0UX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C17 | sing | 1.53Å | 1.52Å | |
| C16 | C22 | sing | 1.53Å | 1.51Å | |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C13 | N6 | sing | 1.46Å | 1.45Å | |
| C22 | C23 | sing | 1.53Å | 1.52Å | |
| C15 | C14 | sing | 1.53Å | 1.54Å | |
| N6 | C12 | sing | 1.38Å | 1.35Å | |
| C18 | C20 | sing | 1.53Å | 1.51Å | |
| C18 | C19 | sing | 1.53Å | 1.54Å | |
| C23 | C20 | sing | 1.53Å | 1.52Å | |
| C23 | C21 | sing | 1.53Å | 1.54Å | |
| C14 | C19 | sing | 1.53Å | 1.53Å | |
| C14 | C21 | sing | 1.53Å | 1.53Å | |
| C14 | C11 | sing | 1.53Å | 1.54Å | |
| C12 | N7 | doub | 1.31Å | 1.31Å | Aromatic |
| C12 | N5 | sing | 1.36Å | 1.36Å | Aromatic |
| N4 | C11 | sing | 1.47Å | 1.46Å | |
| N4 | C10 | sing | 1.47Å | 1.47Å | |
| N7 | C7 | sing | 1.36Å | 1.38Å | Aromatic |
| N5 | C6 | sing | 1.39Å | 1.36Å | Aromatic |
| C10 | C9 | sing | 1.53Å | 1.52Å | |
| C7 | C6 | doub | 1.41Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.40Å | 1.42Å | Aromatic |
| C9 | C8 | sing | 1.51Å | 1.49Å | |
| C6 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C3 | doub | 1.39Å | 1.41Å | Aromatic |
| C5 | C2 | doub | 1.39Å | 1.41Å | Aromatic |
| C3 | C2 | sing | 1.42Å | 1.40Å | Aromatic |
| C3 | N2 | sing | 1.36Å | 1.43Å | |
| C2 | C1 | sing | 1.47Å | 1.46Å | |
| N2 | C4 | doub | 1.31Å | 1.30Å | |
| C1 | O1 | doub | 1.22Å | 1.20Å | |
| C1 | N1 | sing | 1.35Å | 1.39Å | |
| C4 | N1 | sing | 1.36Å | 1.39Å | |
| C4 | N3 | sing | 1.37Å | 1.37Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N3 | H2 | sing | 0.97Å | 1.00Å | |
| N3 | H3 | sing | 0.97Å | 1.00Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| N4 | H9 | sing | 1.01Å | 1.00Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| N5 | H13 | sing | 0.97Å | 1.00Å | |
| N6 | H14 | sing | 0.97Å | 1.00Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C13 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C15 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C21 | H29 | sing | 1.09Å | 1.10Å | |
| C21 | H30 | sing | 1.09Å | 1.10Å | |
| C22 | H31 | sing | 1.09Å | 1.10Å | |
| C22 | H32 | sing | 1.09Å | 1.10Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C16 | C22 | 110.8° | 109.5° |
| C17 | C16 | C15 | 106.7° | 109.5° |
| C16 | C17 | C18 | 112.4° | 109.5° |
| C17 | C16 | H21 | 110.2° | 109.5° |
