HFR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | S1 | doub | 1.42Å | 1.54Å | |
| N3 | C11 | sing | 1.47Å | 1.45Å | |
| C11 | C10 | sing | 1.51Å | 1.51Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| S1 | N4 | sing | 1.66Å | 1.63Å | |
| S1 | O3 | doub | 1.42Å | 1.51Å | |
| S1 | O4 | sing | 1.52Å | 1.55Å | |
| C5 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| N4 | C13 | sing | 1.35Å | 1.34Å | |
| C6 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
| O6 | C16 | sing | 1.43Å | 1.42Å | |
| C7 | C8 | doub | 1.38Å | 1.39Å | Aromatic |
| C9 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | BR | sing | 1.89Å | 1.85Å | |
| C14 | O4 | sing | 1.43Å | 1.41Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C12 | C13 | sing | 1.51Å | 1.57Å | |
| C13 | O1 | doub | 1.21Å | 1.23Å | |
| C16 | C15 | sing | 1.54Å | 1.54Å | |
| C16 | C17 | sing | 1.55Å | 1.56Å | |
| C15 | O5 | sing | 1.44Å | 1.46Å | |
| C17 | O7 | sing | 1.43Å | 1.42Å | |
| C17 | C18 | sing | 1.55Å | 1.51Å | |
| O5 | C18 | sing | 1.44Å | 1.46Å | |
| C4 | N5 | sing | 1.36Å | 1.35Å | Aromatic |
| C4 | N6 | doub | 1.30Å | 1.34Å | Aromatic |
| C18 | N5 | sing | 1.47Å | 1.49Å | |
| N5 | C1 | sing | 1.37Å | 1.33Å | Aromatic |
| N6 | C2 | sing | 1.35Å | 1.32Å | Aromatic |
| C2 | C1 | doub | 1.41Å | 1.35Å | Aromatic |
| C2 | C3 | sing | 1.41Å | 1.32Å | Aromatic |
| C1 | N2 | sing | 1.33Å | 1.35Å | Aromatic |
| N7 | C3 | sing | 1.38Å | 1.34Å | |
| N2 | C19 | doub | 1.32Å | 1.41Å | Aromatic |
| C3 | N1 | doub | 1.33Å | 1.34Å | Aromatic |
| N1 | C19 | sing | 1.32Å | 1.41Å | Aromatic |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C14 | H2 | sing | 1.09Å | 1.10Å | |
| C14 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H5 | sing | 1.08Å | 1.08Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C9 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| N3 | H11 | sing | 1.01Å | 1.00Å | |
| N3 | H12 | sing | 1.01Å | 1.00Å | |
| N4 | H14 | sing | 0.97Å | 1.00Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| O6 | H17 | sing | 0.97Å | 0.95Å | |
| C17 | H18 | sing | 1.09Å | 1.10Å | |
| O7 | H19 | sing | 0.97Å | 0.95Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.08Å | 1.08Å | |
| N7 | H22 | sing | 0.97Å | 1.00Å | |
| N7 | H23 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | S1 | N4 | 103.5° | 106.4° |
| O2 | S1 | O3 | 115.3° | 123.2° |
