HUJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | C2 | sing | 1.53Å | 1.52Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| N2 | N3 | doub | 1.29Å | 1.41Å | Aromatic |
| N2 | N1 | sing | 1.40Å | 1.39Å | Aromatic |
| N3 | C6 | sing | 1.34Å | 1.35Å | Aromatic |
| C1 | C | sing | 1.53Å | 1.55Å | |
| N1 | C8 | sing | 1.46Å | 1.47Å | |
| N1 | C7 | sing | 1.35Å | 1.34Å | Aromatic |
| N | C | sing | 1.47Å | 1.47Å | |
| N | C5 | sing | 1.35Å | 1.34Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C6 | C5 | sing | 1.48Å | 1.49Å | |
| C6 | C7 | doub | 1.37Å | 1.39Å | Aromatic |
| C | B | sing | 1.60Å | 1.62Å | |
| O6 | B | sing | 1.37Å | 1.54Å | |
| C5 | O | doub | 1.22Å | 1.22Å | |
| C13 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C13 | C14 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.40Å | 1.41Å | Aromatic |
| B | O5 | sing | 1.37Å | 1.54Å | |
| C9 | N4 | sing | 1.46Å | 1.46Å | |
| N4 | C10 | sing | 1.35Å | 1.35Å | |
| O4 | C14 | sing | 1.36Å | 1.37Å | |
| O4 | C19 | sing | 1.43Å | 1.46Å | |
| C14 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C10 | sing | 1.47Å | 1.52Å | |
| C11 | C16 | doub | 1.40Å | 1.42Å | Aromatic |
| C10 | O1 | doub | 1.22Å | 1.23Å | |
| C15 | C16 | sing | 1.39Å | 1.41Å | Aromatic |
| C15 | O3 | sing | 1.36Å | 1.37Å | |
| C16 | O2 | sing | 1.36Å | 1.38Å | |
| O3 | C18 | sing | 1.43Å | 1.44Å | |
| O2 | C17 | sing | 1.43Å | 1.43Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C4 | H8 | sing | 1.09Å | 1.10Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.08Å | 1.08Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.08Å | 1.08Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| N | H23 | sing | 0.97Å | 1.00Å | |
| N4 | H25 | sing | 0.97Å | 1.00Å | |
| O5 | H26 | sing | 0.97Å | 0.95Å | |
| O6 | H27 | sing | 0.97Å | 0.95Å | |
| C9 | H28 | sing | 1.09Å | 1.10Å | |
| C9 | H29 | sing | 1.09Å | 1.10Å | |
| C13 | H30 | sing | 1.08Å | 1.08Å | |
| B | O7 | sing | 1.37Å | 1.45Å | |
| O7 | H24 | sing | 0.97Å | 0.95Å | |
| C | H31 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | C2 | C3 | 110.0° | 109.5° |
| C4 | C2 | C1 | 110.8° | 109.5° |
| C4 | C2 | H3 | 107.7° | 109.5° |
| C2 | C4 | H7 | 109.5° | 109.5° |
| C2 | C4 | H8 | 109.4° | 109.5° |
| C2 | C4 | H9 | 109.4° | 109.5° |
| C3 | C2 | C1 | 113.2° | 109.5° |
| C3 | C2 | H3 | 107.6° | 109.4° |
| C2 | C3 | H4 | 109.5° | 109.5° |