| C16 | C17 | H22 | 108.7° | 109.4° |
| C16 | C17 | H23 | 108.7° | 109.5° |
| C22 | C16 | C15 | 108.5° | 109.4° |
| C16 | C22 | C23 | 110.5° | 109.5° |
| C22 | C16 | H21 | 110.4° | 109.5° |
| C16 | C22 | H31 | 109.2° | 109.4° |
| C16 | C22 | H32 | 109.2° | 109.4° |
| C16 | C15 | C14 | 111.3° | 109.5° |
| C16 | C15 | H19 | 109.0° | 109.5° |
| C16 | C15 | H20 | 109.0° | 109.5° |
| C15 | C16 | H21 | 110.2° | 109.5° |
| C17 | C18 | C20 | 107.0° | 109.5° |
| C17 | C18 | C19 | 109.8° | 109.5° |
| C18 | C17 | H22 | 108.7° | 109.5° |
| C18 | C17 | H23 | 108.7° | 109.5° |
| C17 | C18 | H24 | 111.1° | 109.5° |
| C13 | N6 | C12 | 116.1° | 120.0° |
| C13 | N6 | H14 | 107.8° | 120.0° |
| N6 | C13 | H15 | 109.5° | 109.5° |
| N6 | C13 | H16 | 109.4° | 109.5° |
| N6 | C13 | H17 | 109.5° | 109.5° |
| C22 | C23 | C20 | 108.7° | 109.5° |
| C22 | C23 | C21 | 108.0° | 109.5° |
| C23 | C22 | H31 | 109.2° | 109.5° |
| C23 | C22 | H32 | 109.2° | 109.5° |
| C22 | C23 | H33 | 110.3° | 109.5° |
| C15 | C14 | C19 | 109.9° | 109.5° |
| C15 | C14 | C21 | 108.1° | 109.5° |
| C15 | C14 | C11 | 108.8° | 109.4° |
| C14 | C15 | H19 | 109.0° | 109.5° |
| C14 | C15 | H20 | 109.0° | 109.5° |
| N6 | C12 | N7 | 127.9° | 125.0° |
| N6 | C12 | N5 | 119.8° | 125.0° |
| C12 | N6 | H14 | 107.8° | 120.0° |
| C20 | C18 | C19 | 106.8° | 109.4° |
| C18 | C20 | C23 | 113.2° | 109.5° |
| C20 | C18 | H24 | 111.3° | 109.5° |
| C18 | C20 | H27 | 108.5° | 109.5° |
| C18 | C20 | H28 | 108.5° | 109.4° |
| C18 | C19 | C14 | 110.7° | 109.5° |
| C19 | C18 | H24 | 110.7° | 109.5° |
| C18 | C19 | H25 | 109.2° | 109.5° |
| C18 | C19 | H26 | 109.1° | 109.5° |
| C20 | C23 | C21 | 109.7° | 109.5° |
| C23 | C20 | H27 | 108.5° | 109.5° |
| C23 | C20 | H28 | 108.5° | 109.4° |
| C20 | C23 | H33 | 110.2° | 109.4° |
| C23 | C21 | C14 | 109.7° | 109.5° |
| C23 | C21 | H29 | 109.4° | 109.5° |
| C23 | C21 | H30 | 109.4° | 109.5° |
| C21 | C23 | H33 | 110.0° | 109.5° |
| C19 | C14 | C21 | 108.2° | 109.5° |
| C19 | C14 | C11 | 111.9° | 109.5° |
| C14 | C19 | H25 | 109.1° | 109.4° |
| C14 | C19 | H26 | 109.2° | 109.5° |
| C21 | C14 | C11 | 109.9° | 109.5° |
| C14 | C21 | H29 | 109.4° | 109.5° |
| C14 | C21 | H30 | 109.4° | 109.4° |
| C14 | C11 | N4 | 116.9° | 109.5° |
| C14 | C11 | H11 | 107.6° | 109.4° |
| C14 | C11 | H12 | 107.6° | 109.5° |
