LRS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C23 | doub | 1.36Å | 1.38Å | Aromatic |
| C24 | N6 | sing | 1.36Å | 1.39Å | Aromatic |
| N5 | N6 | sing | 1.40Å | 1.37Å | Aromatic |
| N5 | C20 | doub | 1.31Å | 1.35Å | Aromatic |
| C23 | C22 | sing | 1.40Å | 1.39Å | Aromatic |
| N6 | C21 | sing | 1.37Å | 1.38Å | Aromatic |
| C20 | C19 | sing | 1.41Å | 1.40Å | Aromatic |
| C22 | N7 | doub | 1.32Å | 1.35Å | Aromatic |
| C21 | C19 | doub | 1.41Å | 1.40Å | Aromatic |
| C21 | N7 | sing | 1.33Å | 1.34Å | Aromatic |
| C19 | C18 | sing | 1.47Å | 1.49Å | |
| O1 | C17 | sing | 1.43Å | 1.42Å | |
| C18 | O2 | doub | 1.22Å | 1.24Å | |
| C18 | N4 | sing | 1.35Å | 1.36Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C17 | C14 | sing | 1.53Å | 1.52Å | |
| N4 | C3 | sing | 1.40Å | 1.42Å | |
| C16 | N3 | sing | 1.47Å | 1.47Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| C3 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C3 | C4 | sing | 1.40Å | 1.41Å | Aromatic |
| N3 | C4 | sing | 1.40Å | 1.41Å | |
| N3 | C12 | sing | 1.47Å | 1.47Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C2 | C1 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | C6 | doub | 1.40Å | 1.40Å | Aromatic |
| C1 | N | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.39Å | Aromatic |
| C | N | sing | 1.46Å | 1.46Å | |
| C6 | N1 | sing | 1.36Å | 1.40Å | Aromatic |
| N | C7 | sing | 1.37Å | 1.43Å | Aromatic |
| C8 | C9 | sing | 1.53Å | 1.50Å | |
| C8 | N2 | sing | 1.47Å | 1.47Å | |
| C7 | N1 | doub | 1.31Å | 1.30Å | Aromatic |
| C7 | N2 | sing | 1.38Å | 1.38Å | |
| C9 | O | sing | 1.43Å | 1.42Å | |
| N2 | C11 | sing | 1.47Å | 1.47Å | |
| O | C10 | sing | 1.43Å | 1.42Å | |
| C11 | C10 | sing | 1.53Å | 1.51Å | |
| C14 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.08Å | 1.08Å | |
| C23 | H16 | sing | 1.08Å | 1.08Å | |
| C24 | H17 | sing | 1.08Å | 1.08Å | |
| C20 | H18 | sing | 1.08Å | 1.08Å | |
| N4 | H19 | sing | 0.97Å | 1.00Å | |
| C2 | H20 | sing | 1.08Å | 1.08Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| O1 | H27 | sing | 0.97Å | 0.95Å | |
| C | H28 | sing | 1.09Å | 1.10Å | |
| C | H29 | sing | 1.09Å | 1.10Å | |
| C | H30 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | C24 | N6 | 119.7° | 119.1° |
| C24 | C23 | C22 | 117.5° | 119.4° |
| C24 | C23 | H16 | 121.3° | 120.3° |
| C23 | C24 | H17 | 120.2° | 120.4° |
| C24 | N6 | N5 | 128.1° | 132.1° |
| C24 | N6 | C21 | 118.6° | 119.7° |
| N6 | C24 | H17 | 120.1° | 120.5° |
| N6 | N5 | C20 | 102.9° | 109.5° |
| N5 | N6 | C21 | 113.3° | 108.2° |
| N5 | C20 | C19 | 113.6° | 108.7° |
| N5 | C20 | H18 | 123.2° | 125.6° |
| C23 | C22 | N7 | 124.1° | 120.1° |
| C23 | C22 | H15 | 118.0° | 119.9° |
| C22 | C23 | H16 | 121.3° | 120.3° |
| N6 | C21 | C19 | 105.7° | 106.7° |
| N6 | C21 | N7 | 122.9° | 120.8° |
