5XH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N1 | sing | 1.47Å | 1.46Å | |
| C27 | N1 | sing | 1.47Å | 1.46Å | |
| N1 | C2 | sing | 1.47Å | 1.45Å | |
| C8 | C7 | sing | 1.47Å | 1.53Å | |
| C8 | C9 | sing | 1.53Å | 1.52Å | |
| C24 | C23 | sing | 1.51Å | 1.51Å | |
| C2 | C3 | sing | 1.51Å | 1.52Å | |
| C7 | C6 | sing | 1.55Å | 1.54Å | |
| C4 | C3 | doub | 1.33Å | 1.54Å | |
| C4 | C5 | sing | 1.47Å | 1.51Å | |
| C9 | C10 | sing | 1.51Å | 1.54Å | |
| C10 | N3 | sing | 1.47Å | 1.47Å | |
| C10 | C26 | sing | 1.54Å | 1.55Å | |
| C23 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C23 | C25 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | N2 | sing | 1.44Å | 1.47Å | |
| C5 | N2 | sing | 1.35Å | 1.36Å | |
| C5 | O2 | doub | 1.22Å | 1.23Å | |
| N2 | C26 | sing | 1.48Å | 1.46Å | |
| C22 | C21 | sing | 1.39Å | 1.38Å | Aromatic |
| N3 | C25 | sing | 1.38Å | 1.44Å | Aromatic |
| N3 | C11 | sing | 1.36Å | 1.45Å | Aromatic |
| C25 | C19 | doub | 1.40Å | 1.41Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | N4 | sing | 1.38Å | 1.45Å | |
| C11 | N6 | doub | 1.31Å | 1.31Å | Aromatic |
| C19 | C20 | sing | 1.40Å | 1.39Å | Aromatic |
| C19 | N6 | sing | 1.36Å | 1.39Å | Aromatic |
| C17 | C16 | sing | 1.51Å | 1.50Å | |
| N4 | C12 | sing | 1.35Å | 1.38Å | |
| C18 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C13 | sing | 1.40Å | 1.39Å | Aromatic |
| C16 | N5 | sing | 1.32Å | 1.35Å | Aromatic |
| C12 | C13 | sing | 1.48Å | 1.50Å | |
| C12 | O1 | doub | 1.22Å | 1.23Å | |
| C13 | C14 | doub | 1.40Å | 1.39Å | Aromatic |
| N5 | C15 | doub | 1.32Å | 1.34Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.08Å | 1.08Å | |
| C14 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.08Å | 1.08Å | |
| C20 | H14 | sing | 1.08Å | 1.08Å | |
| C21 | H15 | sing | 1.08Å | 1.08Å | |
| C22 | H16 | sing | 1.08Å | 1.08Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | H20 | sing | 1.09Å | 1.10Å | |
| C26 | H21 | sing | 1.09Å | 1.10Å | |
| C27 | H22 | sing | 1.09Å | 1.10Å | |
| C27 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C4 | H25 | sing | 1.08Å | 1.08Å | |
| C10 | H28 | sing | 1.09Å | 1.10Å | |
| C9 | H29 | sing | 1.09Å | 1.10Å | |
| C9 | H30 | sing | 1.09Å | 1.10Å | |
| C8 | H31 | sing | 1.09Å | 1.10Å | |
| C8 | H32 | sing | 1.09Å | 1.10Å | |
| C7 | H33 | sing | 1.09Å | 1.10Å | |
| C6 | H34 | sing | 1.09Å | 1.10Å | |
| N4 | H35 | sing | 0.97Å | 1.00Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H26 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N1 | C27 | 110.3° | 111.0° |
