U9K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N4 | C18 | sing | 1.47Å | 1.49Å | |
| C18 | C17 | sing | 1.53Å | 1.52Å | |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | C7 | sing | 1.39Å | 1.37Å | Aromatic |
| C15 | C14 | sing | 1.53Å | 1.56Å | |
| F1 | C7 | sing | 1.35Å | 1.36Å | |
| C9 | C10 | sing | 1.38Å | 1.40Å | Aromatic |
| C7 | C6 | doub | 1.38Å | 1.37Å | Aromatic |
| O2 | P1 | doub | 1.48Å | 1.48Å | |
| O3 | C19 | doub | 1.21Å | 1.21Å | |
| C14 | P1 | sing | 1.83Å | 1.83Å | |
| C14 | C19 | sing | 1.51Å | 1.54Å | |
| C14 | C20 | sing | 1.54Å | 1.54Å | |
| C10 | C11 | sing | 1.51Å | 1.52Å | |
| C10 | C5 | doub | 1.40Å | 1.41Å | Aromatic |
| C13 | P1 | sing | 1.83Å | 1.81Å | |
| C13 | C12 | sing | 1.54Å | 1.53Å | |
| P1 | O1 | sing | 1.61Å | 1.47Å | |
| N3 | C20 | sing | 1.46Å | 1.50Å | |
| N3 | C11 | sing | 1.47Å | 1.52Å | |
| N3 | C12 | sing | 1.46Å | 1.50Å | |
| C19 | O4 | sing | 1.34Å | 1.23Å | |
| C6 | C5 | sing | 1.40Å | 1.41Å | Aromatic |
| C5 | C4 | sing | 1.48Å | 1.48Å | |
| C4 | C3 | doub | 1.36Å | 1.37Å | Aromatic |
| C4 | N1 | sing | 1.38Å | 1.40Å | Aromatic |
| C1 | N1 | sing | 1.47Å | 1.46Å | |
| C3 | N2 | sing | 1.34Å | 1.37Å | Aromatic |
| N1 | C2 | sing | 1.35Å | 1.36Å | Aromatic |
| N2 | C2 | doub | 1.31Å | 1.32Å | Aromatic |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| N4 | H24 | sing | 1.01Å | 1.00Å | |
| N4 | H25 | sing | 1.01Å | 1.00Å | |
| N4 | H26 | sing | 1.01Å | 1.00Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C9 | H8 | sing | 1.08Å | 1.08Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H7 | sing | 1.08Å | 1.08Å | |
| N3 | H11 | sing | 1.01Å | 1.00Å | |
| O1 | H29 | sing | 0.97Å | 0.95Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| O4 | H30 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N4 | C18 | C17 | 112.8° | 109.5° |
| C18 | N4 | H24 | 109.5° | 109.4° |
| C18 | N4 | H25 | 109.5° | 109.5° |
| C18 | N4 | H26 | 109.5° | 109.5° |
| N4 | C18 | H23 | 108.6° | 109.5° |
| N4 | C18 | H22 | 108.7° | 109.5° |
| C18 | C17 | C16 | 111.3° | 109.4° |
| C17 | C18 | H23 | 108.6° | 109.4° |
| C17 | C18 | H22 | 108.6° | 109.5° |
| C18 | C17 | H21 | 109.0° | 109.5° |
| C18 | C17 | H20 | 109.0° | 109.4° |
| C17 | C16 | C15 | 115.1° | 109.4° |