| O2 | S1 | O4 | 109.5° | 106.4° |
| N3 | C11 | C10 | 106.5° | 109.5° |
| N3 | C11 | C12 | 113.3° | 109.4° |
| N3 | C11 | H6 | 109.9° | 109.5° |
| C11 | N3 | H11 | 109.5° | 110.9° |
| C11 | N3 | H12 | 109.5° | 111.0° |
| C10 | C11 | C12 | 109.0° | 109.4° |
| C11 | C10 | C5 | 120.1° | 120.0° |
| C11 | C10 | C9 | 119.5° | 120.0° |
| C10 | C11 | H6 | 109.2° | 109.5° |
| C11 | C12 | C13 | 114.1° | 109.4° |
| C12 | C11 | H6 | 108.9° | 109.5° |
| C11 | C12 | H9 | 108.3° | 109.5° |
| C11 | C12 | H10 | 108.3° | 109.5° |
| N4 | S1 | O3 | 109.2° | 106.4° |
| N4 | S1 | O4 | 114.6° | 107.2° |
| S1 | N4 | C13 | 119.1° | 120.0° |
| S1 | N4 | H14 | 120.5° | 120.1° |
| O3 | S1 | O4 | 105.3° | 106.4° |
| S1 | O4 | C14 | 119.5° | 114.0° |
| C6 | C5 | C10 | 120.3° | 120.0° |
| C5 | C6 | C7 | 119.6° | 120.0° |
| C6 | C5 | H4 | 119.9° | 120.0° |
| C5 | C6 | H5 | 120.2° | 120.0° |
| C5 | C10 | C9 | 120.4° | 120.0° |
| C10 | C5 | H4 | 119.9° | 120.0° |
| N4 | C13 | C12 | 117.1° | 120.0° |
| N4 | C13 | O1 | 122.6° | 119.9° |
| C13 | N4 | H14 | 120.4° | 119.9° |
| C6 | C7 | C8 | 119.7° | 120.0° |
| C7 | C6 | H5 | 120.2° | 120.0° |
| C6 | C7 | H7 | 120.2° | 120.0° |
| C10 | C9 | C8 | 119.0° | 120.0° |
| C10 | C9 | H8 | 120.5° | 120.0° |
| O6 | C16 | C15 | 111.1° | 110.5° |
| O6 | C16 | C17 | 111.3° | 110.5° |
| O6 | C16 | H16 | 112.3° | 110.5° |
| C16 | O6 | H17 | 109.5° | 114.0° |
| C7 | C8 | C9 | 121.1° | 120.0° |
| C7 | C8 | BR | 119.9° | 120.0° |
| C8 | C7 | H7 | 120.2° | 120.1° |
| C9 | C8 | BR | 119.0° | 120.0° |
| C8 | C9 | H8 | 120.5° | 120.0° |
| O4 | C14 | C15 | 109.1° | 109.5° |
| O4 | C14 | H2 | 109.6° | 109.5° |
| O4 | C14 | H3 | 109.5° | 109.5° |
| C14 | C15 | C16 | 108.9° | 109.9° |
| C14 | C15 | O5 | 110.8° | 109.9° |
| C15 | C14 | H2 | 109.6° | 109.4° |
| C15 | C14 | H3 | 109.6° | 109.5° |
| C14 | C15 | H15 | 110.3° | 109.8° |
| C12 | C13 | O1 | 120.1° | 120.1° |
| C13 | C12 | H9 | 108.3° | 109.4° |
| C13 | C12 | H10 | 108.3° | 109.5° |
| C15 | C16 | C17 | 100.8° | 104.2° |
| C16 | C15 | O5 | 105.3° | 107.3° |
| C16 | C15 | H15 | 110.1° | 110.0° |
| C15 | C16 | H16 | 110.6° | 110.4° |
| C16 | C17 | O7 | 111.7° | 110.9° |
| C16 | C17 | C18 | 101.4° | 102.1° |
| C17 | C16 | H16 | 110.2° | 110.5° |
| C16 | C17 | H18 | 110.0° | 110.9° |
| C15 | O5 | C18 | 108.5° | 107.0° |
| O5 | C15 | H15 | 111.3° | 109.9° |
| O7 | C17 | C18 | 110.4° | 110.9° |