| C1 | N1 | C2 | 109.7° | 111.0° |
| N1 | C1 | H1 | 109.5° | 109.4° |
| N1 | C1 | H2 | 109.5° | 109.5° |
| N1 | C1 | H3 | 109.5° | 109.5° |
| C27 | N1 | C2 | 110.1° | 111.0° |
| N1 | C27 | H22 | 109.5° | 109.5° |
| N1 | C27 | H23 | 109.5° | 109.5° |
| N1 | C27 | H24 | 109.5° | 109.5° |
| N1 | C2 | C3 | 114.1° | 109.5° |
| N1 | C2 | H4 | 108.3° | 109.5° |
| N1 | C2 | H5 | 108.3° | 109.5° |
| C7 | C8 | C9 | 116.3° | 114.3° |
| C8 | C7 | C6 | 123.0° | 110.3° |
| C7 | C8 | H31 | 107.7° | 108.5° |
| C7 | C8 | H32 | 107.7° | 108.5° |
| C8 | C7 | H33 | 106.0° | 109.3° |
| C8 | C7 | H7 | 106.0° | 109.3° |
| C8 | C9 | C10 | 115.3° | 109.4° |
| C8 | C9 | H29 | 108.0° | 109.5° |
| C8 | C9 | H30 | 108.0° | 109.5° |
| C9 | C8 | H31 | 107.7° | 108.5° |
| C9 | C8 | H32 | 107.8° | 108.5° |
| C24 | C23 | C22 | 119.7° | 120.1° |
| C24 | C23 | C25 | 122.2° | 120.1° |
| C23 | C24 | H17 | 109.5° | 109.5° |
| C23 | C24 | H18 | 109.5° | 109.5° |
| C23 | C24 | H19 | 109.5° | 109.5° |
| C2 | C3 | C4 | 114.1° | 120.0° |
| C3 | C2 | H4 | 108.3° | 109.5° |
| C3 | C2 | H5 | 108.3° | 109.5° |
| C2 | C3 | H6 | 123.0° | 120.0° |
| C7 | C6 | N2 | 116.9° | 109.7° |
| C6 | C7 | H33 | 106.0° | 109.4° |
| C7 | C6 | H34 | 107.6° | 109.5° |
| C6 | C7 | H7 | 106.0° | 109.3° |
| C7 | C6 | H26 | 107.6° | 109.4° |
| C3 | C4 | C5 | 111.3° | 120.0° |
| C4 | C3 | H6 | 123.0° | 120.0° |
| C3 | C4 | H25 | 124.3° | 120.0° |
| C4 | C5 | N2 | 118.5° | 120.0° |
| C4 | C5 | O2 | 118.9° | 120.0° |
| C5 | C4 | H25 | 124.4° | 120.0° |
| C9 | C10 | N3 | 115.0° | 109.3° |
| C9 | C10 | C26 | 115.8° | 110.1° |
| C9 | C10 | H28 | 107.0° | 109.3° |
| C10 | C9 | H29 | 108.0° | 109.5° |
| C10 | C9 | H30 | 108.0° | 109.5° |
| N3 | C10 | C26 | 103.7° | 109.4° |
| C10 | N3 | C25 | 126.8° | 126.4° |
| C10 | N3 | C11 | 128.3° | 126.4° |
| N3 | C10 | H28 | 107.8° | 109.3° |
| C10 | C26 | N2 | 120.1° | 112.1° |
| C10 | C26 | H20 | 106.7° | 109.0° |
| C10 | C26 | H21 | 106.7° | 108.9° |
| C26 | C10 | H28 | 107.0° | 109.4° |
| C22 | C23 | C25 | 118.0° | 119.9° |
| C23 | C22 | C21 | 121.7° | 120.4° |
| C23 | C22 | H16 | 119.2° | 119.8° |
| C23 | C25 | N3 | 135.9° | 133.9° |
| C23 | C25 | C19 | 120.4° | 120.0° |
| C6 | N2 | C5 | 123.9° | 118.6° |
| C6 | N2 | C26 | 118.7° | 122.7° |
| N2 | C6 | H34 | 107.6° | 109.5° |
| N2 | C6 | H26 | 107.6° | 109.5° |
| N2 | C5 | O2 | 122.2° | 120.0° |
| C5 | N2 | C26 | 116.6° | 118.6° |