| C2 | C3 | H5 | 109.5° | 109.5° |
| C2 | C3 | H6 | 109.5° | 109.5° |
| C2 | C1 | C | 117.0° | 109.5° |
| C2 | C1 | H1 | 107.5° | 109.5° |
| C2 | C1 | H2 | 107.5° | 109.5° |
| C1 | C2 | H3 | 107.5° | 109.4° |
| N3 | N2 | N1 | 104.7° | 108.4° |
| N2 | N3 | C6 | 109.1° | 109.5° |
| N2 | N1 | C8 | 115.2° | 126.6° |
| N2 | N1 | C7 | 110.3° | 106.8° |
| N3 | C6 | C5 | 124.7° | 125.7° |
| N3 | C6 | C7 | 108.0° | 108.5° |
| C1 | C | N | 107.8° | 109.5° |
| C1 | C | B | 110.4° | 109.4° |
| C | C1 | H1 | 107.6° | 109.5° |
| C | C1 | H2 | 107.6° | 109.5° |
| C1 | C | H31 | 107.8° | 109.5° |
| C8 | N1 | C7 | 134.6° | 126.6° |
| N1 | C8 | C9 | 112.7° | 109.5° |
| N1 | C8 | H11 | 108.7° | 109.4° |
| N1 | C8 | H12 | 108.7° | 109.5° |
| N1 | C7 | C6 | 108.0° | 106.9° |
| N1 | C7 | H10 | 126.0° | 126.6° |
| C | N | C5 | 126.6° | 120.0° |
| N | C | B | 115.2° | 109.5° |
| C | N | H23 | 116.7° | 120.0° |
| N | C | H31 | 108.7° | 109.5° |
| N | C5 | C6 | 119.2° | 120.0° |
| N | C5 | O | 123.6° | 120.0° |
| C5 | N | H23 | 116.7° | 120.0° |
| C8 | C9 | N4 | 114.5° | 109.5° |
| C9 | C8 | H11 | 108.6° | 109.5° |
| C9 | C8 | H12 | 108.7° | 109.5° |
| C8 | C9 | H28 | 108.2° | 109.5° |
| C8 | C9 | H29 | 108.2° | 109.5° |
| C5 | C6 | C7 | 127.2° | 125.8° |
| C6 | C5 | O | 117.2° | 120.0° |
| C6 | C7 | H10 | 126.0° | 126.6° |
| C | B | O6 | 108.4° | 109.5° |
| C | B | O5 | 109.1° | 109.4° |
| C | B | O7 | 108.4° | 109.4° |
| B | C | H31 | 106.9° | 109.5° |
| O6 | B | O5 | 111.5° | 109.5° |
| B | O6 | H27 | 109.5° | 114.0° |
| O6 | B | O7 | 112.9° | 109.5° |
| C12 | C13 | C14 | 120.0° | 120.3° |
| C13 | C12 | C11 | 120.8° | 120.0° |
| C13 | C12 | H13 | 119.6° | 120.1° |
| C12 | C13 | H30 | 120.0° | 119.8° |
| C13 | C14 | O4 | 119.4° | 119.9° |
| C13 | C14 | C15 | 119.8° | 120.2° |
| C14 | C13 | H30 | 120.0° | 119.9° |
| C12 | C11 | C10 | 118.8° | 120.1° |
| C12 | C11 | C16 | 118.9° | 119.8° |
| C11 | C12 | H13 | 119.6° | 120.0° |
| B | O5 | H26 | 109.5° | 114.1° |
| O5 | B | O7 | 106.4° | 109.4° |
| C9 | N4 | C10 | 125.6° | 120.0° |
| C9 | N4 | H25 | 117.2° | 119.9° |
| N4 | C9 | H28 | 108.2° | 109.5° |
| N4 | C9 | H29 | 108.2° | 109.4° |
| N4 | C10 | C11 | 119.0° | 120.0° |
| N4 | C10 | O1 | 123.1° | 120.0° |
| C10 | N4 | H25 | 117.3° | 120.0° |
| C14 | O4 | C19 | 119.9° | 117.0° |
| O4 | C14 | C15 | 120.8° | 119.9° |
| O4 | C19 | H20 | 109.5° | 109.5° |
| O4 | C19 | H21 | 109.4° | 109.4° |