| O7 | C17 | H18 | 112.2° | 110.8° |
| C17 | O7 | H19 | 109.5° | 114.0° |
| C17 | C18 | O5 | 107.6° | 103.5° |
| C17 | C18 | N5 | 112.2° | 110.6° |
| C18 | C17 | H18 | 110.8° | 110.9° |
| C17 | C18 | H20 | 109.6° | 110.7° |
| O5 | C18 | N5 | 107.3° | 110.6° |
| O5 | C18 | H20 | 110.2° | 110.6° |
| N5 | C4 | N6 | 109.1° | 109.9° |
| C4 | N5 | C18 | 131.2° | 126.3° |
| C4 | N5 | C1 | 107.1° | 107.5° |
| N5 | C4 | H1 | 125.5° | 125.0° |
| C4 | N6 | C2 | 107.2° | 109.5° |
| N6 | C4 | H1 | 125.4° | 125.0° |
| C18 | N5 | C1 | 121.8° | 126.2° |
| N5 | C18 | H20 | 109.9° | 110.6° |
| N5 | C1 | C2 | 108.0° | 106.0° |
| N5 | C1 | N2 | 130.2° | 135.0° |
| N6 | C2 | C1 | 108.6° | 107.2° |
| N6 | C2 | C3 | 129.8° | 134.7° |
| C1 | C2 | C3 | 121.6° | 118.2° |
| C2 | C1 | N2 | 121.8° | 119.1° |
| C2 | C3 | N7 | 114.7° | 120.8° |
| C2 | C3 | N1 | 121.2° | 118.4° |
| C1 | N2 | C19 | 116.5° | 120.7° |
| N7 | C3 | N1 | 124.1° | 120.7° |
| C3 | N7 | H22 | 109.5° | 120.1° |
| C3 | N7 | H23 | 109.5° | 120.0° |
| N2 | C19 | N1 | 120.6° | 122.4° |
| N2 | C19 | H21 | 119.7° | 118.8° |
| C3 | N1 | C19 | 118.3° | 121.2° |
| N1 | C19 | H21 | 119.7° | 118.8° |
| H2 | C14 | H3 | 109.5° | 109.4° |
| H9 | C12 | H10 | 109.5° | 109.5° |
| H11 | N3 | H12 | 109.5° | 111.0° |
| H22 | N7 | H23 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | S1 | N4 | O3 | 123.2° | 133.0° |
| O2 | S1 | N4 | O4 | 119.1° | 113.5° |
| O2 | S1 | O3 | O4 | 120.7° | 122.9° |
| O2 | S1 | N4 | C13 | 163.0° | 178.5° |
| O2 | S1 | O4 | C14 | 59.8° | 38.5° |
| O2 | S1 | N4 | H14 | 17.0° | 1.6° |
| N3 | C11 | C10 | C12 | 122.6° | 119.9° |
| N3 | C11 | C10 | H6 | 118.6° | 120.1° |
| N3 | C11 | C12 | H6 | 122.6° | 120.0° |
| N3 | C11 | C10 | C5 | 45.9° | 140.0° |
| N3 | C11 | C10 | C9 | 131.1° | 39.9° |
| N3 | C11 | C12 | C13 | 74.9° | 65.0° |
| N3 | C11 | C12 | H9 | 45.8° | 54.9° |
| N3 | C11 | C12 | H10 | 164.5° | 175.0° |
| C11 | N3 | H11 | H12 | 120.0° | 123.9° |
| C10 | C11 | C12 | H6 | 119.0° | 120.0° |
| C11 | C10 | C5 | C6 | 177.2° | 179.9° |
| C11 | C10 | C5 | C9 | 177.0° | 180.0° |
| C11 | C10 | C9 | C8 | 178.5° | 179.9° |
| C10 | C11 | C12 | C13 | 166.7° | 175.0° |
| C11 | C10 | C5 | H4 | 2.8° | 0.3° |
| C11 | C10 | C9 | H8 | 1.5° | 0.0° |
| C10 | C11 | C12 | H9 | 72.6° | 65.0° |
| C10 | C11 | C12 | H10 | 46.0° | 55.0° |
| C10 | C11 | N3 | H11 | 180.0° | 64.0° |
| C10 | C11 | N3 | H12 | 60.0° | 59.9° |
