109.5° | 109.5° |
| H6 | C4 | H7 | 109.5° | 109.5° |
| H9 | C6 | H10 | 109.5° | 109.5° |
| H11 | C7 | H12 | 109.4° | 109.7° |
| H19 | C16 | H20 | 109.5° | 109.5° |
| H21 | C17 | H22 | 109.5° | 109.5° |
| H25 | C18 | H26 | 109.5° | 109.5° |
| H27 | C19 | H28 | 109.4° | 109.5° |
| H29 | C20 | H30 | 109.5° | 109.7° |
| H31 | C21 | H32 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | N1 | O1 | 178.5° | 179.7° |
| C2 | C1 | N1 | C3 | 179.8° | 179.7° |
| C1 | C2 | H1 | H2 | 120.2° | 120.0° |
| C1 | C2 | H1 | CL1 | 119.7° | 120.0° |
| C1 | C2 | H2 | CL1 | 119.7° | 120.0° |
| C2 | C1 | N1 | H13 | 0.2° | 0.3° |
| C1 | N1 | C3 | H13 | 180.0° | 179.9° |
| C1 | N1 | C3 | C4 | 87.2° | 180.0° |
| N1 | C1 | C2 | H1 | 119.1° | 60.3° |
| N1 | C1 | C2 | H2 | 1.0° | 59.7° |
| N1 | C1 | C2 | CL1 | 120.9° | 179.7° |
| C1 | N1 | C3 | H4 | 152.7° | 60.0° |
| C1 | N1 | C3 | H5 | 32.9° | 60.1° |
| C3 | N1 | C1 | O1 | 1.3° | 0.0° |
| N1 | C3 | C4 | H4 | 120.1° | 120.0° |
| N1 | C3 | C4 | H5 | 120.1° | 120.0° |
| N1 | C3 | C4 | C5 | 104.4° | 180.0° |
| N1 | C3 | H4 | H5 | 119.6° | 120.1° |
| N1 | C3 | C4 | H6 | 133.9° | 60.1° |
| N1 | C3 | C4 | H7 | 17.3° | 60.0° |
| O1 | C1 | C2 | H1 | 59.4° | 120.0° |
| O1 | C1 | C2 | H2 | 179.5° | 120.0° |
| O1 | C1 | C2 | CL1 | 60.5° | 0.0° |
| O1 | C1 | N1 | H13 | 178.6° | 179.9° |
| C3 | C4 | C5 | C6 | 89.9° | 175.0° |
| C3 | C4 | C5 | C21 | 37.3° | 65.0° |
| C3 | C4 | C5 | H6 | 121.7° | 119.9° |
| C3 | C4 | C5 | H7 | 121.7° | 120.0° |
| C4 | C3 | H4 | H5 | 119.6° | 120.0° |
| C3 | C4 | H6 | H7 | 114.3° | 120.1° |
| C3 | C4 | C5 | H8 | 154.6° | 55.0° |
| C4 | C3 | N1 | H13 | 92.8° | 0.0° |
| C7 | C6 | C5 | H9 | 120.5° | 120.0° |
| C7 | C6 | C5 | H10 | 120.5° | 119.9° |
| C6 | C7 | N2 | C20 | 25.6° | 53.6° |
| C6 | C7 | N2 | H11 | 120.5° | 119.8° |
| C6 | C7 | N2 | H12 | 120.5° | 119.7° |
| C7 | C6 | C5 | C21 | 61.6° | 61.4° |
| C6 | C7 | N2 | C8 | 158.8° | 126.4° |
| C7 | C6 | C5 | C4 | 166.8° | 178.7° |
| C7 | C6 | C5 | H8 | 51.5° | 58.6° |
| C7 | C6 | H9 | H10 | 118.5° | 120.1° |
| C6 | C7 | H11 | H12 | 118.4° | 120.3° |
| C6 | C5 | C21 | C20 | 27.1° | 61.4° |
| C5 | C6 | C7 | N2 | 34.8° | 54.7° |
| C6 | C5 | C21 | C4 | 129.7° | 120.0° |
| C6 | C5 | C21 | H8 | 113.1° | 120.0° |
| C6 | C5 | C4 | H8 | 115.5° | 120.0° |
| C6 | C5 | C4 | H6 | 148.3° | 55.0° |
| C6 | C5 | C4 | H7 | 31.8° | 65.0° |
| C5 | C6 | H9 | H10 | 118.5° | 120.0° |
| C5 | C6 | C7 | H11 | 85.7° | 65.2° |
| C5 | C6 | C7 | H12 | 155.3° | 174.4° |
| C6 | C5 | C21 | H31 | 147.8° | 58.6° |