| N7 | C12 | N5 | 112.2° | 110.0° |
| C12 | N7 | C7 | 104.7° | 109.7° |
| C12 | N5 | C6 | 107.7° | 107.2° |
| C12 | N5 | H13 | 126.1° | 126.4° |
| C11 | N4 | C10 | 114.8° | 110.9° |
| C11 | N4 | H9 | 108.1° | 111.0° |
| N4 | C11 | H11 | 107.6° | 109.5° |
| N4 | C11 | H12 | 107.6° | 109.5° |
| N4 | C10 | C9 | 111.7° | 109.4° |
| N4 | C10 | H7 | 108.9° | 109.5° |
| N4 | C10 | H8 | 108.9° | 109.4° |
| C10 | N4 | H9 | 108.1° | 111.0° |
| N7 | C7 | C6 | 110.7° | 107.0° |
| N7 | C7 | C8 | 128.5° | 132.8° |
| N5 | C6 | C7 | 104.6° | 106.0° |
| N5 | C6 | C5 | 131.0° | 133.4° |
| C6 | N5 | H13 | 126.1° | 126.4° |
| C10 | C9 | C8 | 113.1° | 109.4° |
| C10 | C9 | H5 | 108.5° | 109.5° |
| C10 | C9 | H6 | 108.5° | 109.4° |
| C9 | C10 | H7 | 108.9° | 109.5° |
| C9 | C10 | H8 | 108.9° | 109.4° |
| C6 | C7 | C8 | 120.7° | 120.1° |
| C7 | C6 | C5 | 124.4° | 120.5° |
| C7 | C8 | C9 | 119.1° | 120.2° |
| C7 | C8 | C3 | 115.8° | 119.6° |
| C9 | C8 | C3 | 125.1° | 120.2° |
| C8 | C9 | H5 | 108.5° | 109.5° |
| C8 | C9 | H6 | 108.6° | 109.5° |
| C6 | C5 | C2 | 114.5° | 119.5° |
| C6 | C5 | H4 | 122.7° | 120.2° |
| C8 | C3 | C2 | 122.0° | 119.8° |
| C8 | C3 | N2 | 120.0° | 121.2° |
| C5 | C2 | C3 | 122.6° | 120.4° |
| C5 | C2 | C1 | 115.7° | 121.5° |
| C2 | C5 | H4 | 122.7° | 120.2° |
| C2 | C3 | N2 | 117.9° | 119.0° |
| C3 | C2 | C1 | 121.7° | 118.1° |
| C3 | N2 | C4 | 120.4° | 121.5° |
| C2 | C1 | O1 | 125.4° | 121.2° |
| C2 | C1 | N1 | 115.3° | 117.6° |
| N2 | C4 | N1 | 122.9° | 123.1° |
| N2 | C4 | N3 | 121.4° | 118.4° |
| O1 | C1 | N1 | 119.4° | 121.2° |
| C1 | N1 | C4 | 121.6° | 120.6° |
| C1 | N1 | H1 | 119.2° | 119.6° |
| N1 | C4 | N3 | 115.7° | 118.5° |
| C4 | N1 | H1 | 119.2° | 119.7° |
| C4 | N3 | H2 | 120.0° | 120.1° |
| C4 | N3 | H3 | 120.0° | 119.9° |
| H2 | N3 | H3 | 120.0° | 120.0° |
| H5 | C9 | H6 | 109.5° | 109.5° |
| H7 | C10 | H8 | 109.5° | 109.5° |
| H11 | C11 | H12 | 109.5° | 109.5° |
| H15 | C13 | H16 | 109.5° | 109.4° |
| H15 | C13 | H17 | 109.5° | 109.4° |
| H16 | C13 | H17 | 109.5° | 109.5° |
| H19 | C15 | H20 | 109.4° | 109.5° |
| H22 | C17 | H23 | 109.5° | 109.4° |
| H25 | C19 | H26 | 109.5° | 109.5° |
| H27 | C20 | H28 | 109.5° | 109.5° |
| H29 | C21 | H30 | 109.5° | 109.4° |
| H31 | C22 | H32 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C16 | C22 | C15 | 116.8° | 120.0° |