| O4 | C19 | H22 | 109.5° | 109.5° |
| C14 | C15 | C16 | 120.5° | 119.9° |
| C14 | C15 | O3 | 119.3° | 120.0° |
| C10 | C11 | C16 | 122.2° | 120.1° |
| C11 | C10 | O1 | 117.9° | 120.0° |
| C11 | C16 | C15 | 120.0° | 119.7° |
| C11 | C16 | O2 | 121.4° | 120.1° |
| C16 | C15 | O3 | 120.2° | 120.0° |
| C15 | C16 | O2 | 118.6° | 120.2° |
| C15 | O3 | C18 | 121.1° | 117.1° |
| C16 | O2 | C17 | 120.7° | 117.0° |
| O3 | C18 | H17 | 109.5° | 109.4° |
| O3 | C18 | H18 | 109.5° | 109.5° |
| O3 | C18 | H19 | 109.5° | 109.4° |
| O2 | C17 | H14 | 109.5° | 109.5° |
| O2 | C17 | H15 | 109.5° | 109.4° |
| O2 | C17 | H16 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.4° |
| H4 | C3 | H5 | 109.5° | 109.4° |
| H4 | C3 | H6 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.4° | 109.5° |
| H7 | C4 | H8 | 109.4° | 109.4° |
| H7 | C4 | H9 | 109.5° | 109.5° |
| H8 | C4 | H9 | 109.5° | 109.4° |
| H11 | C8 | H12 | 109.4° | 109.5° |
| H14 | C17 | H15 | 109.4° | 109.4° |
| H14 | C17 | H16 | 109.5° | 109.4° |
| H15 | C17 | H16 | 109.5° | 109.5° |
| H17 | C18 | H18 | 109.5° | 109.5° |
| H17 | C18 | H19 | 109.5° | 109.5° |
| H18 | C18 | H19 | 109.4° | 109.5° |
| H20 | C19 | H21 | 109.5° | 109.5° |
| H20 | C19 | H22 | 109.5° | 109.5° |
| H21 | C19 | H22 | 109.5° | 109.5° |
| H28 | C9 | H29 | 109.5° | 109.4° |
| B | O7 | H24 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | C2 | C3 | C1 | 124.4° | 120.1° |
| C4 | C2 | C3 | H3 | 117.0° | 120.0° |
| C4 | C2 | C1 | H3 | 117.3° | 120.0° |
| C4 | C2 | C1 | C | 178.7° | 65.4° |
| C4 | C2 | C1 | H1 | 57.6° | 54.7° |
| C4 | C2 | C1 | H2 | 60.2° | 174.6° |
| C4 | C2 | C3 | H4 | 180.0° | 60.0° |
| C4 | C2 | C3 | H5 | 60.0° | 60.0° |
| C4 | C2 | C3 | H6 | 60.0° | 180.0° |
| C2 | C4 | H7 | H8 | 119.9° | 120.0° |
| C2 | C4 | H7 | H9 | 120.0° | 120.0° |
| C2 | C4 | H8 | H9 | 120.0° | 120.0° |
| C3 | C2 | C1 | H3 | 118.6° | 119.9° |
| C3 | C2 | C1 | C | 54.6° | 174.6° |
| C3 | C2 | C1 | H1 | 66.5° | 65.4° |
| C3 | C2 | C1 | H2 | 175.7° | 54.5° |
| C2 | C3 | H4 | H5 | 120.0° | 120.0° |
| C2 | C3 | H4 | H6 | 120.0° | 120.0° |
| C2 | C3 | H5 | H6 | 120.0° | 120.0° |
| C3 | C2 | C4 | H7 | 180.0° | 65.1° |
| C3 | C2 | C4 | H8 | 60.0° | 174.9° |
| C3 | C2 | C4 | H9 | 60.0° | 55.0° |
| C2 | C1 | C | H1 | 121.1° | 120.0° |
| C2 | C1 | C | H2 | 121.1° | 120.0° |
| C2 | C1 | C | N | 45.0° | 62.5° |
| C2 | C1 | C | B | 171.6° | 177.5° |