| C6 | C5 | C21 | H32 | 93.5° | 178.7° |
| C21 | C20 | N2 | H29 | 120.5° | 119.8° |
| C21 | C20 | N2 | H30 | 120.5° | 119.8° |
| C21 | C20 | N2 | C7 | 60.2° | 53.6° |
| C20 | C21 | C5 | H31 | 120.7° | 120.0° |
| C20 | C21 | C5 | H32 | 120.7° | 119.9° |
| C21 | C20 | N2 | C8 | 124.6° | 126.4° |
| C20 | C21 | C5 | C4 | 156.8° | 178.7° |
| C20 | C21 | C5 | H8 | 86.0° | 58.6° |
| C21 | C20 | H29 | H30 | 118.5° | 120.3° |
| C20 | C21 | H31 | H32 | 118.0° | 120.1° |
| C20 | N2 | C7 | C8 | 175.6° | 180.0° |
| N2 | C20 | C21 | C5 | 31.0° | 54.7° |
| C20 | N2 | C8 | O2 | 169.9° | 174.4° |
| C20 | N2 | C8 | C9 | 10.7° | 5.6° |
| C20 | N2 | C7 | H11 | 146.1° | 66.2° |
| C20 | N2 | C7 | H12 | 94.9° | 173.3° |
| N2 | C20 | H29 | H30 | 118.4° | 120.3° |
| N2 | C20 | C21 | H31 | 89.7° | 65.3° |
| N2 | C20 | C21 | H32 | 151.6° | 174.6° |
| C7 | N2 | C8 | O2 | 5.0° | 5.6° |
| C7 | N2 | C8 | C9 | 174.4° | 174.4° |
| N2 | C7 | C6 | H9 | 85.7° | 174.6° |
| N2 | C7 | C6 | H10 | 155.3° | 65.3° |
| N2 | C7 | H11 | H12 | 118.4° | 120.4° |
| C7 | N2 | C20 | H29 | 60.3° | 66.2° |
| C7 | N2 | C20 | H30 | 179.3° | 173.4° |
| C17 | C16 | C9 | H19 | 120.1° | 119.9° |
| C17 | C16 | C9 | H20 | 120.1° | 120.0° |
| C16 | C17 | N4 | H21 | 120.6° | 120.0° |
| C16 | C17 | N4 | H22 | 120.6° | 119.9° |
| C17 | C16 | C9 | C8 | 172.1° | 177.5° |
| C17 | C16 | C9 | N3 | 61.9° | 62.3° |
| C17 | C16 | C9 | C19 | 53.6° | 57.6° |
| C16 | C17 | N4 | C18 | 54.8° | 61.7° |
| C17 | C16 | H19 | H20 | 119.6° | 120.1° |
| C16 | C17 | H21 | H22 | 118.1° | 120.0° |
| C16 | C17 | N4 | H23 | 65.7° | 62.4° |
| C16 | C9 | C8 | N2 | 70.8° | 164.9° |
| C9 | C16 | C17 | N4 | 52.4° | 59.2° |
| C16 | C9 | C8 | O2 | 109.9° | 15.1° |
| C16 | C9 | C8 | N3 | 123.0° | 120.1° |
| C16 | C9 | C8 | C19 | 118.5° | 119.8° |
| C16 | C9 | N3 | C19 | 117.1° | 119.7° |
| C16 | C9 | N3 | C10 | 155.2° | 65.6° |
| C16 | C9 | C19 | C18 | 58.9° | 57.5° |
| C16 | C9 | N3 | H14 | 82.8° | 114.5° |
| C9 | C16 | H19 | H20 | 119.6° | 120.1° |
| C9 | C16 | C17 | H21 | 173.0° | 179.2° |
| C9 | C16 | C17 | H22 | 68.2° | 60.8° |
| C16 | C9 | C19 | H27 | 179.0° | 177.6° |
| C16 | C9 | C19 | H28 | 61.2° | 62.3° |
| C21 | C5 | C4 | H8 | 117.3° | 120.0° |
| C21 | C5 | C4 | H6 | 84.4° | 175.0° |
| C21 | C5 | C4 | H7 | 159.0° | 55.0° |
| C21 | C5 | C6 | H9 | 58.9° | 178.6° |
| C21 | C5 | C6 | H10 | 177.9° | 58.6° |
| C5 | C21 | C20 | H29 | 89.5° | 65.1° |
| C5 | C21 | C20 | H30 | 151.4° | 174.5° |
| C5 | C21 | H31 | H32 | 118.0° | 120.1° |
| N2 | C8 | O2 | C9 | 179.4° | 180.0° |
| N2 | C8 | C9 | N3 | 52.3° | 44.8° |