| N2 | C26 | H20 | 106.7° | 109.0° |
| N2 | C26 | H21 | 106.8° | 108.9° |
| C22 | C21 | C20 | 120.5° | 120.5° |
| C22 | C21 | H15 | 119.7° | 119.7° |
| C21 | C22 | H16 | 119.2° | 119.7° |
| C25 | N3 | C11 | 104.6° | 107.2° |
| N3 | C25 | C19 | 103.7° | 106.2° |
| N3 | C11 | N4 | 123.4° | 125.1° |
| N3 | C11 | N6 | 113.4° | 109.9° |
| C25 | C19 | C20 | 120.0° | 119.5° |
| C25 | C19 | N6 | 113.6° | 107.1° |
| C21 | C20 | C19 | 119.4° | 119.8° |
| C21 | C20 | H14 | 120.3° | 120.1° |
| C20 | C21 | H15 | 119.8° | 119.8° |
| N4 | C11 | N6 | 122.9° | 125.0° |
| C11 | N4 | C12 | 123.7° | 120.0° |
| C11 | N4 | H35 | 118.2° | 120.0° |
| C11 | N6 | C19 | 104.7° | 109.6° |
| C20 | C19 | N6 | 126.4° | 133.4° |
| C19 | C20 | H14 | 120.3° | 120.1° |
| C17 | C16 | C18 | 121.3° | 119.6° |
| C17 | C16 | N5 | 116.3° | 119.6° |
| C16 | C17 | H10 | 109.5° | 109.5° |
| C16 | C17 | H11 | 109.5° | 109.5° |
| C16 | C17 | H12 | 109.5° | 109.5° |
| N4 | C12 | C13 | 116.7° | 120.0° |
| N4 | C12 | O1 | 122.3° | 120.0° |
| C12 | N4 | H35 | 118.1° | 120.0° |
| C16 | C18 | C13 | 119.1° | 119.0° |
| C18 | C16 | N5 | 122.4° | 120.8° |
| C16 | C18 | H13 | 120.4° | 120.5° |
| C18 | C13 | C12 | 123.0° | 120.9° |
| C18 | C13 | C14 | 118.5° | 118.2° |
| C13 | C18 | H13 | 120.4° | 120.5° |
| C16 | N5 | C15 | 117.4° | 122.1° |
| C13 | C12 | O1 | 121.0° | 120.0° |
| C12 | C13 | C14 | 118.4° | 120.9° |
| C13 | C14 | C15 | 118.7° | 118.9° |
| C13 | C14 | H8 | 120.6° | 120.5° |
| N5 | C15 | C14 | 123.8° | 120.9° |
| N5 | C15 | H9 | 118.1° | 119.5° |
| C15 | C14 | H8 | 120.7° | 120.5° |
| C14 | C15 | H9 | 118.1° | 119.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.4° |
| H2 | C1 | H3 | 109.4° | 109.5° |
| H4 | C2 | H5 | 109.5° | 109.5° |
| H10 | C17 | H11 | 109.5° | 109.4° |
| H10 | C17 | H12 | 109.5° | 109.5° |
| H11 | C17 | H12 | 109.5° | 109.5° |
| H17 | C24 | H18 | 109.4° | 109.5° |
| H17 | C24 | H19 | 109.4° | 109.4° |
| H18 | C24 | H19 | 109.5° | 109.5° |
| H20 | C26 | H21 | 109.5° | 108.9° |
| H22 | C27 | H23 | 109.5° | 109.5° |
| H22 | C27 | H24 | 109.5° | 109.4° |
| H23 | C27 | H24 | 109.5° | 109.5° |
| H29 | C9 | H30 | 109.5° | 109.5° |
| H31 | C8 | H32 | 109.5° | 108.3° |
| H33 | C7 | H7 | 109.5° | 109.2° |
| H34 | C6 | H26 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N1 | C27 | C2 | 121.2° | 124.0° |
| C1 | N1 | C2 | C3 | 125.0° | 66.0° |
| N1 | C1 | H1 | H2 | 120.0° | 120.0° |
| N1 | C1 | H1 | H3 | 120.0° | 119.9° |