| C17 | C16 | C22 | H21 | 122.4° | 120.0° |
| C17 | C16 | C15 | H21 | 119.6° | 120.0° |
| C16 | C17 | C18 | H22 | 120.5° | 120.0° |
| C16 | C17 | C18 | H23 | 120.4° | 120.0° |
| C17 | C16 | C22 | C23 | 56.1° | 60.0° |
| C17 | C16 | C15 | C14 | 60.5° | 60.0° |
| C16 | C17 | C18 | C20 | 56.6° | 60.0° |
| C16 | C17 | C18 | C19 | 58.9° | 60.0° |
| C17 | C16 | C15 | H19 | 179.2° | 60.0° |
| C17 | C16 | C15 | H20 | 59.8° | 180.0° |
| C16 | C17 | H22 | H23 | 118.6° | 120.0° |
| C16 | C17 | C18 | H24 | 178.2° | 180.0° |
| C17 | C16 | C22 | H31 | 64.0° | 60.0° |
| C17 | C16 | C22 | H32 | 176.3° | 180.0° |
| C22 | C16 | C15 | H21 | 120.9° | 120.0° |
| C22 | C16 | C17 | C18 | 57.1° | 60.0° |
| C16 | C22 | C23 | H31 | 120.1° | 119.9° |
| C16 | C22 | C23 | H32 | 120.2° | 120.0° |
| C22 | C16 | C15 | C14 | 58.9° | 60.0° |
| C16 | C22 | C23 | C20 | 56.7° | 60.0° |
| C16 | C22 | C23 | C21 | 62.3° | 60.0° |
| C22 | C16 | C15 | H19 | 61.3° | 180.0° |
| C22 | C16 | C15 | H20 | 179.2° | 60.0° |
| C22 | C16 | C17 | H22 | 177.5° | 180.0° |
| C22 | C16 | C17 | H23 | 63.4° | 60.1° |
| C16 | C22 | H31 | H32 | 119.6° | 119.9° |
| C16 | C22 | C23 | H33 | 177.5° | 180.0° |
| C15 | C16 | C17 | C18 | 60.9° | 60.0° |
| C15 | C16 | C22 | C23 | 60.7° | 60.0° |
| C16 | C15 | C14 | H19 | 120.3° | 120.0° |
| C16 | C15 | C14 | H20 | 120.3° | 120.0° |
| C16 | C15 | C14 | C19 | 59.3° | 60.0° |
| C16 | C15 | C14 | C21 | 58.6° | 60.0° |
| C16 | C15 | C14 | C11 | 177.9° | 180.0° |
| C16 | C15 | H19 | H20 | 119.1° | 120.0° |
| C15 | C16 | C17 | H22 | 59.6° | 60.1° |
| C15 | C16 | C17 | H23 | 178.7° | 180.0° |
| C15 | C16 | C22 | H31 | 179.2° | 180.0° |
| C15 | C16 | C22 | H32 | 59.5° | 60.0° |
| C17 | C18 | C20 | C19 | 117.5° | 120.0° |
| C17 | C18 | C20 | H24 | 121.5° | 120.0° |
| C17 | C18 | C19 | H24 | 123.1° | 120.0° |
| C17 | C18 | C20 | C23 | 58.9° | 60.0° |
| C17 | C18 | C19 | C14 | 54.8° | 60.0° |
| C18 | C17 | C16 | H21 | 179.5° | 180.0° |
| C18 | C17 | H22 | H23 | 118.6° | 120.0° |
| C17 | C18 | C19 | H25 | 65.4° | 180.0° |
| C17 | C18 | C19 | H26 | 175.0° | 60.0° |
| C17 | C18 | C20 | H27 | 179.5° | 180.0° |
| C17 | C18 | C20 | H28 | 61.6° | 60.0° |
| C13 | N6 | C12 | H14 | 121.0° | 179.9° |
| C13 | N6 | C12 | N7 | 20.7° | 180.0° |
| C13 | N6 | C12 | N5 | 160.9° | 0.0° |
| N6 | C13 | H15 | H16 | 120.0° | 120.0° |