| C2 | C1 | H1 | H2 | 116.5° | 120.0° |
| C1 | C2 | C3 | H4 | 55.5° | 60.1° |
| C1 | C2 | C3 | H5 | 175.5° | 180.0° |
| C1 | C2 | C3 | H6 | 64.5° | 60.0° |
| C1 | C2 | C4 | H7 | 54.1° | 55.0° |
| C1 | C2 | C4 | H8 | 65.8° | 65.0° |
| C1 | C2 | C4 | H9 | 174.2° | 175.0° |
| C2 | C1 | C | H31 | 72.0° | 57.5° |
| N3 | N2 | N1 | C8 | 179.8° | 179.7° |
| N3 | N2 | N1 | C7 | 0.3° | 0.3° |
| N2 | N3 | C6 | C5 | 178.2° | 179.8° |
| N2 | N3 | C6 | C7 | 1.8° | 0.4° |
| N1 | N2 | N3 | C6 | 1.0° | 0.4° |
| N2 | N1 | C8 | C7 | 179.4° | 179.9° |
| N2 | N1 | C8 | C9 | 147.2° | 55.0° |
| N2 | N1 | C7 | C6 | 1.3° | 0.0° |
| N2 | N1 | C7 | H10 | 178.7° | 180.0° |
| N2 | N1 | C8 | H11 | 26.7° | 65.0° |
| N2 | N1 | C8 | H12 | 92.3° | 175.0° |
| N3 | C6 | C7 | N1 | 1.9° | 0.2° |
| N3 | C6 | C5 | N | 23.6° | 0.3° |
| N3 | C6 | C5 | C7 | 175.7° | 179.8° |
| N3 | C6 | C5 | O | 155.0° | 179.7° |
| N3 | C6 | C7 | H10 | 178.1° | 179.7° |
| C1 | C | N | B | 123.7° | 119.9° |
| C1 | C | N | H31 | 116.5° | 120.0° |
| C1 | C | N | C5 | 140.3° | 135.0° |
| C1 | C | B | H31 | 116.9° | 120.0° |
| C1 | C | B | O6 | 72.9° | 61.8° |
| C1 | C | B | O5 | 165.4° | 58.3° |
| C | C1 | H1 | H2 | 116.6° | 120.0° |
| C | C1 | C2 | H3 | 64.0° | 54.7° |
| C1 | C | N | H23 | 39.7° | 45.0° |
| C1 | C | B | O7 | 49.9° | 178.2° |
| N1 | C8 | C9 | H11 | 120.5° | 119.9° |
| N1 | C8 | C9 | H12 | 120.5° | 120.0° |
| C8 | N1 | C7 | C6 | 179.2° | 179.9° |
| N1 | C8 | C9 | N4 | 79.4° | 180.0° |
| C8 | N1 | C7 | H10 | 0.8° | 0.0° |
| N1 | C8 | H11 | H12 | 118.5° | 120.0° |
| N1 | C8 | C9 | H28 | 159.9° | 60.0° |
| N1 | C8 | C9 | H29 | 41.4° | 60.0° |
| C7 | N1 | C8 | C9 | 33.4° | 125.0° |
| N1 | C7 | C6 | C5 | 178.3° | 180.0° |
| N1 | C7 | C6 | H10 | 180.0° | 180.0° |
| C7 | N1 | C8 | H11 | 153.9° | 115.0° |
| C7 | N1 | C8 | H12 | 87.1° | 5.0° |
| C | N | C5 | H23 | 180.0° | 180.0° |
| C | N | C5 | C6 | 176.5° | 180.0° |
| N | C | B | H31 | 120.8° | 120.0° |
| N | C | B | O6 | 49.4° | 58.1° |
| C | N | C5 | O | 2.0° | 0.0° |
| N | C | B | O5 | 72.3° | 178.2° |
| N | C | C1 | H1 | 166.1° | 177.5° |
| N | C | C1 | H2 | 76.0° | 57.5° |
| N | C | B | O7 | 172.2° | 61.9° |
| N | C5 | C6 | O | 178.6° | 180.0° |
| N | C5 | C6 | C7 | 160.6° | 179.9° |
| C5 | N | C | B | 96.0° | 105.0° |
| C5 | N | C | H31 | 23.8° | 15.0° |
| C8 | C9 | N4 | H28 | 120.7° | 120.0° |
| C8 | C9 | N4 | H29 | 120.7° | 120.0° |