| C12 | C11 | C10 | C5 | 76.6° | 100.0° |
| C11 | C12 | C13 | N4 | 39.0° | 180.0° |
| C12 | C11 | C10 | C9 | 106.3° | 80.0° |
| C11 | C12 | C13 | H9 | 120.7° | 120.0° |
| C11 | C12 | C13 | H10 | 120.7° | 120.0° |
| C11 | C12 | C13 | O1 | 147.1° | 0.0° |
| C11 | C12 | H9 | H10 | 117.9° | 120.1° |
| C12 | C11 | N3 | H11 | 60.1° | 176.0° |
| C12 | C11 | N3 | H12 | 179.8° | 60.0° |
| N4 | S1 | O3 | O4 | 123.4° | 114.1° |
| S1 | N4 | C13 | H14 | 180.0° | 179.9° |
| N4 | S1 | O4 | C14 | 55.9° | 75.0° |
| S1 | N4 | C13 | C12 | 179.4° | 180.0° |
| S1 | N4 | C13 | O1 | 5.7° | 0.0° |
| O3 | S1 | N4 | C13 | 73.7° | 48.5° |
| O3 | S1 | O4 | C14 | 175.8° | 171.4° |
| O3 | S1 | N4 | H14 | 106.3° | 131.4° |
| O4 | S1 | N4 | C13 | 44.0° | 65.0° |
| S1 | O4 | C14 | C15 | 176.4° | 180.0° |
| S1 | O4 | C14 | H2 | 63.6° | 60.0° |
| S1 | O4 | C14 | H3 | 56.5° | 59.9° |
| O4 | S1 | N4 | H14 | 136.0° | 115.0° |
| C6 | C5 | C10 | H4 | 180.0° | 179.7° |
| C5 | C6 | C7 | H5 | 180.0° | 180.0° |
| C6 | C5 | C10 | C9 | 0.2° | 0.0° |
| C5 | C6 | C7 | C8 | 1.6° | 0.0° |
| C5 | C6 | C7 | H7 | 178.4° | 180.0° |
| C10 | C5 | C6 | C7 | 1.4° | 0.0° |
| C5 | C10 | C9 | C8 | 1.5° | 0.1° |
| C10 | C5 | C6 | H5 | 178.6° | 180.0° |
| C5 | C10 | C11 | H6 | 164.5° | 20.0° |
| C5 | C10 | C9 | H8 | 178.5° | 180.0° |
| N4 | C13 | C12 | O1 | 173.9° | 180.0° |
| N4 | C13 | C12 | H9 | 81.6° | 60.0° |
| N4 | C13 | C12 | H10 | 159.7° | 60.0° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 0.3° | 0.0° |
| C6 | C7 | C8 | BR | 179.2° | 180.0° |
| C7 | C6 | C5 | H4 | 178.6° | 179.7° |
| C10 | C9 | C8 | C7 | 1.3° | 0.1° |
| C10 | C9 | C8 | H8 | 180.0° | 179.9° |
| C10 | C9 | C8 | BR | 179.3° | 180.0° |
| C9 | C10 | C5 | H4 | 179.8° | 179.7° |
| C9 | C10 | C11 | H6 | 12.5° | 160.0° |
| O6 | C16 | C15 | C14 | 86.8° | 119.8° |
| O6 | C16 | C15 | C17 | 118.1° | 118.7° |
| O6 | C16 | C15 | H16 | 125.4° | 122.6° |
| O6 | C16 | C17 | H16 | 125.3° | 122.6° |
| O6 | C16 | C15 | O5 | 154.3° | 120.7° |
| O6 | C16 | C17 | O7 | 39.6° | 20.4° |
| O6 | C16 | C17 | C18 | 157.1° | 97.8° |
| O6 | C16 | C15 | H15 | 34.3° | 1.3° |
| O6 | C16 | C17 | H18 | 85.6° | 143.9° |
| C7 | C8 | C9 | BR | 179.5° | 180.0° |
| C8 | C7 | C6 | H5 | 178.4° | 180.0° |
| C7 | C8 | C9 | H8 | 178.7° | 180.0° |
| C9 | C8 | C7 | H7 | 179.7° | 180.0° |
| BR | C8 | C7 | H7 | 0.8° | 0.0° |
| BR | C8 | C9 | H8 | 0.7° | 0.1° |