| C17 | C16 | H19 | 108.0° | 109.5° |
| C17 | C16 | H18 | 108.0° | 109.5° |
| C16 | C17 | H21 | 109.0° | 109.5° |
| C16 | C17 | H20 | 109.0° | 109.5° |
| C16 | C15 | C14 | 118.8° | 109.5° |
| C16 | C15 | H17 | 107.1° | 109.5° |
| C16 | C15 | H16 | 107.1° | 109.5° |
| C15 | C16 | H19 | 108.0° | 109.5° |
| C15 | C16 | H18 | 108.1° | 109.4° |
| C9 | C8 | C7 | 118.3° | 120.3° |
| C8 | C9 | C10 | 121.8° | 120.2° |
| C8 | C9 | H8 | 119.1° | 120.0° |
| C9 | C8 | H7 | 120.9° | 119.8° |
| C8 | C7 | F1 | 119.4° | 120.0° |
| C8 | C7 | C6 | 122.3° | 120.1° |
| C7 | C8 | H7 | 120.9° | 119.9° |
| C15 | C14 | P1 | 113.4° | 109.9° |
| C15 | C14 | C19 | 106.9° | 109.9° |
| C15 | C14 | C20 | 110.7° | 110.0° |
| C14 | C15 | H17 | 107.1° | 109.5° |
| C14 | C15 | H16 | 107.1° | 109.5° |
| F1 | C7 | C6 | 118.3° | 119.9° |
| C9 | C10 | C11 | 119.9° | 120.1° |
| C9 | C10 | C5 | 118.4° | 119.9° |
| C10 | C9 | H8 | 119.1° | 119.8° |
| C7 | C6 | C5 | 120.0° | 119.8° |
| C7 | C6 | H6 | 120.0° | 120.2° |
| O2 | P1 | C14 | 112.5° | 110.0° |
| O2 | P1 | C13 | 108.8° | 110.0° |
| O2 | P1 | O1 | 120.2° | 110.0° |
| O3 | C19 | C14 | 119.2° | 120.0° |
| O3 | C19 | O4 | 122.1° | 120.0° |
| P1 | C14 | C19 | 106.4° | 109.9° |
| P1 | C14 | C20 | 112.3° | 107.1° |
| C14 | P1 | C13 | 99.6° | 106.8° |
| C14 | P1 | O1 | 108.3° | 110.0° |
| C19 | C14 | C20 | 106.7° | 109.9° |
| C14 | C19 | O4 | 118.6° | 120.0° |
| C14 | C20 | N3 | 112.0° | 109.6° |
| C14 | C20 | H28 | 108.8° | 109.5° |
| C14 | C20 | H27 | 108.8° | 109.4° |
| C11 | C10 | C5 | 121.6° | 120.0° |
| C10 | C11 | N3 | 113.8° | 109.5° |
| C10 | C11 | H9 | 108.4° | 109.5° |
| C10 | C11 | H10 | 108.4° | 109.5° |
| C10 | C5 | C6 | 119.1° | 119.7° |
| C10 | C5 | C4 | 121.7° | 120.2° |
| P1 | C13 | C12 | 117.8° | 107.1° |
| C13 | P1 | O1 | 105.2° | 110.0° |
| P1 | C13 | H15 | 107.3° | 109.9° |
| P1 | C13 | H14 | 107.3° | 109.9° |
| C13 | C12 | N3 | 111.3° | 109.6° |
| C13 | C12 | H12 | 109.0° | 109.5° |
| C13 | C12 | H13 | 109.0° | 109.4° |
| C12 | C13 | H15 | 107.3° | 109.9° |
| C12 | C13 | H14 | 107.4° | 109.9° |
| P1 | O1 | H29 | 109.5° | 114.0° |
| C20 | N3 | C11 | 112.9° | 109.0° |
| C20 | N3 | C12 | 109.7° | 111.8° |
| N3 | C20 | H28 | 108.8° | 109.4° |
| N3 | C20 | H27 | 108.8° | 109.5° |
| C20 | N3 | H11 | 107.1° | 109.0° |