| N1 | C1 | H2 | H3 | 120.0° | 120.1° |
| C1 | N1 | C2 | H4 | 114.3° | 174.0° |
| C1 | N1 | C2 | H5 | 4.3° | 54.0° |
| C1 | N1 | C27 | H22 | 180.0° | 56.0° |
| C1 | N1 | C27 | H23 | 60.0° | 176.0° |
| C1 | N1 | C27 | H24 | 60.0° | 63.9° |
| C27 | N1 | C2 | C3 | 113.4° | 170.0° |
| C27 | N1 | C1 | H1 | 180.0° | 59.9° |
| C27 | N1 | C1 | H2 | 60.0° | 179.9° |
| C27 | N1 | C1 | H3 | 60.0° | 59.9° |
| C27 | N1 | C2 | H4 | 7.3° | 50.0° |
| C27 | N1 | C2 | H5 | 125.9° | 70.0° |
| N1 | C27 | H22 | H23 | 120.0° | 120.0° |
| N1 | C27 | H22 | H24 | 120.0° | 120.0° |
| N1 | C27 | H23 | H24 | 120.0° | 120.1° |
| N1 | C2 | C3 | H4 | 120.7° | 120.0° |
| N1 | C2 | C3 | H5 | 120.7° | 120.0° |
| N1 | C2 | C3 | C4 | 41.1° | 125.0° |
| C2 | N1 | C1 | H1 | 58.6° | 64.0° |
| C2 | N1 | C1 | H2 | 61.4° | 56.0° |
| C2 | N1 | C1 | H3 | 178.6° | 176.1° |
| N1 | C2 | H4 | H5 | 117.9° | 120.0° |
| N1 | C2 | C3 | H6 | 138.9° | 55.0° |
| C2 | N1 | C27 | H22 | 58.8° | 180.0° |
| C2 | N1 | C27 | H23 | 178.8° | 60.0° |
| C2 | N1 | C27 | H24 | 61.2° | 60.0° |
| C7 | C8 | C9 | H31 | 121.0° | 121.3° |
| C7 | C8 | C9 | H32 | 121.0° | 121.2° |
| C8 | C7 | C6 | H33 | 121.9° | 120.2° |
| C8 | C7 | C6 | H7 | 121.9° | 120.2° |
| C7 | C8 | C9 | C10 | 77.4° | 85.0° |
| C8 | C7 | C6 | N2 | 9.2° | 71.3° |
| C7 | C8 | C9 | H29 | 161.8° | 35.0° |
| C7 | C8 | C9 | H30 | 43.5° | 155.0° |
| C7 | C8 | H31 | H32 | 116.9° | 117.6° |
| C8 | C7 | H33 | H7 | 113.9° | 119.5° |
| C8 | C7 | C6 | H34 | 111.9° | 48.8° |
| C8 | C7 | C6 | H26 | 130.3° | 168.7° |
| C9 | C8 | C7 | C6 | 54.9° | 62.8° |
| C8 | C9 | C10 | H29 | 120.8° | 120.0° |
| C8 | C9 | C10 | H30 | 120.8° | 120.0° |
| C8 | C9 | C10 | N3 | 179.1° | 147.9° |
| C8 | C9 | C10 | C26 | 59.8° | 91.9° |
| C8 | C9 | C10 | H28 | 59.4° | 28.3° |
| C8 | C9 | H29 | H30 | 117.4° | 120.0° |
| C9 | C8 | H31 | H32 | 116.9° | 117.6° |
| C9 | C8 | C7 | H33 | 67.0° | 57.5° |
| C9 | C8 | C7 | H7 | 176.7° | 177.0° |
| C24 | C23 | C22 | C25 | 178.4° | 179.7° |
| C24 | C23 | C22 | C21 | 177.4° | 179.9° |
| C24 | C23 | C25 | N3 | 0.9° | 0.2° |
| C24 | C23 | C25 | C19 | 179.2° | 179.9° |
| C24 | C23 | C22 | H16 | 2.6° | 0.1° |
| C23 | C24 | H17 | H18 | 120.0° | 120.1° |
| C23 | C24 | H17 | H19 | 120.0° | 120.0° |
| C23 | C24 | H18 | H19 | 120.0° | 120.0° |
| C2 | C3 | C4 | H6 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 136.5° | 180.0° |
| C3 | C2 | H4 | H5 | 117.9° | 120.0° |
| C2 | C3 | C4 | H25 | 43.5° | 0.0° |
