A1H35
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F | B | sing | 1.37Å | 1.39Å | |
| F1 | B | sing | 1.37Å | 1.38Å | |
| B | N | sing | 1.52Å | 1.54Å | |
| N | C | doub | 1.33Å | 1.34Å | |
| C | C1 | sing | 1.38Å | 1.39Å | |
| C1 | C2 | doub | 1.38Å | 1.37Å | |
| C2 | C3 | sing | 1.41Å | 1.41Å | |
| N | C3 | sing | 1.37Å | 1.39Å | |
| C3 | C4 | doub | 1.39Å | 1.40Å | |
| C4 | C5 | sing | 1.51Å | 1.49Å | |
| C5 | C6 | sing | 1.53Å | 1.55Å | |
| C6 | C7 | sing | 1.54Å | 1.55Å | |
| C7 | C8 | sing | 1.53Å | 1.54Å | |
| C9 | C8 | sing | 1.53Å | 1.54Å | |
| C6 | C9 | sing | 1.54Å | 1.55Å | |
| C8 | C10 | sing | 1.53Å | 1.54Å | |
| C10 | N1 | sing | 1.48Å | 1.46Å | |
| C11 | N1 | sing | 1.48Å | 1.47Å | |
| C8 | C11 | sing | 1.53Å | 1.54Å | |
| N1 | C12 | sing | 1.35Å | 1.33Å | |
| C12 | O | doub | 1.22Å | 1.22Å | |
| N2 | C12 | sing | 1.35Å | 1.34Å | |
| N2 | C13 | sing | 1.47Å | 1.46Å | |
| C13 | C14 | sing | 1.52Å | 1.55Å | |
| C14 | C15 | sing | 1.53Å | 1.55Å | |
| C15 | C16 | sing | 1.54Å | 1.54Å | |
| C16 | C17 | sing | 1.54Å | 1.54Å | |
| C17 | C14 | sing | 1.53Å | 1.54Å | |
| N3 | C16 | sing | 1.47Å | 1.43Å | |
| N3 | C18 | sing | 1.34Å | 1.34Å | Aromatic |
| C18 | N4 | doub | 1.31Å | 1.33Å | Aromatic |
| N4 | C19 | sing | 1.33Å | 1.36Å | Aromatic |
| C19 | N5 | doub | 1.31Å | 1.34Å | Aromatic |
| N5 | N3 | sing | 1.40Å | 1.34Å | Aromatic |
| C20 | C19 | sing | 1.51Å | 1.48Å | |
| C20 | C21 | sing | 1.53Å | 1.51Å | |
| C21 | C22 | sing | 1.53Å | 1.48Å | |
| C22 | C20 | sing | 1.53Å | 1.51Å | |
| C14 | C23 | sing | 1.52Å | 1.54Å | |
| C23 | N2 | sing | 1.47Å | 1.47Å | |
| C24 | C4 | sing | 1.39Å | 1.40Å | |
| C24 | C25 | doub | 1.41Å | 1.40Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.37Å | Aromatic |
| C27 | N6 | sing | 1.33Å | 1.36Å | Aromatic |
| B | N6 | sing | 1.52Å | 1.54Å | |
| N6 | C24 | sing | 1.37Å | 1.39Å | Aromatic |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.08Å | 1.08Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C | H | sing | 1.08Å | 1.08Å | |
| C27 | H31 | sing | 1.08Å | 1.08Å | |
| C26 | H30 | sing | 1.08Å | 1.08Å | |
| C25 | H29 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F | B | F1 | 109.5° | 107.7° |
| F | B | N | 110.4° | 107.9° |
| F | B | N6 | 110.2° | 107.9° |
| F1 | B | N | 110.1° | 107.9° |
| F1 | B | N6 | 110.4° | 107.9° |
| B | N | C | 126.5° | 132.0° |
| B | N | C3 | 126.0° | 118.5° |
| N | B | N6 | 106.2° | 117.3° |
| N | C | C1 | 110.4° | 109.1° |
| C | N | C3 | 107.5° | 109.6° |
| N | C | H | 124.8° | 125.5° |
| C | C1 | C2 | 107.0° | 107.4° |
| C | C1 | H1 | 126.5° | 126.3° |
| C1 | C | H | 124.8° | 125.4° |