| C11 | N3 | C12 | 112.9° | 109.0° |
| N3 | C11 | H9 | 108.4° | 109.5° |
| N3 | C11 | H10 | 108.4° | 109.4° |
| C11 | N3 | H11 | 106.8° | 108.9° |
| N3 | C12 | H12 | 109.0° | 109.5° |
| N3 | C12 | H13 | 109.0° | 109.4° |
| C12 | N3 | H11 | 107.0° | 109.0° |
| C19 | O4 | H30 | 109.5° | 117.0° |
| C6 | C5 | C4 | 119.1° | 120.1° |
| C5 | C6 | H6 | 120.0° | 120.0° |
| C5 | C4 | C3 | 128.8° | 126.7° |
| C5 | C4 | N1 | 125.5° | 126.8° |
| C3 | C4 | N1 | 105.5° | 106.5° |
| C4 | C3 | N2 | 110.3° | 107.9° |
| C4 | C3 | H5 | 124.9° | 126.1° |
| C4 | N1 | C1 | 126.4° | 126.5° |
| C4 | N1 | C2 | 106.2° | 107.1° |
| C1 | N1 | C2 | 127.3° | 126.4° |
| N1 | C1 | H1 | 109.5° | 109.4° |
| N1 | C1 | H2 | 109.5° | 109.4° |
| N1 | C1 | H3 | 109.4° | 109.5° |
| C3 | N2 | C2 | 105.9° | 109.5° |
| N2 | C3 | H5 | 124.8° | 126.0° |
| N1 | C2 | N2 | 112.0° | 109.0° |
| N1 | C2 | H4 | 124.0° | 125.5° |
| N2 | C2 | H4 | 124.0° | 125.5° |
| H24 | N4 | H25 | 109.4° | 109.5° |
| H24 | N4 | H26 | 109.5° | 109.4° |
| H25 | N4 | H26 | 109.4° | 109.5° |
| H9 | C11 | H10 | 109.5° | 109.4° |
| H12 | C12 | H13 | 109.5° | 109.5° |
| H15 | C13 | H14 | 109.5° | 110.0° |
| H17 | C15 | H16 | 109.5° | 109.5° |
| H19 | C16 | H18 | 109.5° | 109.5° |
| H23 | C18 | H22 | 109.5° | 109.5° |
| H28 | C20 | H27 | 109.5° | 109.4° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.4° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H21 | C17 | H20 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N4 | C18 | C17 | H23 | 120.5° | 120.0° |
| N4 | C18 | C17 | H22 | 120.5° | 120.0° |
| N4 | C18 | C17 | C16 | 77.6° | 180.0° |
| C18 | N4 | H24 | H25 | 120.0° | 120.0° |
| C18 | N4 | H24 | H26 | 120.0° | 119.9° |
| C18 | N4 | H25 | H26 | 120.0° | 120.0° |
| N4 | C18 | H23 | H22 | 118.5° | 120.0° |
| N4 | C18 | C17 | H21 | 162.1° | 60.0° |
| N4 | C18 | C17 | H20 | 42.6° | 60.0° |
| C18 | C17 | C16 | H21 | 120.3° | 120.0° |
| C18 | C17 | C16 | H20 | 120.3° | 120.0° |
| C18 | C17 | C16 | C15 | 148.2° | 180.0° |
| C17 | C18 | N4 | H24 | 180.0° | 179.9° |
| C17 | C18 | N4 | H25 | 60.0° | 60.0° |
| C17 | C18 | N4 | H26 | 60.0° | 60.0° |
| C18 | C17 | C16 | H19 | 27.4° | 60.0° |
| C18 | C17 | C16 | H18 | 90.9° | 60.0° |
| C17 | C18 | H23 | H22 | 118.5° | 120.0° |