| C7 | C6 | N2 | H34 | 121.1° | 120.1° |
| C7 | C6 | N2 | H26 | 121.1° | 120.0° |
| C7 | C6 | N2 | C5 | 124.6° | 89.1° |
| C7 | C6 | N2 | C26 | 65.9° | 90.8° |
| C6 | C7 | C8 | H31 | 66.1° | 176.0° |
| C6 | C7 | C8 | H32 | 175.9° | 58.5° |
| C6 | C7 | H33 | H7 | 113.9° | 119.6° |
| C7 | C6 | H34 | H26 | 116.6° | 119.8° |
| C3 | C4 | C5 | H25 | 180.0° | 180.0° |
| C3 | C4 | C5 | N2 | 135.1° | 180.0° |
| C3 | C4 | C5 | O2 | 37.8° | 0.0° |
| C4 | C3 | C2 | H4 | 161.8° | 115.0° |
| C4 | C3 | C2 | H5 | 79.5° | 5.0° |
| C4 | C5 | N2 | C6 | 30.3° | 0.1° |
| C4 | C5 | N2 | O2 | 172.6° | 180.0° |
| C4 | C5 | N2 | C26 | 160.0° | 180.0° |
| C5 | C4 | C3 | H6 | 43.5° | 0.0° |
| C9 | C10 | N3 | C26 | 127.5° | 120.6° |
| C9 | C10 | N3 | H28 | 119.3° | 119.6° |
| C9 | C10 | C26 | H28 | 119.2° | 120.1° |
| C9 | C10 | C26 | N2 | 55.6° | 40.6° |
| C9 | C10 | N3 | C25 | 140.3° | 114.9° |
| C9 | C10 | N3 | C11 | 47.0° | 65.1° |
| C9 | C10 | C26 | H20 | 177.1° | 80.1° |
| C9 | C10 | C26 | H21 | 65.9° | 161.2° |
| C10 | C9 | H29 | H30 | 117.4° | 120.1° |
| C10 | C9 | C8 | H31 | 43.6° | 153.7° |
| C10 | C9 | C8 | H32 | 161.7° | 36.2° |
| N3 | C10 | C26 | H28 | 113.8° | 119.7° |
| C10 | N3 | C25 | C23 | 5.7° | 0.4° |
| N3 | C10 | C26 | N2 | 177.4° | 160.7° |
| C10 | N3 | C25 | C11 | 174.1° | 180.0° |
| C10 | N3 | C25 | C19 | 172.7° | 179.8° |
| C10 | N3 | C11 | N4 | 1.3° | 0.0° |
| C10 | N3 | C11 | N6 | 173.6° | 179.8° |
| N3 | C10 | C26 | H20 | 55.9° | 40.1° |
| N3 | C10 | C26 | H21 | 61.1° | 78.6° |
| N3 | C10 | C9 | H29 | 58.3° | 92.1° |
| N3 | C10 | C9 | H30 | 60.0° | 28.0° |
| C10 | C26 | N2 | C6 | 75.5° | 42.1° |
| C10 | C26 | N2 | C5 | 114.3° | 137.8° |
| C10 | C26 | N2 | H20 | 121.5° | 120.7° |
| C10 | C26 | N2 | H21 | 121.5° | 120.6° |
| C26 | C10 | N3 | C25 | 92.2° | 124.5° |
| C26 | C10 | N3 | C11 | 80.4° | 55.5° |
| C10 | C26 | H20 | H21 | 115.2° | 118.7° |
| C26 | C10 | C9 | H29 | 179.4° | 28.1° |
| C26 | C10 | C9 | H30 | 61.1° | 148.1° |
| C23 | C22 | C21 | H16 | 180.0° | 180.0° |
| C22 | C23 | C25 | N3 | 177.4° | 179.9° |
| C22 | C23 | C25 | C19 | 0.8° | 0.4° |
| C23 | C22 | C21 | C20 | 1.6° | 0.0° |
| C23 | C22 | C21 | H15 | 178.4° | 179.9° |
| C22 | C23 | C24 | H17 | 89.2° | 97.4° |
| C22 | C23 | C24 | H18 | 150.8° | 142.5° |
| C22 | C23 | C24 | H19 | 30.8° | 22.5° |
| C25 | C23 | C22 | C21 | 1.0° | 0.2° |
| C23 | C25 | N3 | C19 | 178.4° | 179.7° |
| C23 | C25 | N3 | C11 | 179.8° | 179.6° |
| C23 | C25 | C19 | C20 | 2.1° | 0.3° |