| N2 | C8 | C9 | C19 | 170.7° | 75.4° |
| C8 | N2 | C7 | H11 | 38.3° | 113.9° |
| C8 | N2 | C7 | H12 | 80.7° | 6.6° |
| C8 | N2 | C20 | H29 | 114.9° | 113.8° |
| C8 | N2 | C20 | H30 | 4.1° | 6.5° |
| C5 | C4 | C3 | H4 | 15.7° | 60.0° |
| C5 | C4 | C3 | H5 | 135.5° | 60.1° |
| C5 | C4 | H6 | H7 | 114.4° | 120.0° |
| C4 | C5 | C6 | H9 | 72.8° | 58.7° |
| C4 | C5 | C6 | H10 | 46.3° | 61.4° |
| C4 | C5 | C21 | H31 | 82.5° | 61.4° |
| C4 | C5 | C21 | H32 | 36.1° | 58.7° |
| C17 | N4 | C18 | H23 | 120.4° | 124.2° |
| C17 | N4 | C18 | C19 | 58.0° | 61.7° |
| N4 | C17 | C16 | H19 | 172.5° | 60.8° |
| N4 | C17 | C16 | H20 | 67.8° | 179.2° |
| N4 | C17 | H21 | H22 | 118.1° | 120.0° |
| C17 | N4 | C18 | H25 | 178.0° | 178.2° |
| C17 | N4 | C18 | H26 | 62.0° | 58.2° |
| O2 | C8 | C9 | N3 | 127.1° | 135.2° |
| O2 | C8 | C9 | C19 | 8.7° | 104.6° |
| C8 | C9 | N3 | C19 | 119.7° | 120.1° |
| C8 | C9 | N3 | C10 | 32.0° | 54.5° |
| C8 | C9 | C19 | C18 | 178.0° | 177.5° |
| C8 | C9 | N3 | H14 | 154.0° | 125.4° |
| C8 | C9 | C16 | H19 | 67.9° | 57.6° |
| C8 | C9 | C16 | H20 | 51.9° | 62.5° |
| C8 | C9 | C19 | H27 | 61.9° | 62.5° |
| C8 | C9 | C19 | H28 | 57.8° | 57.6° |
| C9 | N3 | C10 | H14 | 122.0° | 180.0° |
| N3 | C9 | C19 | C18 | 58.6° | 62.4° |
| C9 | N3 | C10 | C15 | 159.0° | 179.0° |
| C9 | N3 | C10 | C11 | 19.2° | 1.2° |
| N3 | C9 | C16 | H19 | 58.2° | 177.7° |
| N3 | C9 | C16 | H20 | 177.9° | 57.7° |
| N3 | C9 | C19 | H27 | 61.5° | 57.6° |
| N3 | C9 | C19 | H28 | 178.7° | 177.8° |
| C9 | C19 | C18 | N4 | 60.8° | 59.1° |
| C19 | C9 | N3 | C10 | 87.7° | 174.7° |
| C9 | C19 | C18 | H27 | 120.1° | 120.0° |
| C9 | C19 | C18 | H28 | 120.1° | 119.9° |
| C19 | C9 | N3 | H14 | 34.3° | 5.3° |
| C19 | C9 | C16 | H19 | 173.7° | 62.3° |
| C19 | C9 | C16 | H20 | 66.5° | 177.6° |
| C9 | C19 | C18 | H25 | 179.1° | 179.1° |
| C9 | C19 | C18 | H26 | 59.2° | 60.9° |
| C9 | C19 | H27 | H28 | 119.7° | 120.1° |
| N4 | C18 | C19 | H25 | 120.0° | 120.1° |
| N4 | C18 | C19 | H26 | 120.0° | 120.0° |
| C18 | N4 | C17 | H21 | 175.4° | 178.2° |
| C18 | N4 | C17 | H22 | 65.8° | 58.2° |
| N4 | C18 | H25 | H26 | 119.9° | 120.0° |
| N4 | C18 | C19 | H27 | 179.1° | 179.0° |
| N4 | C18 | C19 | H28 | 59.3° | 60.8° |
| N3 | C10 | C15 | C11 | 178.2° | 179.8° |
| N3 | C10 | C15 | C14 | 178.8° | 179.7° |
| N3 | C10 | C11 | C12 | 178.9° | 180.0° |
| N3 | C10 | C11 | H15 | 1.1° | 0.0° |
| N3 | C10 | C15 | H18 | 1.2° | 0.1° |
| C19 | C18 | N4 | H23 | 62.4° | 62.5° |
| C19 | C18 | H25 | H26 | 119.9° | 119.9° |