| N6 | C13 | H15 | H17 | 120.0° | 120.0° |
| N6 | C13 | H16 | H17 | 120.0° | 120.0° |
| C22 | C23 | C20 | C18 | 60.1° | 60.0° |
| C22 | C23 | C20 | C21 | 117.9° | 120.0° |
| C22 | C23 | C20 | H33 | 120.9° | 120.0° |
| C22 | C23 | C21 | H33 | 120.4° | 120.0° |
| C22 | C23 | C21 | C14 | 61.7° | 60.0° |
| C23 | C22 | C16 | H21 | 178.5° | 180.0° |
| C22 | C23 | C20 | H27 | 179.3° | 180.0° |
| C22 | C23 | C20 | H28 | 60.4° | 60.0° |
| C22 | C23 | C21 | H29 | 178.3° | 60.0° |
| C22 | C23 | C21 | H30 | 58.4° | 180.0° |
| C23 | C22 | H31 | H32 | 119.5° | 120.1° |
| C15 | C14 | C19 | C18 | 55.1° | 60.0° |
| C15 | C14 | C21 | C23 | 59.5° | 60.0° |
| C15 | C14 | C19 | C21 | 117.8° | 120.0° |
| C15 | C14 | C19 | C11 | 120.9° | 120.0° |
| C15 | C14 | C21 | C11 | 118.6° | 120.0° |
| C15 | C14 | C11 | N4 | 56.0° | 60.0° |
| C15 | C14 | C11 | H11 | 177.0° | 180.0° |
| C15 | C14 | C11 | H12 | 65.1° | 60.0° |
| C14 | C15 | H19 | H20 | 119.2° | 120.0° |
| C14 | C15 | C16 | H21 | 179.9° | 180.0° |
| C15 | C14 | C19 | H25 | 65.1° | 180.0° |
| C15 | C14 | C19 | H26 | 175.3° | 60.0° |
| C15 | C14 | C21 | H29 | 179.6° | 60.0° |
| C15 | C14 | C21 | H30 | 60.5° | 180.0° |
| N6 | C12 | N7 | N5 | 178.5° | 180.0° |
| N6 | C12 | N7 | C7 | 177.8° | 180.0° |
| N6 | C12 | N5 | C6 | 179.1° | 180.0° |
| N6 | C12 | N5 | H13 | 0.9° | 0.1° |
| C12 | N6 | C13 | H15 | 180.0° | 60.0° |
| C12 | N6 | C13 | H16 | 60.0° | 60.0° |
| C12 | N6 | C13 | H17 | 60.0° | 180.0° |
| C20 | C18 | C19 | H24 | 121.3° | 120.0° |
| C18 | C20 | C23 | H27 | 120.5° | 120.0° |
| C18 | C20 | C23 | H28 | 120.6° | 119.9° |
| C18 | C20 | C23 | C21 | 57.8° | 60.0° |
| C20 | C18 | C19 | C14 | 60.8° | 60.0° |
| C20 | C18 | C17 | H22 | 177.0° | 180.0° |
| C20 | C18 | C17 | H23 | 63.9° | 60.1° |
| C20 | C18 | C19 | H25 | 179.0° | 60.0° |
| C20 | C18 | C19 | H26 | 59.4° | 180.0° |
| C18 | C20 | H27 | H28 | 118.3° | 120.0° |
| C18 | C20 | C23 | H33 | 179.0° | 180.0° |
| C19 | C18 | C20 | C23 | 58.6° | 60.0° |
| C18 | C19 | C14 | H25 | 120.2° | 120.0° |
| C18 | C19 | C14 | H26 | 120.2° | 120.0° |
| C18 | C19 | C14 | C21 | 62.7° | 60.0° |
| C18 | C19 | C14 | C11 | 176.1° | 180.0° |
| C19 | C18 | C17 | H22 | 61.5° | 60.0° |
| C19 | C18 | C17 | H23 | 179.4° | 180.0° |
| C18 | C19 | H25 | H26 | 119.4° | 120.0° |
| C19 | C18 | C20 | H27 | 62.0° | 60.0° |