| O4 | C14 | C15 | H2 | 120.0° | 120.0° |
| O4 | C14 | C15 | H3 | 119.9° | 120.1° |
| O4 | C14 | C15 | C16 | 170.9° | 175.7° |
| O4 | C14 | C15 | O5 | 73.8° | 66.4° |
| O4 | C14 | H2 | H3 | 120.2° | 120.0° |
| O4 | C14 | C15 | H15 | 49.9° | 54.6° |
| C14 | C15 | C16 | O5 | 118.9° | 119.5° |
| C14 | C15 | C16 | H15 | 121.1° | 121.1° |
| C14 | C15 | C16 | C17 | 155.1° | 121.5° |
| C14 | C15 | O5 | H15 | 123.2° | 121.0° |
| C14 | C15 | O5 | C18 | 136.7° | 146.0° |
| C15 | C14 | H2 | H3 | 120.2° | 120.0° |
| C14 | C15 | C16 | H16 | 38.6° | 2.8° |
| C13 | C12 | C11 | H6 | 47.7° | 55.0° |
| C13 | C12 | H9 | H10 | 117.9° | 120.0° |
| C12 | C13 | N4 | H14 | 0.6° | 0.0° |
| O1 | C13 | C12 | H9 | 92.3° | 120.0° |
| O1 | C13 | C12 | H10 | 26.4° | 120.0° |
| O1 | C13 | N4 | H14 | 174.3° | 179.9° |
| C15 | C16 | C17 | H16 | 116.8° | 118.7° |
| C16 | C15 | O5 | H15 | 119.2° | 119.6° |
| C15 | C16 | C17 | O7 | 78.3° | 139.1° |
| C15 | C16 | C17 | C18 | 39.2° | 20.9° |
| C16 | C15 | O5 | C18 | 19.1° | 26.5° |
| C16 | C15 | C14 | H2 | 69.2° | 64.2° |
| C16 | C15 | C14 | H3 | 51.0° | 55.7° |
| C15 | C16 | O6 | H17 | 180.0° | 180.0° |
| C15 | C16 | C17 | H18 | 156.5° | 97.3° |
| C17 | C16 | C15 | O5 | 36.3° | 2.0° |
| C16 | C17 | O7 | C18 | 112.0° | 112.7° |
| C16 | C17 | O7 | H18 | 124.0° | 123.6° |
| C16 | C17 | C18 | H18 | 116.7° | 118.2° |
| C16 | C17 | C18 | O5 | 29.3° | 37.0° |
| C16 | C17 | C18 | N5 | 88.5° | 155.5° |
| C17 | C16 | C15 | H15 | 83.8° | 117.5° |
| C17 | C16 | O6 | H17 | 68.6° | 65.2° |
| C16 | C17 | O7 | H19 | 180.0° | 61.4° |
| C16 | C17 | C18 | H20 | 149.1° | 81.5° |
| C15 | O5 | C18 | C17 | 7.0° | 40.1° |
| C15 | O5 | C18 | N5 | 113.9° | 158.6° |
| O5 | C15 | C14 | H2 | 46.2° | 53.6° |
| O5 | C15 | C14 | H3 | 166.3° | 173.5° |
| O5 | C15 | C16 | H16 | 80.3° | 116.7° |
| C15 | O5 | C18 | H20 | 126.4° | 78.5° |
| O7 | C17 | C18 | H18 | 124.8° | 123.6° |
| O7 | C17 | C18 | O5 | 89.2° | 155.2° |
| O7 | C17 | C18 | N5 | 153.0° | 86.3° |
| O7 | C17 | C16 | H16 | 164.9° | 102.2° |
| O7 | C17 | C18 | H20 | 30.7° | 36.7° |
| C17 | C18 | O5 | N5 | 120.9° | 118.5° |
| C17 | C18 | O5 | H20 | 119.4° | 118.5° |
| C17 | C18 | N5 | C4 | 90.9° | 90.5° |
| C17 | C18 | N5 | H20 | 122.2° | 123.0° |
| C17 | C18 | N5 | C1 | 88.6° | 89.5° |
| C18 | C17 | C16 | H16 | 77.6° | 139.6° |
| C18 | C17 | O7 | H19 | 68.0° | 174.1° |