| C18 | C17 | H21 | H20 | 119.2° | 120.0° |
| C17 | C16 | C15 | H19 | 120.8° | 120.0° |
| C17 | C16 | C15 | H18 | 120.8° | 120.0° |
| C17 | C16 | C15 | C14 | 151.2° | 175.0° |
| C17 | C16 | C15 | H17 | 29.8° | 65.0° |
| C17 | C16 | C15 | H16 | 87.5° | 55.0° |
| C17 | C16 | H19 | H18 | 117.4° | 120.1° |
| C16 | C17 | C18 | H23 | 42.8° | 60.0° |
| C16 | C17 | C18 | H22 | 161.8° | 60.0° |
| C16 | C17 | H21 | H20 | 119.1° | 120.1° |
| C16 | C15 | C14 | H17 | 121.3° | 120.0° |
| C16 | C15 | C14 | H16 | 121.3° | 120.0° |
| C16 | C15 | C14 | P1 | 167.3° | 67.1° |
| C16 | C15 | C14 | C19 | 50.4° | 54.1° |
| C16 | C15 | C14 | C20 | 65.5° | 175.2° |
| C16 | C15 | H17 | H16 | 115.8° | 120.0° |
| C15 | C16 | H19 | H18 | 117.4° | 120.0° |
| C15 | C16 | C17 | H21 | 91.5° | 60.0° |
| C15 | C16 | C17 | H20 | 27.9° | 60.0° |
| C9 | C8 | C7 | H7 | 180.0° | 179.8° |
| C9 | C8 | C7 | F1 | 180.0° | 180.0° |
| C8 | C9 | C10 | H8 | 180.0° | 179.5° |
| C9 | C8 | C7 | C6 | 0.9° | 0.0° |
| C8 | C9 | C10 | C11 | 179.0° | 179.5° |
| C8 | C9 | C10 | C5 | 0.9° | 0.5° |
| C8 | C7 | F1 | C6 | 179.1° | 180.0° |
| C7 | C8 | C9 | C10 | 1.0° | 0.2° |
| C8 | C7 | C6 | C5 | 0.7° | 0.0° |
| C8 | C7 | C6 | H6 | 179.3° | 179.7° |
| C7 | C8 | C9 | H8 | 179.0° | 179.7° |
| C15 | C14 | P1 | O2 | 32.0° | 44.4° |
| C15 | C14 | C19 | O3 | 44.8° | 93.9° |
| C15 | C14 | P1 | C19 | 117.3° | 121.1° |
| C15 | C14 | P1 | C20 | 126.4° | 119.5° |
| C15 | C14 | C19 | C20 | 118.5° | 121.2° |
| C15 | C14 | P1 | C13 | 83.1° | 74.9° |
| C15 | C14 | P1 | O1 | 167.3° | 165.8° |
| C15 | C14 | C20 | N3 | 65.3° | 60.5° |
| C15 | C14 | C19 | O4 | 137.3° | 86.1° |
| C14 | C15 | H17 | H16 | 115.8° | 120.0° |
| C14 | C15 | C16 | H19 | 88.0° | 55.0° |
| C14 | C15 | C16 | H18 | 30.3° | 65.0° |
| C15 | C14 | C20 | H28 | 174.3° | 179.5° |
| C15 | C14 | C20 | H27 | 55.0° | 59.5° |
| F1 | C7 | C6 | C5 | 179.8° | 180.0° |
| F1 | C7 | C6 | H6 | 0.2° | 0.3° |
| F1 | C7 | C8 | H7 | 0.0° | 0.3° |
| C9 | C10 | C11 | C5 | 178.0° | 180.0° |
| C9 | C10 | C11 | N3 | 66.3° | 105.2° |
| C9 | C10 | C5 | C6 | 0.6° | 0.5° |
| C9 | C10 | C5 | C4 | 177.5° | 179.5° |
| C9 | C10 | C11 | H9 | 173.1° | 134.7° |
| C9 | C10 | C11 | H10 | 54.4° | 14.7° |
| C10 | C9 | C8 | H7 | 179.0° | 180.0° |
| C7 | C6 | C5 | C10 | 0.5° | 0.2° |