| C19 | C18 | C20 | H28 | 179.1° | 180.0° |
| C20 | C23 | C21 | H33 | 121.3° | 120.0° |
| C20 | C23 | C21 | C14 | 56.6° | 60.0° |
| C23 | C20 | C18 | H24 | 179.5° | 180.0° |
| C23 | C20 | H27 | H28 | 118.3° | 120.0° |
| C20 | C23 | C21 | H29 | 63.4° | 180.0° |
| C20 | C23 | C21 | H30 | 176.7° | 60.0° |
| C20 | C23 | C22 | H31 | 63.5° | 60.0° |
| C20 | C23 | C22 | H32 | 176.8° | 180.0° |
| C23 | C21 | C14 | C19 | 59.4° | 60.0° |
| C23 | C21 | C14 | H29 | 120.1° | 120.0° |
| C23 | C21 | C14 | H30 | 120.0° | 120.1° |
| C23 | C21 | C14 | C11 | 178.1° | 180.0° |
| C21 | C23 | C20 | H27 | 62.8° | 60.0° |
| C21 | C23 | C20 | H28 | 178.4° | 180.0° |
| C23 | C21 | H29 | H30 | 119.9° | 120.1° |
| C21 | C23 | C22 | H31 | 177.6° | 180.0° |
| C21 | C23 | C22 | H32 | 57.9° | 60.0° |
| C19 | C14 | C21 | C11 | 122.5° | 120.0° |
| C19 | C14 | C11 | N4 | 65.6° | 180.0° |
| C19 | C14 | C11 | H11 | 55.5° | 60.0° |
| C19 | C14 | C11 | H12 | 173.4° | 60.0° |
| C19 | C14 | C15 | H19 | 179.6° | 60.0° |
| C19 | C14 | C15 | H20 | 60.9° | 180.0° |
| C14 | C19 | C18 | H24 | 177.8° | 180.0° |
| C14 | C19 | H25 | H26 | 119.4° | 120.0° |
| C19 | C14 | C21 | H29 | 60.6° | 180.0° |
| C19 | C14 | C21 | H30 | 179.5° | 60.0° |
| C21 | C14 | C11 | N4 | 174.1° | 60.0° |
| C21 | C14 | C11 | H11 | 64.8° | 60.0° |
| C21 | C14 | C11 | H12 | 53.1° | 180.0° |
| C21 | C14 | C15 | H19 | 61.7° | 180.0° |
| C21 | C14 | C15 | H20 | 178.9° | 60.0° |
| C21 | C14 | C19 | H25 | 177.1° | 60.0° |
| C21 | C14 | C19 | H26 | 57.5° | 180.0° |
| C14 | C21 | H29 | H30 | 119.9° | 119.9° |
| C14 | C21 | C23 | H33 | 177.9° | 180.0° |
| C14 | C11 | N4 | H11 | 121.1° | 120.0° |
| C14 | C11 | N4 | H12 | 121.1° | 120.0° |
| C14 | C11 | N4 | C10 | 136.8° | 179.9° |
| C14 | C11 | N4 | H9 | 102.4° | 56.0° |
| C14 | C11 | H11 | H12 | 116.7° | 120.0° |
| C11 | C14 | C15 | H19 | 57.6° | 60.0° |
| C11 | C14 | C15 | H20 | 61.8° | 60.0° |
| C11 | C14 | C19 | H25 | 55.9° | 60.1° |
| C11 | C14 | C19 | H26 | 63.8° | 60.0° |
| C11 | C14 | C21 | H29 | 61.9° | 59.9° |
| C11 | C14 | C21 | H30 | 58.1° | 60.0° |
| N7 | C12 | N5 | C6 | 0.5° | 0.0° |
| C12 | N7 | C7 | C6 | 1.7° | 0.0° |
| C12 | N7 | C7 | C8 | 177.8° | 179.9° |
| N7 | C12 | N5 | H13 | 179.5° | 180.0° |
| N7 | C12 | N6 | H14 | 100.3° | 0.1° |
| N5 | C12 | N7 | C7 | 0.8° | 0.0° |