| C23 | C25 | C19 | N6 | 179.2° | 179.8° |
| C25 | C23 | C22 | H16 | 179.0° | 179.8° |
| C25 | C23 | C24 | H17 | 89.1° | 82.8° |
| C25 | C23 | C24 | H18 | 30.9° | 37.2° |
| C25 | C23 | C24 | H19 | 150.9° | 157.2° |
| C6 | N2 | C5 | C26 | 169.7° | 180.0° |
| C6 | N2 | C5 | O2 | 142.4° | 180.0° |
| C6 | N2 | C26 | H20 | 163.0° | 162.8° |
| C6 | N2 | C26 | H21 | 46.0° | 78.5° |
| N2 | C6 | C7 | H33 | 131.1° | 48.9° |
| N2 | C6 | H34 | H26 | 116.6° | 119.9° |
| N2 | C6 | C7 | H7 | 112.7° | 168.5° |
| C5 | N2 | C26 | H20 | 7.2° | 17.1° |
| C5 | N2 | C26 | H21 | 124.3° | 101.6° |
| N2 | C5 | C4 | H25 | 44.9° | 0.1° |
| C5 | N2 | C6 | H34 | 114.3° | 150.8° |
| C5 | N2 | C6 | H26 | 3.5° | 30.9° |
| O2 | C5 | N2 | C26 | 27.3° | 0.0° |
| O2 | C5 | C4 | H25 | 142.2° | 180.0° |
| N2 | C26 | H20 | H21 | 115.2° | 118.7° |
| N2 | C26 | C10 | H28 | 63.5° | 79.5° |
| C26 | N2 | C6 | H34 | 55.2° | 29.3° |
| C26 | N2 | C6 | H26 | 173.0° | 149.2° |
| C22 | C21 | C20 | H15 | 180.0° | 179.9° |
| C22 | C21 | C20 | C19 | 0.4° | 0.0° |
| C22 | C21 | C20 | H14 | 179.6° | 180.0° |
| C25 | N3 | C11 | N4 | 175.2° | 180.0° |
| C25 | N3 | C11 | N6 | 0.4° | 0.2° |
| N3 | C25 | C19 | C20 | 176.7° | 179.9° |
| N3 | C25 | C19 | N6 | 2.0° | 0.0° |
| C25 | N3 | C10 | H28 | 21.0° | 4.7° |
| C11 | N3 | C25 | C19 | 1.4° | 0.1° |
| N3 | C11 | N4 | N6 | 174.4° | 179.8° |
| N3 | C11 | N6 | C19 | 0.8° | 0.2° |
| N3 | C11 | N4 | C12 | 177.1° | 179.7° |
| C11 | N3 | C10 | H28 | 166.3° | 175.3° |
| N3 | C11 | N4 | H35 | 2.9° | 0.2° |
| C25 | C19 | C20 | C21 | 1.5° | 0.1° |
| C25 | C19 | N6 | C11 | 1.8° | 0.1° |
| C25 | C19 | C20 | N6 | 178.5° | 179.9° |
| C25 | C19 | C20 | H14 | 178.6° | 179.8° |
| C21 | C20 | C19 | H14 | 180.0° | 180.0° |
| C21 | C20 | C19 | N6 | 180.0° | 180.0° |
| C20 | C21 | C22 | H16 | 178.4° | 180.0° |
| N4 | C11 | N6 | C19 | 174.1° | 180.0° |
| C11 | N4 | C12 | H35 | 180.0° | 179.9° |
| C11 | N4 | C12 | C13 | 178.9° | 180.0° |
| C11 | N4 | C12 | O1 | 3.3° | 0.1° |
| C11 | N6 | C19 | C20 | 176.8° | 180.0° |
| N6 | C11 | N4 | C12 | 8.5° | 0.1° |
| N6 | C11 | N4 | H35 | 171.5° | 179.9° |
| C19 | C20 | C21 | H15 | 179.7° | 180.0° |
| N6 | C19 | C20 | H14 | 0.1° | 0.1° |
| C17 | C16 | C18 | N5 | 179.3° | 179.6° |
| C17 | C16 | C18 | C13 | 178.4° | 179.7° |
| C17 | C16 | N5 | C15 | 179.9° | 180.0° |
| C16 | C17 | H10 | H11 | 120.0° | 120.0° |
| C16 | C17 | H10 | H12 | 120.0° | 120.0° |
| C16 | C17 | H11 | H12 | 120.0° | 120.0° |
| C17 | C16 | C18 | H13 | 1.6° | 0.4° |