| C1 | C2 | C3 | 107.5° | 106.6° |
| C2 | C1 | H1 | 126.5° | 126.3° |
| C1 | C2 | H2 | 126.3° | 126.7° |
| C2 | C3 | N | 107.5° | 107.3° |
| C2 | C3 | C4 | 131.7° | 131.5° |
| C3 | C2 | H2 | 126.2° | 126.7° |
| N | C3 | C4 | 120.7° | 121.2° |
| C3 | C4 | C5 | 120.0° | 118.3° |
| C3 | C4 | C24 | 120.3° | 123.3° |
| C4 | C5 | C6 | 108.1° | 109.5° |
| C5 | C4 | C24 | 119.5° | 118.3° |
| C4 | C5 | H4 | 109.8° | 109.5° |
| C4 | C5 | H3 | 109.8° | 109.5° |
| C5 | C6 | C7 | 120.9° | 113.6° |
| C5 | C6 | C9 | 120.1° | 113.6° |
| C6 | C5 | H4 | 109.8° | 109.4° |
| C6 | C5 | H3 | 109.8° | 109.4° |
| C5 | C6 | H5 | 108.6° | 112.8° |
| C6 | C7 | C8 | 88.1° | 86.8° |
| C7 | C6 | C9 | 88.3° | 87.3° |
| C6 | C7 | H6 | 114.5° | 113.7° |
| C6 | C7 | H7 | 114.5° | 113.7° |
| C7 | C6 | H5 | 108.6° | 113.6° |
| C7 | C8 | C9 | 88.7° | 88.2° |
| C7 | C8 | C10 | 122.7° | 121.3° |
| C7 | C8 | C11 | 119.4° | 121.2° |
| C8 | C7 | H6 | 114.5° | 113.7° |
| C8 | C7 | H7 | 114.5° | 113.6° |
| C8 | C9 | C6 | 88.1° | 86.8° |
| C9 | C8 | C10 | 120.8° | 121.3° |
| C9 | C8 | C11 | 120.8° | 121.5° |
| C8 | C9 | H8 | 114.5° | 113.6° |
| C8 | C9 | H9 | 114.5° | 113.7° |
| C6 | C9 | H8 | 114.5° | 113.7° |
| C6 | C9 | H9 | 114.5° | 113.8° |
| C9 | C6 | H5 | 108.6° | 113.6° |
| C8 | C10 | N1 | 88.5° | 85.8° |
| C10 | C8 | C11 | 88.0° | 87.3° |
| C8 | C10 | H11 | 114.4° | 113.9° |
| C8 | C10 | H10 | 114.4° | 113.9° |
| C10 | N1 | C11 | 94.2° | 91.2° |
| C10 | N1 | C12 | 120.1° | 134.4° |
| N1 | C10 | H11 | 114.4° | 113.7° |
| N1 | C10 | H10 | 114.4° | 114.0° |
| N1 | C11 | C8 | 88.4° | 85.7° |
| C11 | N1 | C12 | 127.1° | 134.4° |
| N1 | C11 | H13 | 114.5° | 114.0° |
| N1 | C11 | H12 | 114.5° | 113.7° |
| C8 | C11 | H13 | 114.4° | 113.9° |
| C8 | C11 | H12 | 114.5° | 113.8° |
| N1 | C12 | O | 121.9° | 120.0° |
| N1 | C12 | N2 | 115.3° | 120.0° |
| O | C12 | N2 | 121.7° | 120.0° |
| C12 | N2 | C13 | 126.9° | 135.9° |
| C12 | N2 | C23 | 136.2° | 135.9° |
| N2 | C13 | C14 | 88.6° | 87.8° |
| C13 | N2 | C23 | 94.4° | 88.2° |
| N2 | C13 | H15 | 114.4° | 113.5° |
| N2 | C13 | H14 | 114.4° | 113.5° |
| C13 | C14 | C15 | 123.4° | 122.2° |
| C13 | C14 | C17 | 118.4° | 121.8° |
| C13 | C14 | C23 | 88.2° | 84.7° |
| C14 | C13 | H15 | 114.4° | 113.4° |
| C14 | C13 | H14 | 114.4° | 113.5° |
| C14 | C15 | C16 | 87.5° | 86.7° |
| C15 | C14 | C17 | 88.8° | 88.4° |
| C15 | C14 | C23 | 122.7° | 122.0° |
| C14 | C15 | H17 | 114.7° | 113.6° |
| C14 | C15 | H16 | 114.6° | 113.7° |
| C15 | C16 | C17 | 89.0° | 87.3° |
| C15 | C16 | N3 | 121.1° | 113.5° |
| C15 | C16 | H18 | 109.6° | 113.6° |
| C16 | C15 | H17 | 114.7° | 113.7° |
| C16 | C15 | H16 | 114.7° | 113.7° |