| C8 | C9 | N4 | C10 | 117.5° | 180.0° |
| C9 | C8 | H11 | H12 | 118.5° | 120.0° |
| C8 | C9 | N4 | H25 | 62.5° | 0.1° |
| C8 | C9 | H28 | H29 | 117.7° | 120.0° |
| C5 | C6 | C7 | H10 | 1.7° | 0.1° |
| C6 | C5 | N | H23 | 3.4° | 0.0° |
| C7 | C6 | C5 | O | 20.7° | 0.0° |
| C | B | O6 | O5 | 120.2° | 120.0° |
| C | B | O6 | O7 | 120.1° | 120.0° |
| C | B | O5 | O7 | 116.7° | 119.9° |
| B | C | C1 | H1 | 67.3° | 57.5° |
| B | C | C1 | H2 | 50.5° | 62.5° |
| B | C | N | H23 | 84.0° | 74.9° |
| C | B | O5 | H26 | 180.0° | 55.6° |
| C | B | O6 | H27 | 180.0° | 59.9° |
| C | B | O7 | H24 | 180.0° | 180.0° |
| O6 | B | O5 | O7 | 123.5° | 120.0° |
| O6 | B | O5 | H26 | 60.2° | 175.7° |
| O6 | B | O7 | H24 | 59.9° | 60.0° |
| O6 | B | C | H31 | 170.2° | 178.2° |
| O | C5 | N | H23 | 178.0° | 180.0° |
| C12 | C13 | C14 | H30 | 180.0° | 180.0° |
| C13 | C12 | C11 | H13 | 180.0° | 180.0° |
| C12 | C13 | C14 | O4 | 179.9° | 180.0° |
| C12 | C13 | C14 | C15 | 0.1° | 0.3° |
| C13 | C12 | C11 | C10 | 179.9° | 180.0° |
| C13 | C12 | C11 | C16 | 0.4° | 0.3° |
| C14 | C13 | C12 | C11 | 0.3° | 0.0° |
| C13 | C14 | O4 | C15 | 180.0° | 179.7° |
| C13 | C14 | O4 | C19 | 99.7° | 0.0° |
| C13 | C14 | C15 | C16 | 0.0° | 0.3° |
| C13 | C14 | C15 | O3 | 180.0° | 179.8° |
| C14 | C13 | C12 | H13 | 179.7° | 180.0° |
| C12 | C11 | C10 | N4 | 46.7° | 0.3° |
| C12 | C11 | C10 | C16 | 179.7° | 179.7° |
| C12 | C11 | C10 | O1 | 132.6° | 179.7° |
| C12 | C11 | C16 | C15 | 0.4° | 0.3° |
| C12 | C11 | C16 | O2 | 179.8° | 179.7° |
| C11 | C12 | C13 | H30 | 179.7° | 180.0° |
| O5 | B | O6 | H27 | 59.8° | 179.9° |
| O5 | B | O7 | H24 | 62.7° | 60.1° |
| O5 | B | C | H31 | 48.5° | 61.7° |
| C9 | N4 | C10 | H25 | 180.0° | 179.9° |
| C9 | N4 | C10 | C11 | 179.6° | 180.0° |
| C9 | N4 | C10 | O1 | 1.2° | 0.1° |
| N4 | C9 | C8 | H11 | 41.1° | 60.0° |
| N4 | C9 | C8 | H12 | 160.1° | 60.0° |
| N4 | C9 | H28 | H29 | 117.7° | 120.0° |
| N4 | C10 | C11 | O1 | 179.3° | 179.9° |
| N4 | C10 | C11 | C16 | 133.5° | 180.0° |
| C10 | N4 | C9 | H28 | 121.8° | 59.9° |
| C10 | N4 | C9 | H29 | 3.3° | 60.0° |
| O4 | C14 | C15 | C16 | 179.9° | 180.0° |
| O4 | C14 | C15 | O3 | 0.0° | 0.0° |
| C14 | O4 | C19 | H20 | 180.0° | 60.0° |
| C14 | O4 | C19 | H21 | 60.0° | 60.0° |
| C14 | O4 | C19 | H22 | 60.0° | 180.0° |
| O4 | C14 | C13 | H30 | 0.1° | 0.0° |
| C19 | O4 | C14 | C15 | 80.3° | 179.7° |
| O4 | C19 | H20 | H21 | 120.0° | 120.0° |