| C12 | N5 | C6 | H13 | 180.0° | 180.0° |
| C12 | N5 | C6 | C7 | 1.5° | 0.0° |
| C12 | N5 | C6 | C5 | 177.4° | 180.0° |
| N5 | C12 | N6 | H14 | 78.2° | 180.0° |
| C11 | N4 | C10 | H9 | 120.8° | 124.0° |
| C11 | N4 | C10 | C9 | 70.8° | 180.0° |
| C11 | N4 | C10 | H7 | 49.6° | 60.0° |
| C11 | N4 | C10 | H8 | 168.9° | 60.0° |
| N4 | C11 | H11 | H12 | 116.6° | 120.0° |
| N4 | C10 | C9 | H7 | 120.3° | 120.0° |
| N4 | C10 | C9 | H8 | 120.3° | 119.9° |
| N4 | C10 | C9 | C8 | 152.4° | 180.0° |
| N4 | C10 | C9 | H5 | 31.8° | 60.0° |
| N4 | C10 | C9 | H6 | 87.1° | 60.0° |
| N4 | C10 | H7 | H8 | 119.0° | 120.0° |
| C10 | N4 | C11 | H11 | 15.7° | 60.0° |
| C10 | N4 | C11 | H12 | 102.2° | 60.0° |
| N7 | C7 | C6 | N5 | 2.0° | 0.0° |
| N7 | C7 | C6 | C8 | 176.4° | 179.9° |
| N7 | C7 | C8 | C9 | 3.5° | 0.1° |
| N7 | C7 | C6 | C5 | 177.0° | 180.0° |
| N7 | C7 | C8 | C3 | 175.1° | 179.9° |
| N5 | C6 | C7 | C5 | 179.0° | 180.0° |
| N5 | C6 | C7 | C8 | 178.4° | 179.9° |
| N5 | C6 | C5 | C2 | 177.3° | 180.0° |
| N5 | C6 | C5 | H4 | 2.7° | 0.0° |
| C10 | C9 | C8 | C7 | 76.1° | 90.0° |
| C10 | C9 | C8 | H5 | 120.5° | 120.0° |
| C10 | C9 | C8 | H6 | 120.5° | 120.0° |
| C10 | C9 | C8 | C3 | 105.5° | 90.2° |
| C10 | C9 | H5 | H6 | 118.3° | 120.0° |
| C9 | C10 | H7 | H8 | 119.0° | 120.0° |
| C9 | C10 | N4 | H9 | 168.5° | 56.1° |
| C6 | C7 | C8 | C9 | 179.2° | 180.0° |
| C6 | C7 | C8 | C3 | 0.6° | 0.1° |
| C7 | C6 | C5 | C2 | 1.4° | 0.0° |
| C7 | C6 | C5 | H4 | 178.6° | 180.0° |
| C7 | C6 | N5 | H13 | 178.5° | 180.0° |
| C7 | C8 | C9 | C3 | 178.4° | 179.8° |
| C8 | C7 | C6 | C5 | 0.6° | 0.1° |
| C7 | C8 | C3 | C2 | 0.9° | 0.2° |
| C7 | C8 | C3 | N2 | 177.6° | 179.9° |
| C7 | C8 | C9 | H5 | 44.4° | 150.0° |
| C7 | C8 | C9 | H6 | 163.4° | 30.0° |
| C9 | C8 | C3 | C2 | 179.4° | 180.0° |
| C9 | C8 | C3 | N2 | 3.9° | 0.0° |
| C8 | C9 | H5 | H6 | 118.4° | 120.0° |
| C8 | C9 | C10 | H7 | 87.3° | 60.0° |
| C8 | C9 | C10 | H8 | 32.0° | 60.0° |
| C6 | C5 | C2 | H4 | 180.0° | 180.0° |
| C6 | C5 | C2 | C3 | 1.1° | 0.0° |
| C6 | C5 | C2 | C1 | 179.7° | 180.0° |
| C5 | C6 | N5 | H13 | 2.5° | 0.1° |
| C8 | C3 | C2 | C5 | 0.0° | 0.1° |
| C8 | C3 | C2 | N2 | 176.8° | 180.0° |
| C8 | C3 | C2 | C1 | 178.6° | 179.9° |
| C8 | C3 | N2 | C4 | 178.5° | 179.7° |
| C3 | C8 | C9 | H5 | 134.0° | 29.8° |
| C3 | C8 | C9 | H6 | 15.1° | 149.9° |