| C16 | C17 | C14 | 87.5° | 86.7° |
| C17 | C16 | N3 | 114.3° | 113.6° |
| C16 | C17 | H20 | 114.7° | 113.6° |
| C16 | C17 | H19 | 114.7° | 113.7° |
| C17 | C16 | H18 | 109.6° | 113.6° |
| C17 | C14 | C23 | 118.8° | 122.0° |
| C14 | C17 | H20 | 114.6° | 113.7° |
| C14 | C17 | H19 | 114.7° | 113.7° |
| C16 | N3 | C18 | 131.9° | 126.8° |
| C16 | N3 | N5 | 118.2° | 126.8° |
| N3 | C16 | H18 | 111.2° | 112.8° |
| N3 | C18 | N4 | 110.2° | 108.1° |
| C18 | N3 | N5 | 109.9° | 106.4° |
| N3 | C18 | H21 | 124.9° | 126.0° |
| C18 | N4 | C19 | 103.2° | 109.8° |
| N4 | C18 | H21 | 124.9° | 125.9° |
| N4 | C19 | N5 | 113.2° | 108.9° |
| N4 | C19 | C20 | 125.5° | 125.5° |
| C19 | N5 | N3 | 103.4° | 106.8° |
| N5 | C19 | C20 | 121.3° | 125.5° |
| C19 | C20 | C21 | 118.8° | 117.4° |
| C19 | C20 | C22 | 118.4° | 117.5° |
| C19 | C20 | H22 | 116.5° | 115.6° |
| C20 | C21 | C22 | 60.7° | 60.0° |
| C21 | C20 | C22 | 58.8° | 60.0° |
| C21 | C20 | H22 | 116.0° | 117.5° |
| C20 | C21 | H23 | 119.9° | 117.5° |
| C20 | C21 | H24 | 119.9° | 117.5° |
| C21 | C22 | C20 | 60.5° | 60.0° |
| C21 | C22 | H25 | 119.9° | 117.5° |
| C21 | C22 | H26 | 119.9° | 117.5° |
| C22 | C21 | H23 | 119.9° | 117.5° |
| C22 | C21 | H24 | 119.9° | 117.5° |
| C22 | C20 | H22 | 116.0° | 117.5° |
| C20 | C22 | H25 | 119.9° | 117.5° |
| C20 | C22 | H26 | 119.9° | 117.5° |
| C14 | C23 | N2 | 88.6° | 87.6° |
| C14 | C23 | H28 | 114.4° | 113.5° |
| C14 | C23 | H27 | 114.4° | 113.6° |
| N2 | C23 | H28 | 114.4° | 113.5° |
| N2 | C23 | H27 | 114.4° | 113.5° |
| C4 | C24 | C25 | 131.7° | 131.5° |
| C4 | C24 | N6 | 120.5° | 121.1° |
| C24 | C25 | C26 | 107.3° | 106.7° |
| C25 | C24 | N6 | 107.8° | 107.3° |
| C24 | C25 | H29 | 126.4° | 126.7° |
| C25 | C26 | C27 | 107.2° | 107.4° |
| C25 | C26 | H30 | 126.4° | 126.4° |
| C26 | C25 | H29 | 126.4° | 126.7° |
| C26 | C27 | N6 | 110.2° | 109.1° |
| C26 | C27 | H31 | 124.9° | 125.4° |
| C27 | C26 | H30 | 126.4° | 126.2° |
| C27 | N6 | B | 126.4° | 132.0° |
| C27 | N6 | C24 | 107.5° | 109.5° |
| N6 | C27 | H31 | 124.9° | 125.5° |
| B | N6 | C24 | 126.2° | 118.5° |
| H6 | C7 | H7 | 109.5° | 112.9° |
| H8 | C9 | H9 | 109.5° | 112.9° |
| H4 | C5 | H3 | 109.5° | 109.5° |
| H28 | C23 | H27 | 109.4° | 112.8° |
| H20 | C17 | H19 | 109.5° | 112.9° |
| H25 | C22 | H26 | 109.5° | 115.6° |
| H23 | C21 | H24 | 109.5° | 115.6° |
| H17 | C15 | H16 | 109.5° | 112.9° |
| H15 | C13 | H14 | 109.5° | 112.8° |
| H11 | C10 | H10 | 109.5° | 113.1° |
| H13 | C11 | H12 | 109.4° | 113.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F | B | F1 | N | 121.6° | 116.2° |
| F | B | F1 | N6 | 121.5° | 116.2° |