| N4 | C12 | C13 | C18 | 11.8° | 179.7° |
| N4 | C12 | C13 | O1 | 177.9° | 180.0° |
| N4 | C12 | C13 | C14 | 164.5° | 0.0° |
| C16 | C18 | C13 | H13 | 180.0° | 179.9° |
| C16 | C18 | C13 | C12 | 174.5° | 180.0° |
| C16 | C18 | C13 | C14 | 1.8° | 0.2° |
| C18 | C16 | N5 | C15 | 0.5° | 0.4° |
| C18 | C16 | C17 | H10 | 179.4° | 90.3° |
| C18 | C16 | C17 | H11 | 60.6° | 29.7° |
| C18 | C16 | C17 | H12 | 59.3° | 149.7° |
| C13 | C18 | C16 | N5 | 0.9° | 0.1° |
| C18 | C13 | C12 | C14 | 176.3° | 179.7° |
| C18 | C13 | C12 | O1 | 166.1° | 0.3° |
| C18 | C13 | C14 | C15 | 1.5° | 0.2° |
| C18 | C13 | C14 | H8 | 178.6° | 179.7° |
| C16 | N5 | C15 | C14 | 0.9° | 0.3° |
| C16 | N5 | C15 | H9 | 179.1° | 179.7° |
| N5 | C16 | C17 | H10 | 0.0° | 90.1° |
| N5 | C16 | C17 | H11 | 120.0° | 150.0° |
| N5 | C16 | C17 | H12 | 120.0° | 29.9° |
| N5 | C16 | C18 | H13 | 179.1° | 180.0° |
| C12 | C13 | C14 | C15 | 175.0° | 180.0° |
| C12 | C13 | C14 | H8 | 5.0° | 0.0° |
| C12 | C13 | C18 | H13 | 5.6° | 0.0° |
| C13 | C12 | N4 | H35 | 1.1° | 0.1° |
| O1 | C12 | C13 | C14 | 17.6° | 180.0° |
| O1 | C12 | N4 | H35 | 176.7° | 179.9° |
| C13 | C14 | C15 | N5 | 0.1° | 0.0° |
| C13 | C14 | C15 | H8 | 180.0° | 180.0° |
| C13 | C14 | C15 | H9 | 179.9° | 180.0° |
| C14 | C13 | C18 | H13 | 178.1° | 179.7° |
| N5 | C15 | C14 | H9 | 180.0° | 180.0° |
| N5 | C15 | C14 | H8 | 179.9° | 180.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H4 | C2 | C3 | H6 | 18.2° | 65.0° |
| H5 | C2 | C3 | H6 | 100.5° | 175.1° |
| H6 | C3 | C4 | H25 | 136.5° | 179.9° |
| H8 | C14 | C15 | H9 | 0.1° | 0.0° |
| H10 | C17 | H11 | H12 | 120.0° | 120.0° |
| H14 | C20 | C21 | H15 | 0.4° | 0.1° |
| H15 | C21 | C22 | H16 | 1.6° | 0.1° |
| H17 | C24 | H18 | H19 | 119.9° | 119.9° |
| H20 | C26 | C10 | H28 | 58.0° | 159.8° |
| H21 | C26 | C10 | H28 | 175.0° | 41.1° |
| H22 | C27 | H23 | H24 | 120.0° | 120.0° |
| H28 | C10 | C9 | H29 | 61.5° | 148.3° |
| H28 | C10 | C9 | H30 | 179.8° | 91.7° |
| H29 | C9 | C8 | H31 | 77.2° | 86.3° |
| H29 | C9 | C8 | H32 | 40.8° | 156.2° |
| H30 | C9 | C8 | H31 | 164.5° | 33.7° |
| H30 | C9 | C8 | H32 | 77.5° | 83.8° |
| H31 | C8 | C7 | H33 | 172.0° | 63.7° |
| H31 | C8 | C7 | H7 | 55.8° | 55.7° |
| H32 | C8 | C7 | H33 | 54.0° | 178.8° |
| H32 | C8 | C7 | H7 | 62.3° | 61.8° |
| H33 | C7 | C6 | H34 | 10.0° | 169.0° |
| H33 | C7 | C6 | H26 | 107.9° | 71.2° |
| H34 | C6 | C7 | H7 | 126.3° | 71.4° |
| H7 | C7 | C6 | H26 | 8.4° | 48.4° |