| C7 | C6 | C5 | H6 | 180.0° | 179.7° |
| C7 | C6 | C5 | C4 | 177.6° | 179.8° |
| C6 | C7 | C8 | H7 | 179.1° | 179.7° |
| O2 | P1 | C14 | C13 | 115.1° | 119.3° |
| O2 | P1 | C14 | O1 | 135.3° | 121.3° |
| O2 | P1 | C14 | C19 | 85.2° | 76.7° |
| O2 | P1 | C14 | C20 | 158.4° | 163.9° |
| O2 | P1 | C13 | O1 | 129.9° | 121.3° |
| O2 | P1 | C13 | C12 | 159.2° | 163.9° |
| O2 | P1 | C13 | H15 | 38.1° | 76.7° |
| O2 | P1 | C13 | H14 | 79.6° | 44.6° |
| O2 | P1 | O1 | H29 | 0.0° | 61.3° |
| O3 | C19 | C14 | P1 | 76.7° | 145.0° |
| O3 | C19 | C14 | O4 | 177.9° | 180.0° |
| O3 | C19 | C14 | C20 | 163.3° | 27.3° |
| O3 | C19 | O4 | H30 | 0.0° | 0.0° |
| P1 | C14 | C19 | C20 | 120.0° | 117.7° |
| C14 | P1 | C13 | O1 | 112.1° | 119.3° |
| C14 | P1 | C13 | C12 | 41.3° | 44.6° |
| P1 | C14 | C20 | N3 | 62.5° | 58.9° |
| P1 | C14 | C19 | O4 | 101.2° | 35.0° |
| C14 | P1 | C13 | H15 | 79.9° | 164.0° |
| C14 | P1 | C13 | H14 | 162.5° | 74.7° |
| P1 | C14 | C15 | H17 | 71.3° | 53.0° |
| P1 | C14 | C15 | H16 | 46.0° | 173.0° |
| P1 | C14 | C20 | H28 | 57.9° | 61.1° |
| P1 | C14 | C20 | H27 | 177.1° | 179.0° |
| C14 | P1 | O1 | H29 | 131.3° | 177.3° |
| C19 | C14 | P1 | C13 | 159.6° | 164.0° |
| C19 | C14 | P1 | O1 | 50.0° | 44.7° |
| C19 | C14 | C20 | N3 | 178.7° | 178.4° |
| C19 | C14 | C15 | H17 | 171.7° | 174.1° |
| C19 | C14 | C15 | H16 | 70.9° | 65.9° |
| C19 | C14 | C20 | H28 | 58.3° | 58.3° |
| C19 | C14 | C20 | H27 | 61.0° | 61.6° |
| C14 | C19 | O4 | H30 | 177.8° | 180.0° |
| C20 | C14 | P1 | C13 | 43.3° | 44.6° |
| C20 | C14 | P1 | O1 | 66.3° | 74.7° |
| C14 | C20 | N3 | H28 | 120.4° | 120.1° |
| C14 | C20 | N3 | H27 | 120.4° | 120.0° |
| C14 | C20 | N3 | C11 | 161.2° | 161.2° |
| C14 | C20 | N3 | C12 | 71.9° | 78.1° |
| C20 | C14 | C19 | O4 | 18.8° | 152.7° |
| C20 | C14 | C15 | H17 | 55.9° | 64.8° |
| C20 | C14 | C15 | H16 | 173.2° | 55.2° |
| C14 | C20 | H28 | H27 | 118.9° | 119.9° |
| C14 | C20 | N3 | H11 | 43.9° | 42.4° |
| C10 | C11 | N3 | C20 | 53.5° | 174.5° |
| C10 | C11 | N3 | H9 | 120.7° | 120.1° |
| C10 | C11 | N3 | H10 | 120.7° | 120.0° |
| C10 | C11 | N3 | C12 | 178.6° | 63.1° |
| C11 | C10 | C5 | C6 | 178.6° | 179.5° |
| C11 | C10 | C5 | C4 | 0.6° | 0.5° |
| C11 | C10 | C9 | H8 | 1.0° | 0.0° |