| F | B | N | N6 | 119.5° | 122.0° |
| F | B | N | C | 62.0° | 58.1° |
| F | B | N | C3 | 119.6° | 121.7° |
| F | B | N6 | C27 | 62.4° | 58.6° |
| F | B | N6 | C24 | 119.5° | 121.9° |
| F1 | B | N | N6 | 119.5° | 121.9° |
| F1 | B | N | C | 59.0° | 58.0° |
| F1 | B | N | C3 | 119.3° | 122.3° |
| F1 | B | N6 | C27 | 58.6° | 57.5° |
| F1 | B | N6 | C24 | 119.4° | 122.0° |
| B | N | C | C3 | 178.6° | 179.8° |
| B | N | C | C1 | 178.6° | 180.0° |
| B | N | C3 | C2 | 178.5° | 179.8° |
| B | N | C3 | C4 | 0.4° | 0.2° |
| N | B | N6 | C27 | 178.0° | 179.5° |
| N | B | N6 | C24 | 0.1° | 0.0° |
| B | N | C | H | 1.4° | 0.0° |
| N | C | C1 | H | 180.0° | 180.0° |
| N | C | C1 | C2 | 0.1° | 0.1° |
| C | N | C3 | C2 | 0.2° | 0.4° |
| C | N | C3 | C4 | 178.2° | 180.0° |
| C | N | B | N6 | 178.6° | 179.9° |
| N | C | C1 | H1 | 179.9° | 179.7° |
| C | C1 | C2 | H1 | 180.0° | 179.7° |
| C | C1 | C2 | C3 | 0.2° | 0.3° |
| C1 | C | N | C3 | 0.1° | 0.2° |
| C | C1 | C2 | H2 | 179.8° | 179.7° |
| C1 | C2 | C3 | H2 | 180.0° | 180.0° |
| C1 | C2 | C3 | N | 0.2° | 0.4° |
| C1 | C2 | C3 | C4 | 177.9° | 180.0° |
| C2 | C1 | C | H | 179.9° | 180.0° |
| C2 | C3 | N | C4 | 178.0° | 179.6° |
| C2 | C3 | C4 | C5 | 2.8° | 0.0° |
| C2 | C3 | C4 | C24 | 178.7° | 179.3° |
| C3 | C2 | C1 | H1 | 179.8° | 180.0° |
| N | C3 | C4 | C5 | 174.7° | 179.6° |
| N | C3 | C4 | C24 | 1.3° | 0.3° |
| C3 | N | B | N6 | 0.2° | 0.3° |
| N | C3 | C2 | H2 | 179.8° | 179.6° |
| C3 | N | C | H | 179.9° | 179.7° |
| C3 | C4 | C5 | C24 | 176.0° | 179.3° |
| C3 | C4 | C5 | C6 | 83.0° | 95.0° |
| C3 | C4 | C24 | C25 | 179.8° | 179.4° |
| C3 | C4 | C24 | N6 | 1.5° | 0.6° |
| C3 | C4 | C5 | H4 | 157.2° | 25.0° |
| C3 | C4 | C5 | H3 | 36.8° | 145.0° |
| C4 | C3 | C2 | H2 | 2.1° | 0.0° |
| C4 | C5 | C6 | H4 | 119.8° | 120.0° |
| C4 | C5 | C6 | H3 | 119.8° | 120.0° |
| C4 | C5 | C6 | C7 | 170.7° | 175.0° |
| C4 | C5 | C6 | C9 | 62.9° | 87.2° |
| C5 | C4 | C24 | C25 | 3.8° | 0.1° |
| C5 | C4 | C24 | N6 | 174.5° | 179.9° |
| C4 | C5 | H4 | H3 | 120.6° | 120.1° |
| C4 | C5 | C6 | H5 | 62.9° | 43.9° |
| C5 | C6 | C7 | C9 | 124.5° | 114.6° |
| C5 | C6 | C7 | H5 | 126.4° | 130.7° |
| C5 | C6 | C7 | C8 | 144.1° | 139.2° |
| C5 | C6 | C9 | C8 | 144.7° | 139.3° |
| C5 | C6 | C9 | H5 | 125.8° | 130.7° |
| C6 | C5 | C4 | C24 | 92.9° | 84.3° |
| C5 | C6 | C7 | H6 | 27.9° | 106.3° |
| C5 | C6 | C7 | H7 | 99.8° | 24.8° |
| C5 | C6 | C9 | H8 | 28.6° | 24.8° |
| C5 | C6 | C9 | H9 | 99.1° | 106.3° |
| C6 | C5 | H4 | H3 | 120.6° | 119.9° |
| C6 | C7 | C8 | H6 | 116.2° | 114.5° |
| C6 | C7 | C8 | H7 | 116.2° | 114.5° |
| C7 | C6 | C9 | C8 | 19.6° | 24.6° |