| O5 | C18 | N5 | C4 | 27.1° | 23.5° |
| O5 | C18 | N5 | H20 | 119.9° | 123.0° |
| O5 | C18 | N5 | C1 | 153.5° | 156.5° |
| C18 | O5 | C15 | H15 | 100.2° | 93.1° |
| O5 | C18 | C17 | H18 | 146.0° | 81.2° |
| N5 | C4 | N6 | H1 | 180.0° | 179.8° |
| C4 | N5 | C18 | C1 | 179.5° | 180.0° |
| N5 | C4 | N6 | C2 | 0.8° | 0.0° |
| C4 | N5 | C1 | C2 | 0.2° | 0.1° |
| C4 | N5 | C1 | N2 | 178.0° | 180.0° |
| C4 | N5 | C18 | H20 | 146.9° | 146.5° |
| N6 | C4 | N5 | C18 | 179.9° | 180.0° |
| N6 | C4 | N5 | C1 | 0.6° | 0.0° |
| C4 | N6 | C2 | C1 | 0.7° | 0.1° |
| C4 | N6 | C2 | C3 | 179.4° | 180.0° |
| C18 | N5 | C1 | C2 | 179.8° | 180.0° |
| C18 | N5 | C1 | N2 | 1.6° | 0.1° |
| C18 | N5 | C4 | H1 | 0.1° | 0.2° |
| N5 | C18 | C17 | H18 | 28.2° | 37.3° |
| N5 | C1 | C2 | N6 | 0.3° | 0.1° |
| N5 | C1 | C2 | N2 | 178.3° | 179.9° |
| N5 | C1 | C2 | C3 | 179.8° | 180.0° |
| N5 | C1 | N2 | C19 | 179.6° | 179.9° |
| C1 | N5 | C4 | H1 | 179.4° | 179.8° |
| C1 | N5 | C18 | H20 | 33.6° | 33.5° |
| N6 | C2 | C1 | C3 | 179.9° | 180.0° |
| N6 | C2 | C1 | N2 | 178.7° | 180.0° |
| N6 | C2 | C3 | N7 | 0.0° | 0.1° |
| N6 | C2 | C3 | N1 | 180.0° | 180.0° |
| C2 | N6 | C4 | H1 | 179.2° | 179.7° |
| C1 | C2 | C3 | N7 | 179.8° | 179.9° |
| C2 | C1 | N2 | C19 | 1.7° | 0.0° |
| C1 | C2 | C3 | N1 | 0.2° | 0.0° |
| C3 | C2 | C1 | N2 | 1.4° | 0.1° |
| C2 | C3 | N7 | N1 | 180.0° | 179.9° |
| C2 | C3 | N1 | C19 | 0.7° | 0.1° |
| C2 | C3 | N7 | H22 | 180.0° | 179.9° |
| C2 | C3 | N7 | H23 | 60.0° | 0.1° |
| C1 | N2 | C19 | N1 | 0.9° | 0.1° |
| C1 | N2 | C19 | H21 | 179.1° | 179.9° |
| N7 | C3 | N1 | C19 | 179.3° | 180.0° |
| C3 | N7 | H22 | H23 | 120.0° | 180.0° |
| N2 | C19 | N1 | C3 | 0.3° | 0.1° |
| N2 | C19 | N1 | H21 | 180.0° | 179.8° |
| C3 | N1 | C19 | H21 | 179.7° | 180.0° |
| N1 | C3 | N7 | H22 | 0.0° | 0.0° |
| N1 | C3 | N7 | H23 | 120.0° | 180.0° |
| H2 | C14 | C15 | H15 | 169.9° | 174.6° |
| H3 | C14 | C15 | H15 | 70.0° | 65.5° |
| H4 | C5 | C6 | H5 | 1.4° | 0.3° |
| H5 | C6 | C7 | H7 | 1.6° | 0.0° |
| H6 | C11 | C12 | H9 | 168.4° | 175.0° |
| H6 | C11 | C12 | H10 | 73.0° | 65.0° |
| H6 | C11 | N3 | H11 | 61.9° | 56.1° |
| H6 | C11 | N3 | H12 | 58.2° | 180.0° |
| H15 | C15 | C16 | H16 | 159.7° | 123.8° |
| H16 | C16 | O6 | H17 | 55.5° | 57.5° |
| H16 | C16 | C17 | H18 | 39.7° | 21.3° |
| H18 | C17 | O7 | H19 | 56.0° | 62.2° |
| H18 | C17 | C18 | H20 | 94.1° | 160.3° |