| O4 | C19 | H20 | H22 | 120.0° | 120.0° |
| O4 | C19 | H21 | H22 | 120.0° | 120.0° |
| C14 | C15 | C16 | C11 | 0.2° | 0.0° |
| C14 | C15 | C16 | O3 | 179.9° | 179.9° |
| C14 | C15 | C16 | O2 | 180.0° | 180.0° |
| C14 | C15 | O3 | C18 | 99.4° | 93.4° |
| C15 | C14 | C13 | H30 | 179.9° | 179.7° |
| C10 | C11 | C16 | C15 | 179.9° | 180.0° |
| C10 | C11 | C16 | O2 | 0.1° | 0.0° |
| C10 | C11 | C12 | H13 | 0.1° | 0.0° |
| C11 | C10 | N4 | H25 | 0.5° | 0.1° |
| C16 | C11 | C10 | O1 | 47.1° | 0.0° |
| C11 | C16 | C15 | O2 | 179.8° | 180.0° |
| C11 | C16 | C15 | O3 | 179.9° | 180.0° |
| C11 | C16 | O2 | C17 | 101.8° | 95.9° |
| C16 | C11 | C12 | H13 | 179.6° | 179.7° |
| O1 | C10 | N4 | H25 | 178.8° | 180.0° |
| C16 | C15 | O3 | C18 | 80.7° | 86.6° |
| C15 | C16 | O2 | C17 | 78.4° | 84.1° |
| O3 | C15 | C16 | O2 | 0.1° | 0.0° |
| C15 | O3 | C18 | H17 | 180.0° | 64.8° |
| C15 | O3 | C18 | H18 | 60.0° | 175.2° |
| C15 | O3 | C18 | H19 | 60.0° | 55.2° |
| C16 | O2 | C17 | H14 | 180.0° | 56.2° |
| C16 | O2 | C17 | H15 | 60.0° | 63.8° |
| C16 | O2 | C17 | H16 | 60.0° | 176.1° |
| O3 | C18 | H17 | H18 | 120.0° | 120.0° |
| O3 | C18 | H17 | H19 | 120.0° | 119.9° |
| O3 | C18 | H18 | H19 | 119.9° | 120.0° |
| O2 | C17 | H14 | H15 | 120.0° | 119.9° |
| O2 | C17 | H14 | H16 | 120.0° | 120.0° |
| O2 | C17 | H15 | H16 | 120.0° | 120.1° |
| H1 | C1 | C2 | H3 | 174.9° | 174.7° |
| H1 | C1 | C | H31 | 49.0° | 62.5° |
| H2 | C1 | C2 | H3 | 57.1° | 65.4° |
| H2 | C1 | C | H31 | 166.9° | 177.5° |
| H3 | C2 | C3 | H4 | 63.0° | 180.0° |
| H3 | C2 | C3 | H5 | 57.0° | 60.1° |
| H3 | C2 | C3 | H6 | 177.0° | 59.9° |
| H3 | C2 | C4 | H7 | 63.1° | 174.9° |
| H3 | C2 | C4 | H8 | 177.0° | 54.9° |
| H3 | C2 | C4 | H9 | 57.0° | 65.0° |
| H4 | C3 | H5 | H6 | 120.0° | 120.0° |
| H7 | C4 | H8 | H9 | 120.1° | 120.0° |
| H11 | C8 | C9 | H28 | 79.6° | 179.9° |
| H11 | C8 | C9 | H29 | 161.9° | 60.0° |
| H12 | C8 | C9 | H28 | 39.4° | 60.0° |
| H12 | C8 | C9 | H29 | 79.1° | 180.0° |
| H13 | C12 | C13 | H30 | 0.3° | 0.0° |
| H14 | C17 | H15 | H16 | 120.0° | 120.0° |
| H17 | C18 | H18 | H19 | 120.0° | 120.1° |
| H20 | C19 | H21 | H22 | 120.0° | 120.0° |
| H23 | N | C | H31 | 156.2° | 165.0° |
| H25 | N4 | C9 | H28 | 58.2° | 120.0° |
| H25 | N4 | C9 | H29 | 176.8° | 120.1° |
| H26 | O5 | B | O7 | 63.3° | 64.3° |
| H27 | O6 | B | O7 | 59.9° | 60.0° |
| O7 | B | C | H31 | 67.0° | 58.2° |