| C10 | C11 | H9 | H10 | 118.0° | 120.0° |
| C10 | C11 | N3 | H11 | 64.0° | 55.7° |
| C5 | C10 | C11 | N3 | 111.8° | 74.8° |
| C10 | C5 | C6 | C4 | 178.1° | 180.0° |
| C10 | C5 | C4 | C3 | 106.0° | 50.3° |
| C10 | C5 | C4 | N1 | 79.3° | 129.9° |
| C10 | C5 | C6 | H6 | 179.5° | 180.0° |
| C5 | C10 | C9 | H8 | 179.1° | 180.0° |
| C5 | C10 | C11 | H9 | 8.9° | 45.2° |
| C5 | C10 | C11 | H10 | 127.6° | 165.3° |
| P1 | C13 | C12 | H15 | 121.2° | 119.4° |
| P1 | C13 | C12 | H14 | 121.2° | 119.4° |
| P1 | C13 | C12 | N3 | 54.6° | 59.0° |
| P1 | C13 | C12 | H12 | 174.8° | 179.0° |
| P1 | C13 | C12 | H13 | 65.7° | 61.0° |
| P1 | C13 | H15 | H14 | 116.2° | 121.2° |
| C13 | P1 | O1 | H29 | 122.9° | 60.0° |
| C12 | C13 | P1 | O1 | 70.8° | 74.7° |
| C13 | C12 | N3 | C20 | 65.6° | 78.1° |
| C13 | C12 | N3 | C11 | 167.5° | 161.2° |
| C13 | C12 | N3 | H12 | 120.3° | 120.0° |
| C13 | C12 | N3 | H13 | 120.3° | 120.0° |
| C13 | C12 | H12 | H13 | 119.2° | 120.0° |
| C12 | C13 | H15 | H14 | 116.3° | 121.1° |
| C13 | C12 | N3 | H11 | 50.3° | 42.4° |
| O1 | P1 | C13 | H15 | 168.0° | 44.6° |
| O1 | P1 | C13 | H14 | 50.4° | 165.9° |
| C20 | N3 | C11 | C12 | 125.2° | 122.4° |
| C20 | N3 | C11 | H11 | 117.4° | 118.8° |
| C20 | N3 | C12 | H11 | 115.8° | 120.6° |
| C20 | N3 | C11 | H9 | 67.2° | 54.4° |
| C20 | N3 | C11 | H10 | 174.1° | 65.5° |
| C20 | N3 | C12 | H12 | 174.2° | 161.8° |
| C20 | N3 | C12 | H13 | 54.7° | 41.9° |
| N3 | C20 | H28 | H27 | 118.8° | 119.9° |
| C11 | N3 | C12 | H11 | 117.3° | 118.8° |
| N3 | C11 | H9 | H10 | 118.0° | 119.9° |
| C11 | N3 | C12 | H12 | 47.3° | 41.2° |
| C11 | N3 | C12 | H13 | 72.2° | 78.8° |
| C11 | N3 | C20 | H28 | 78.5° | 78.7° |
| C11 | N3 | C20 | H27 | 40.8° | 41.2° |
| C12 | N3 | C11 | H9 | 58.0° | 176.8° |
| C12 | N3 | C11 | H10 | 60.7° | 56.8° |
| N3 | C12 | H12 | H13 | 119.2° | 120.0° |
| N3 | C12 | C13 | H15 | 66.6° | 178.3° |
| N3 | C12 | C13 | H14 | 175.8° | 60.5° |
| C12 | N3 | C20 | H28 | 48.5° | 41.9° |
| C12 | N3 | C20 | H27 | 167.7° | 161.9° |
| C6 | C5 | C4 | C3 | 72.1° | 129.7° |
| C6 | C5 | C4 | N1 | 102.6° | 50.1° |
| C5 | C4 | C3 | N1 | 175.5° | 179.8° |
| C5 | C4 | N1 | C1 | 3.9° | 0.1° |
| C5 | C4 | C3 | N2 | 176.8° | 180.0° |
| C5 | C4 | N1 | C2 | 176.3° | 179.8° |
| C5 | C4 | C3 | H5 | 3.2° | 0.4° |