| C7 | C6 | C9 | H5 | 109.1° | 114.6° |
| C6 | C7 | C8 | C10 | 106.9° | 101.2° |
| C6 | C7 | C8 | C11 | 144.7° | 151.2° |
| C6 | C7 | H6 | H7 | 130.2° | 131.5° |
| C7 | C6 | C9 | H8 | 96.6° | 89.8° |
| C7 | C6 | C9 | H9 | 135.7° | 139.1° |
| C7 | C6 | C5 | H4 | 50.9° | 55.0° |
| C7 | C6 | C5 | H3 | 69.5° | 65.0° |
| C7 | C8 | C9 | C10 | 128.1° | 126.0° |
| C7 | C8 | C9 | C11 | 123.9° | 126.1° |
| C7 | C8 | C10 | C11 | 124.2° | 125.3° |
| C7 | C8 | C10 | N1 | 130.7° | 148.5° |
| C7 | C8 | C11 | N1 | 133.5° | 148.6° |
| C8 | C7 | H6 | H7 | 130.2° | 131.3° |
| C7 | C8 | C9 | H8 | 96.6° | 89.7° |
| C7 | C8 | C9 | H9 | 135.8° | 139.4° |
| C8 | C7 | C6 | H5 | 89.5° | 90.0° |
| C7 | C8 | C10 | H11 | 14.5° | 97.4° |
| C7 | C8 | C10 | H10 | 113.0° | 34.2° |
| C7 | C8 | C11 | H13 | 17.2° | 34.2° |
| C7 | C8 | C11 | H12 | 110.2° | 97.4° |
| C8 | C9 | C6 | H8 | 116.2° | 114.4° |
| C8 | C9 | C6 | H9 | 116.2° | 114.5° |
| C9 | C8 | C10 | C11 | 125.2° | 125.7° |
| C9 | C8 | C10 | N1 | 118.6° | 102.5° |
| C9 | C8 | C11 | N1 | 118.7° | 102.2° |
| C9 | C8 | C7 | H6 | 96.5° | 139.3° |
| C9 | C8 | C7 | H7 | 135.8° | 89.7° |
| C8 | C9 | H8 | H9 | 130.2° | 131.3° |
| C8 | C9 | C6 | H5 | 89.5° | 90.0° |
| C9 | C8 | C10 | H11 | 125.1° | 11.5° |
| C9 | C8 | C10 | H10 | 2.4° | 143.2° |
| C9 | C8 | C11 | H13 | 125.0° | 143.3° |
| C9 | C8 | C11 | H12 | 2.5° | 11.8° |
| C6 | C9 | C8 | C10 | 108.5° | 101.2° |
| C6 | C9 | C8 | C11 | 143.5° | 150.9° |
| C9 | C6 | C7 | H6 | 96.6° | 139.1° |
| C9 | C6 | C7 | H7 | 135.7° | 89.8° |
| C6 | C9 | H8 | H9 | 130.2° | 131.5° |
| C9 | C6 | C5 | H4 | 56.9° | 152.7° |
| C9 | C6 | C5 | H3 | 177.3° | 32.8° |
| C8 | C10 | N1 | H11 | 116.3° | 114.2° |
| C8 | C10 | N1 | H10 | 116.3° | 114.3° |
| C10 | C8 | C11 | N1 | 6.5° | 23.2° |
| C8 | C10 | N1 | C12 | 144.8° | 156.2° |
| C10 | C8 | C7 | H6 | 136.9° | 13.3° |
| C10 | C8 | C7 | H7 | 9.3° | 144.3° |
| C10 | C8 | C9 | H8 | 135.4° | 144.3° |
| C10 | C8 | C9 | H9 | 7.7° | 13.3° |
| C8 | C10 | H11 | H10 | 129.9° | 132.0° |
| C10 | C8 | C11 | H13 | 109.8° | 91.2° |
| C10 | C8 | C11 | H12 | 122.8° | 137.2° |
| C10 | N1 | C11 | C12 | 133.4° | 179.7° |
| C10 | N1 | C12 | O | 21.8° | 0.0° |
| C10 | N1 | C12 | N2 | 170.4° | 179.9° |
| N1 | C10 | H11 | H10 | 130.0° | 131.9° |
| C10 | N1 | C11 | H13 | 109.3° | 90.2° |
| C10 | N1 | C11 | H12 | 123.2° | 138.2° |
| N1 | C11 | C8 | H13 | 116.3° | 114.4° |
| N1 | C11 | C8 | H12 | 116.3° | 114.0° |
| C11 | N1 | C12 | O | 144.8° | 179.7° |
| C11 | N1 | C12 | N2 | 47.3° | 0.4° |
| C11 | N1 | C10 | H11 | 109.4° | 138.3° |
| C11 | N1 | C10 | H10 | 123.1° | 90.2° |
| N1 | C11 | H13 | H12 | 130.0° | 131.9° |