| C18 | C19 | H27 | H28 | 119.7° | 120.1° |
| C10 | C15 | C14 | H18 | 180.0° | 179.8° |
| C15 | C10 | C11 | C12 | 0.7° | 0.2° |
| C10 | C15 | C14 | C13 | 0.2° | 0.5° |
| C15 | C10 | N3 | H14 | 79.0° | 1.1° |
| C15 | C10 | C11 | H15 | 179.3° | 179.8° |
| C10 | C15 | C14 | H17 | 179.7° | 179.7° |
| C11 | C10 | C15 | C14 | 0.6° | 0.5° |
| C10 | C11 | C12 | H15 | 180.0° | 179.9° |
| C10 | C11 | C12 | C13 | 0.5° | 0.0° |
| C11 | C10 | N3 | H14 | 102.8° | 178.7° |
| C10 | C11 | C12 | H16 | 179.4° | 180.0° |
| C11 | C10 | C15 | H18 | 179.4° | 179.7° |
| C15 | C14 | C13 | H17 | 180.0° | 179.8° |
| C15 | C14 | C13 | C12 | 0.1° | 0.2° |
| C15 | C14 | C13 | CL2 | 179.0° | 179.8° |
| C11 | C12 | C13 | C14 | 0.2° | 0.0° |
| C11 | C12 | C13 | H16 | 180.0° | 180.0° |
| C11 | C12 | C13 | CL2 | 178.8° | 180.0° |
| C14 | C13 | C12 | CL2 | 179.0° | 180.0° |
| C14 | C13 | C12 | H16 | 179.8° | 180.0° |
| C13 | C14 | C15 | H18 | 179.7° | 179.7° |
| C13 | C12 | C11 | H15 | 179.5° | 180.0° |
| C12 | C13 | C14 | H17 | 179.9° | 180.0° |
| CL2 | C13 | C12 | H16 | 1.2° | 0.0° |
| CL2 | C13 | C14 | H17 | 1.0° | 0.0° |
| H1 | C2 | H2 | CL1 | 120.1° | 119.9° |
| H4 | C3 | C4 | H6 | 106.0° | 59.9° |
| H4 | C3 | C4 | H7 | 137.5° | 180.0° |
| H4 | C3 | N1 | H13 | 27.3° | 120.0° |
| H5 | C3 | C4 | H6 | 13.7° | 180.0° |
| H5 | C3 | C4 | H7 | 102.8° | 60.0° |
| H5 | C3 | N1 | H13 | 147.1° | 119.9° |
| H6 | C4 | C5 | H8 | 32.9° | 65.0° |
| H7 | C4 | C5 | H8 | 83.7° | 175.0° |
| H8 | C5 | C6 | H9 | 171.9° | 61.3° |
| H8 | C5 | C6 | H10 | 69.0° | 178.6° |
| H8 | C5 | C21 | H31 | 34.7° | 178.6° |
| H8 | C5 | C21 | H32 | 153.4° | 61.3° |
| H9 | C6 | C7 | H11 | 153.8° | 54.7° |
| H9 | C6 | C7 | H12 | 34.8° | 65.7° |
| H10 | C6 | C7 | H11 | 34.8° | 174.9° |
| H10 | C6 | C7 | H12 | 84.2° | 54.5° |
| H15 | C11 | C12 | H16 | 0.6° | 0.1° |
| H17 | C14 | C15 | H18 | 0.3° | 0.1° |
| H19 | C16 | C17 | H21 | 66.9° | 59.2° |
| H19 | C16 | C17 | H22 | 51.9° | 179.3° |
| H20 | C16 | C17 | H21 | 52.8° | 60.8° |
| H20 | C16 | C17 | H22 | 171.6° | 59.2° |
| H21 | C17 | N4 | H23 | 55.0° | 57.6° |
| H22 | C17 | N4 | H23 | 173.7° | 177.6° |
| H23 | N4 | C18 | H25 | 57.6° | 57.6° |
| H23 | N4 | C18 | H26 | 177.6° | 177.7° |
| H25 | C18 | C19 | H27 | 59.0° | 60.9° |
| H25 | C18 | C19 | H28 | 60.8° | 59.2° |
| H26 | C18 | C19 | H27 | 61.0° | 59.1° |
| H26 | C18 | C19 | H28 | 179.3° | 179.2° |
| H29 | C20 | C21 | H31 | 149.8° | 174.8° |
| H29 | C20 | C21 | H32 | 31.1° | 54.8° |
| H30 | C20 | C21 | H31 | 30.8° | 54.5° |
| H30 | C20 | C21 | H32 | 87.9° | 65.6° |