| C4 | C5 | C6 | H6 | 2.4° | 0.0° |
| C3 | C4 | N1 | C1 | 179.6° | 179.7° |
| C4 | C3 | N2 | H5 | 180.0° | 179.6° |
| C3 | C4 | N1 | C2 | 0.6° | 0.0° |
| C4 | C3 | N2 | C2 | 1.5° | 0.3° |
| C4 | N1 | C1 | C2 | 179.8° | 179.7° |
| N1 | C4 | C3 | N2 | 1.3° | 0.2° |
| C4 | N1 | C2 | N2 | 0.3° | 0.2° |
| N1 | C4 | C3 | H5 | 178.7° | 179.8° |
| C4 | N1 | C1 | H1 | 180.0° | 95.3° |
| C4 | N1 | C1 | H2 | 60.0° | 24.7° |
| C4 | N1 | C1 | H3 | 60.0° | 144.7° |
| C4 | N1 | C2 | H4 | 179.7° | 179.7° |
| C1 | N1 | C2 | N2 | 179.5° | 180.0° |
| N1 | C1 | H1 | H2 | 120.1° | 119.9° |
| N1 | C1 | H1 | H3 | 120.0° | 120.0° |
| N1 | C1 | H2 | H3 | 120.0° | 120.0° |
| C1 | N1 | C2 | H4 | 0.5° | 0.0° |
| C3 | N2 | C2 | N1 | 1.1° | 0.3° |
| C3 | N2 | C2 | H4 | 178.9° | 179.6° |
| N1 | C2 | N2 | H4 | 180.0° | 179.9° |
| C2 | N1 | C1 | H1 | 0.2° | 85.0° |
| C2 | N1 | C1 | H2 | 120.2° | 155.0° |
| C2 | N1 | C1 | H3 | 119.8° | 35.0° |
| C2 | N2 | C3 | H5 | 178.5° | 179.9° |
| H24 | N4 | H25 | H26 | 120.0° | 120.0° |
| H24 | N4 | C18 | H23 | 59.5° | 60.1° |
| H24 | N4 | C18 | H22 | 59.5° | 59.9° |
| H25 | N4 | C18 | H23 | 60.5° | 60.0° |
| H25 | N4 | C18 | H22 | 179.5° | 180.0° |
| H26 | N4 | C18 | H23 | 179.5° | 180.0° |
| H26 | N4 | C18 | H22 | 60.5° | 60.0° |
| H8 | C9 | C8 | H7 | 1.0° | 0.6° |
| H9 | C11 | N3 | H11 | 175.4° | 64.4° |
| H10 | C11 | N3 | H11 | 56.7° | 175.7° |
| H12 | C12 | C13 | H15 | 53.7° | 61.6° |
| H12 | C12 | C13 | H14 | 64.0° | 59.6° |
| H12 | C12 | N3 | H11 | 70.0° | 77.6° |
| H13 | C12 | C13 | H15 | 173.1° | 58.3° |
| H13 | C12 | C13 | H14 | 55.5° | 179.6° |
| H13 | C12 | N3 | H11 | 170.5° | 162.4° |
| H17 | C15 | C16 | H19 | 150.7° | 175.0° |
| H17 | C15 | C16 | H18 | 91.0° | 55.1° |
| H16 | C15 | C16 | H19 | 33.3° | 65.0° |
| H16 | C15 | C16 | H18 | 151.6° | 175.0° |
| H19 | C16 | C17 | H21 | 147.7° | NaN° |
| H19 | C16 | C17 | H20 | 92.9° | 60.0° |
| H18 | C16 | C17 | H21 | 29.3° | 60.0° |
| H18 | C16 | C17 | H20 | 148.8° | 180.0° |
| H23 | C18 | C17 | H21 | 77.4° | 60.0° |
| H23 | C18 | C17 | H20 | 163.1° | 180.0° |
| H22 | C18 | C17 | H21 | 41.6° | NaN° |
| H22 | C18 | C17 | H20 | 77.9° | 60.0° |
| H28 | C20 | N3 | H11 | 164.3° | 162.5° |
| H27 | C20 | N3 | H11 | 76.5° | 77.6° |
| H1 | C1 | H2 | H3 | 120.0° | 120.1° |