| C8 | C11 | N1 | C12 | 140.3° | 156.2° |
| C11 | C8 | C7 | H6 | 28.5° | 94.4° |
| C11 | C8 | C7 | H7 | 99.1° | 36.6° |
| C11 | C8 | C9 | H8 | 27.3° | 36.4° |
| C11 | C8 | C9 | H9 | 100.3° | 94.5° |
| C11 | C8 | C10 | H11 | 109.7° | 137.3° |
| C11 | C8 | C10 | H10 | 122.8° | 91.1° |
| C8 | C11 | H13 | H12 | 130.0° | 131.9° |
| N1 | C12 | O | N2 | 167.1° | 179.9° |
| N1 | C12 | N2 | C13 | 171.8° | 180.0° |
| N1 | C12 | N2 | C23 | 14.8° | 0.4° |
| C12 | N1 | C10 | H11 | 28.5° | 41.9° |
| C12 | N1 | C10 | H10 | 99.0° | 89.6° |
| C12 | N1 | C11 | H13 | 24.0° | 89.5° |
| C12 | N1 | C11 | H12 | 103.5° | 42.0° |
| O | C12 | N2 | C13 | 3.9° | 0.0° |
| O | C12 | N2 | C23 | 153.1° | 179.6° |
| C12 | N2 | C13 | C23 | 164.3° | 179.7° |
| C12 | N2 | C13 | C14 | 168.5° | 153.8° |
| C12 | N2 | C23 | C14 | 166.0° | 153.9° |
| C12 | N2 | C23 | H28 | 77.8° | 91.5° |
| C12 | N2 | C23 | H27 | 49.7° | 39.1° |
| C12 | N2 | C13 | H15 | 75.2° | 39.2° |
| C12 | N2 | C13 | H14 | 52.2° | 91.4° |
| N2 | C13 | C14 | H15 | 116.3° | 114.7° |
| N2 | C13 | C14 | H14 | 116.3° | 114.8° |
| N2 | C13 | C14 | C15 | 132.8° | 149.9° |
| N2 | C13 | C14 | C17 | 118.0° | 99.6° |
| C13 | N2 | C23 | C14 | 4.2° | 25.9° |
| C13 | N2 | C23 | H28 | 120.5° | 88.8° |
| C13 | N2 | C23 | H27 | 112.1° | 140.6° |
| N2 | C13 | H15 | H14 | 129.9° | 131.0° |
| C13 | C14 | C15 | C17 | 123.8° | 127.3° |
| C13 | C14 | C15 | C23 | 112.2° | 105.3° |
| C13 | C14 | C15 | C16 | 144.0° | 102.5° |
| C13 | C14 | C17 | C16 | 148.0° | 102.8° |
| C13 | C14 | C17 | C23 | 104.8° | 105.1° |
| C13 | C14 | C23 | H28 | 120.2° | 89.6° |
| C13 | C14 | C23 | H27 | 112.3° | 139.8° |
| C13 | C14 | C17 | H20 | 32.0° | 142.8° |
| C13 | C14 | C17 | H19 | 95.9° | 11.7° |
| C13 | C14 | C15 | H17 | 27.9° | 11.9° |
| C13 | C14 | C15 | H16 | 100.0° | 143.0° |
| C14 | C13 | H15 | H14 | 129.9° | 130.9° |
| C14 | C15 | C16 | H17 | 116.0° | 114.4° |
| C14 | C15 | C16 | H16 | 116.0° | 114.5° |
| C15 | C14 | C17 | C16 | 20.1° | 24.7° |
| C15 | C14 | C17 | C23 | 127.2° | 127.4° |
| C14 | C15 | C16 | N3 | 138.1° | 90.1° |
| C15 | C14 | C23 | N2 | 133.3° | 150.0° |
| C15 | C14 | C23 | H28 | 110.4° | 35.3° |
| C15 | C14 | C23 | H27 | 17.0° | 95.3° |
| C15 | C14 | C17 | H20 | 96.0° | 89.7° |
| C15 | C14 | C17 | H19 | 136.1° | 139.3° |
| C14 | C15 | C16 | H18 | 90.4° | 139.2° |
| C14 | C15 | H17 | H16 | 130.5° | 131.4° |
| C15 | C14 | C13 | H15 | 111.0° | 95.4° |
| C15 | C14 | C13 | H14 | 16.5° | 35.1° |
| C15 | C16 | C17 | N3 | 124.0° | 114.6° |
| C15 | C16 | C17 | H18 | 110.5° | 114.7° |
| C15 | C16 | N3 | H18 | 130.9° | 131.1° |
| C15 | C16 | N3 | C18 | 17.6° | 12.1° |