| C5 | C2 | C3 | C1 | 178.6° | 180.0° |
| C5 | C2 | C3 | N2 | 176.9° | 179.9° |
| C5 | C2 | C1 | O1 | 1.3° | 0.0° |
| C5 | C2 | C1 | N1 | 179.2° | 180.0° |
| C2 | C3 | N2 | C4 | 4.6° | 0.3° |
| C3 | C2 | C1 | O1 | 180.0° | 180.0° |
| C3 | C2 | C1 | N1 | 2.1° | 0.0° |
| C3 | C2 | C5 | H4 | 178.9° | 180.0° |
| N2 | C3 | C2 | C1 | 1.7° | 0.0° |
| C3 | N2 | C4 | N1 | 3.4° | 0.6° |
| C3 | N2 | C4 | N3 | 176.8° | 180.0° |
| C2 | C1 | O1 | N1 | 177.8° | 180.0° |
| C2 | C1 | N1 | C4 | 3.5° | 0.3° |
| C2 | C1 | N1 | H1 | 176.5° | 180.0° |
| C1 | C2 | C5 | H4 | 0.2° | 0.0° |
| N2 | C4 | N1 | C1 | 0.9° | 0.6° |
| N2 | C4 | N1 | N3 | 179.8° | 179.4° |
| N2 | C4 | N1 | H1 | 179.1° | 179.7° |
| N2 | C4 | N3 | H2 | 0.0° | 0.1° |
| N2 | C4 | N3 | H3 | 180.0° | 180.0° |
| O1 | C1 | N1 | C4 | 178.4° | 179.7° |
| O1 | C1 | N1 | H1 | 1.6° | 0.0° |
| C1 | N1 | C4 | H1 | 180.0° | 179.7° |
| C1 | N1 | C4 | N3 | 178.9° | 180.0° |
| N1 | C4 | N3 | H2 | 179.8° | 179.5° |
| N1 | C4 | N3 | H3 | 0.2° | 0.6° |
| N3 | C4 | N1 | H1 | 1.1° | 0.3° |
| C4 | N3 | H2 | H3 | 180.0° | 179.9° |
| H5 | C9 | C10 | H7 | 152.2° | 180.0° |
| H5 | C9 | C10 | H8 | 88.5° | 59.9° |
| H6 | C9 | C10 | H7 | 33.2° | 60.0° |
| H6 | C9 | C10 | H8 | 152.6° | 180.0° |
| H7 | C10 | N4 | H9 | 71.2° | 63.9° |
| H8 | C10 | N4 | H9 | 48.1° | 176.0° |
| H9 | N4 | C11 | H11 | 136.5° | 64.0° |
| H9 | N4 | C11 | H12 | 18.6° | 176.0° |
| H14 | N6 | C13 | H15 | 59.0° | 120.0° |
| H14 | N6 | C13 | H16 | 60.9° | 120.0° |
| H14 | N6 | C13 | H17 | 179.1° | 0.0° |
| H15 | C13 | H16 | H17 | 120.0° | 119.9° |
| H19 | C15 | C16 | H21 | 59.6° | 60.0° |
| H20 | C15 | C16 | H21 | 59.8° | 60.0° |
| H21 | C16 | C17 | H22 | 60.0° | 59.9° |
| H21 | C16 | C17 | H23 | 59.1° | 60.0° |
| H21 | C16 | C22 | H31 | 58.4° | 60.0° |
| H21 | C16 | C22 | H32 | 61.3° | 60.0° |
| H22 | C17 | C18 | H24 | 61.3° | 60.0° |
| H23 | C17 | C18 | H24 | 57.8° | 60.0° |
| H24 | C18 | C19 | H25 | 57.6° | 60.0° |
| H24 | C18 | C19 | H26 | 62.0° | 60.0° |
| H24 | C18 | C20 | H27 | 59.0° | 60.0° |
| H24 | C18 | C20 | H28 | 59.9° | 60.1° |
| H27 | C20 | C23 | H33 | 58.4° | 60.0° |
| H28 | C20 | C23 | H33 | 60.5° | 60.1° |
| H29 | C21 | C23 | H33 | 57.9° | 60.0° |
| H30 | C21 | C23 | H33 | 62.0° | 60.0° |
| H31 | C22 | C23 | H33 | 57.4° | 60.0° |
| H32 | C22 | C23 | H33 | 62.3° | 60.0° |