| C15 | C16 | N3 | N5 | 162.7° | 168.3° |
| C16 | C15 | C14 | C23 | 103.8° | 152.2° |
| C15 | C16 | C17 | H20 | 95.8° | 90.0° |
| C15 | C16 | C17 | H19 | 136.2° | 139.0° |
| C16 | C15 | H17 | H16 | 130.5° | 131.5° |
| C16 | C17 | C14 | H20 | 116.1° | 114.4° |
| C16 | C17 | C14 | H19 | 116.1° | 114.5° |
| C17 | C16 | N3 | H18 | 124.6° | 131.2° |
| C17 | C16 | N3 | C18 | 86.9° | 85.7° |
| C17 | C16 | N3 | N5 | 92.8° | 94.0° |
| C16 | C17 | C14 | C23 | 107.2° | 152.1° |
| C16 | C17 | H20 | H19 | 130.5° | 131.4° |
| C17 | C16 | C15 | H17 | 95.9° | 138.9° |
| C17 | C16 | C15 | H16 | 136.1° | 90.0° |
| C14 | C17 | C16 | N3 | 144.2° | 90.1° |
| C17 | C14 | C23 | N2 | 117.8° | 99.4° |
| C17 | C14 | C23 | H28 | 1.5° | 145.9° |
| C17 | C14 | C23 | H27 | 125.9° | 15.3° |
| C14 | C17 | H20 | H19 | 130.5° | 131.5° |
| C14 | C17 | C16 | H18 | 90.3° | 139.2° |
| C17 | C14 | C15 | H17 | 95.9° | 139.2° |
| C17 | C14 | C15 | H16 | 136.2° | 89.8° |
| C17 | C14 | C13 | H15 | 1.8° | 15.1° |
| C17 | C14 | C13 | H14 | 125.7° | 145.6° |
| C16 | N3 | C18 | N5 | 179.7° | 179.7° |
| C16 | N3 | C18 | N4 | 179.4° | 179.8° |
| C16 | N3 | N5 | C19 | 179.0° | 180.0° |
| N3 | C16 | C17 | H20 | 28.2° | 155.5° |
| N3 | C16 | C17 | H19 | 99.8° | 24.4° |
| C16 | N3 | C18 | H21 | 0.6° | 0.0° |
| N3 | C16 | C15 | H17 | 22.1° | 24.3° |
| N3 | C16 | C15 | H16 | 105.9° | 155.4° |
| N3 | C18 | N4 | H21 | 180.0° | 179.9° |
| N3 | C18 | N4 | C19 | 0.3° | 0.4° |
| C18 | N3 | N5 | C19 | 0.8° | 0.3° |
| C18 | N3 | C16 | H18 | 148.5° | 143.2° |
| C18 | N4 | C19 | N5 | 0.8° | 0.2° |
| N4 | C18 | N3 | N5 | 0.3° | 0.4° |
| C18 | N4 | C19 | C20 | 179.8° | 179.9° |
| N4 | C19 | N5 | C20 | 179.4° | 179.9° |
| N4 | C19 | N5 | N3 | 1.0° | 0.1° |
| N4 | C19 | C20 | C21 | 139.4° | 60.1° |
| N4 | C19 | C20 | C22 | 152.6° | 8.5° |
| N4 | C19 | C20 | H22 | 6.9° | 154.3° |
| C19 | N4 | C18 | H21 | 179.7° | 179.7° |
| N5 | C19 | C20 | C21 | 41.2° | 119.7° |
| N5 | C19 | C20 | C22 | 26.7° | 171.6° |
| N5 | C19 | C20 | H22 | 172.4° | 25.9° |
| N3 | N5 | C19 | C20 | 179.6° | 179.8° |
| N5 | N3 | C16 | H18 | 31.8° | 37.2° |
| N5 | N3 | C18 | H21 | 179.7° | 179.7° |
| C19 | C20 | C21 | C22 | 107.6° | 107.5° |
| C19 | C20 | C21 | H22 | 146.5° | 145.0° |
| C19 | C20 | C22 | H22 | 145.9° | 145.0° |
| C19 | C20 | C22 | H25 | 1.4° | 145.1° |
| C19 | C20 | C22 | H26 | 142.2° | 0.0° |
| C19 | C20 | C21 | H23 | 2.1° | 0.0° |
| C19 | C20 | C21 | H24 | 142.7° | 145.1° |
| C20 | C21 | C22 | H23 | 109.7° | 107.5° |
| C20 | C21 | C22 | H24 | 109.7° | 107.5° |
| C21 | C20 | C22 | H22 | 106.0° | 107.5° |
| C21 | C20 | C22 | H25 | 109.6° | 107.5° |
| C21 | C20 | C22 | H26 | 109.6° | 107.5° |
| C20 | C21 | H23 | H24 | 144.3° | 145.8° |
| C21 | C22 | H25 | H26 | 144.5° | 145.7° |
| C22 | C21 | H23 | H24 | 144.4° | 145.7° |
| C20 | C22 | H25 | H26 | 144.5° | 145.7° |
| C14 | C23 | N2 | H28 | 116.3° | 114.7° |
| C14 | C23 | N2 | H27 | 116.3° | 114.7° |
| C14 | C23 | H28 | H27 | 129.9° | 131.0° |
| C23 | C14 | C17 | H20 | 136.8° | 37.7° |
| C23 | C14 | C17 | H19 | 8.9° | 93.3° |
| C23 | C14 | C15 | H17 | 140.1° | 93.4° |
| C23 | C14 | C15 | H16 | 12.2° | 37.7° |
| C23 | C14 | C13 | H15 | 120.3° | 139.8° |
| C23 | C14 | C13 | H14 | 112.3° | 89.7° |
| N2 | C23 | H28 | H27 | 130.0° | 130.9° |
| C23 | N2 | C13 | H15 | 120.5° | 140.5° |
| C23 | N2 | C13 | H14 | 112.1° | 88.8° |
| C4 | C24 | C25 | N6 | 178.5° | 179.9° |
| C4 | C24 | C25 | C26 | 177.3° | 180.0° |
| C4 | C24 | N6 | C27 | 177.5° | 180.0° |
| C4 | C24 | N6 | B | 0.9° | 0.4° |
| C24 | C4 | C5 | H4 | 26.9° | 155.7° |
| C24 | C4 | C5 | H3 | 147.3° | 35.7° |
| C4 | C24 | C25 | H29 | 2.7° | 0.0° |
| C24 | C25 | C26 | H29 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 0.7° | 0.0° |
| C25 | C24 | N6 | C27 | 1.2° | 0.0° |
| C25 | C24 | N6 | B | 179.5° | 179.6° |
| C24 | C25 | C26 | H30 | 179.3° | 180.0° |
| C25 | C26 | C27 | H30 | 180.0° | 180.0° |
| C25 | C26 | C27 | N6 | 0.0° | 0.0° |
| C26 | C25 | C24 | N6 | 1.2° | 0.0° |
| C25 | C26 | C27 | H31 | 180.0° | 180.0° |
| C26 | C27 | N6 | H31 | 180.0° | 180.0° |
| C26 | C27 | N6 | B | 179.1° | 179.5° |
| C26 | C27 | N6 | C24 | 0.8° | 0.0° |
| C27 | C26 | C25 | H29 | 179.3° | 180.0° |
| C27 | N6 | B | C24 | 178.0° | 179.5° |
| N6 | C27 | C26 | H30 | 180.0° | 180.0° |
| B | N6 | C27 | H31 | 0.9° | 0.5° |
| C24 | N6 | C27 | H31 | 179.2° | 180.0° |
| N6 | C24 | C25 | H29 | 178.8° | 180.0° |
| H6 | C7 | C6 | H5 | 154.3° | 24.4° |
| H7 | C7 | C6 | H5 | 26.6° | 155.6° |
| H8 | C9 | C6 | H5 | 154.3° | 155.6° |
| H9 | C9 | C6 | H5 | 26.7° | 24.5° |
| H1 | C1 | C2 | H2 | 0.2° | 0.0° |
| H1 | C1 | C | H | 0.1° | 0.3° |
| H4 | C5 | C6 | H5 | 177.3° | 76.1° |
| H3 | C5 | C6 | H5 | 56.9° | 163.9° |
| H20 | C17 | C16 | H18 | 153.6° | 24.7° |
| H19 | C17 | C16 | H18 | 25.7° | 106.3° |
| H18 | C16 | C15 | H17 | 153.6° | 106.4° |
| H18 | C16 | C15 | H16 | 25.7° | 24.7° |
| H22 | C20 | C22 | H25 | 144.4° | 0.0° |
| H22 | C20 | C22 | H26 | 3.6° | 145.0° |
| H22 | C20 | C21 | H23 | 144.4° | 145.0° |
| H22 | C20 | C21 | H24 | 3.8° | 0.1° |
| H25 | C22 | C21 | H23 | 0.0° | 145.0° |
| H25 | C22 | C21 | H24 | 140.7° | 0.0° |
| H26 | C22 | C21 | H23 | 140.7° | 0.0° |
| H26 | C22 | C21 | H24 | 0.1° | 145.0° |
| H31 | C27 | C26 | H30 | 0.0° | 0.0° |
| H30 | C26 | C25 | H29 | 0.7° | 0.0° |