| C20 | C19 | C21 | 104.5° | 106.9° |
| C20 | C19 | C18 | 125.9° | 126.6° |
| C19 | C20 | H18 | 123.2° | 125.6° |
| C22 | N7 | C21 | 117.2° | 120.8° |
| N7 | C22 | H15 | 118.0° | 120.0° |
| C19 | C21 | N7 | 131.4° | 132.5° |
| C21 | C19 | C18 | 129.6° | 126.5° |
| C19 | C18 | O2 | 120.2° | 120.0° |
| C19 | C18 | N4 | 115.4° | 120.0° |
| O1 | C17 | C14 | 111.6° | 109.5° |
| O1 | C17 | H25 | 109.0° | 109.4° |
| O1 | C17 | H26 | 109.0° | 109.5° |
| C17 | O1 | H27 | 109.5° | 114.0° |
| O2 | C18 | N4 | 124.4° | 120.0° |
| C18 | N4 | C3 | 129.2° | 120.0° |
| C18 | N4 | H19 | 115.4° | 120.0° |
| C16 | C15 | C14 | 111.4° | 109.3° |
| C15 | C16 | N3 | 111.9° | 109.5° |
| C15 | C16 | H21 | 108.8° | 109.4° |
| C15 | C16 | H22 | 108.9° | 109.5° |
| C16 | C15 | H23 | 109.0° | 109.5° |
| C16 | C15 | H24 | 109.0° | 109.5° |
| C15 | C14 | C17 | 112.2° | 109.6° |
| C15 | C14 | C13 | 108.9° | 109.2° |
| C15 | C14 | H1 | 107.6° | 109.5° |
| C14 | C15 | H23 | 109.0° | 109.5° |
| C14 | C15 | H24 | 109.0° | 109.5° |
| C17 | C14 | C13 | 112.7° | 109.5° |
| C17 | C14 | H1 | 107.7° | 109.5° |
| C14 | C17 | H25 | 108.9° | 109.5° |
| C14 | C17 | H26 | 108.9° | 109.5° |
| N4 | C3 | C2 | 121.7° | 119.8° |
| N4 | C3 | C4 | 118.0° | 119.9° |
| C3 | N4 | H19 | 115.4° | 120.0° |
| C16 | N3 | C4 | 113.6° | 111.0° |
| C16 | N3 | C12 | 114.1° | 111.2° |
| N3 | C16 | H21 | 108.9° | 109.4° |
| N3 | C16 | H22 | 108.9° | 109.5° |
| C14 | C13 | C12 | 111.4° | 109.2° |
| C13 | C14 | H1 | 107.6° | 109.5° |
| C14 | C13 | H13 | 109.0° | 109.5° |
| C14 | C13 | H14 | 109.0° | 109.5° |
| C2 | C3 | C4 | 120.2° | 120.2° |
| C3 | C2 | C1 | 118.3° | 119.8° |
| C3 | C2 | H20 | 120.8° | 120.1° |
| C3 | C4 | N3 | 119.3° | 119.9° |
| C3 | C4 | C5 | 120.2° | 120.3° |
| C4 | N3 | C12 | 114.7° | 111.0° |
| N3 | C4 | C5 | 120.5° | 119.8° |
| N3 | C12 | C13 | 111.6° | 109.6° |
| N3 | C12 | H11 | 109.0° | 109.5° |
| N3 | C12 | H12 | 108.9° | 109.5° |
| C13 | C12 | H11 | 108.9° | 109.4° |
| C13 | C12 | H12 | 109.0° | 109.5° |
| C12 | C13 | H13 | 109.0° | 109.6° |
| C12 | C13 | H14 | 109.0° | 109.5° |
| C2 | C1 | C6 | 121.9° | 120.2° |
| C2 | C1 | N | 132.1° | 133.7° |
| C1 | C2 | H20 | 120.8° | 120.1° |
| C4 | C5 | C6 | 119.9° | 119.8° |
| C4 | C5 | H2 | 120.1° | 120.1° |
| C6 | C1 | N | 105.7° | 106.1° |
| C1 | C6 | C5 | 119.4° | 119.6° |
| C1 | C6 | N1 | 111.1° | 107.1° |
| C1 | N | C | 124.9° | 126.4° |
| C1 | N | C7 | 105.1° | 107.2° |
| C5 | C6 | N1 | 129.1° | 133.2° |
| C6 | C5 | H2 | 120.0° | 120.1° |
| C | N | C7 | 129.6° | 126.4° |
| N | C | H28 | 109.5° | 109.5° |
| N | C | H29 | 109.4° | 109.5° |
| N | C | H30 | 109.5° | 109.5° |
| C6 | N1 | C7 | 105.1° | 109.6° |
| N | C7 | N1 | 112.9° | 109.9° |
| N | C7 | N2 | 123.4° | 125.1° |
| C9 | C8 | N2 | 109.9° | 109.3° |
| C8 | C9 | O | 110.6° | 109.3° |
| C9 | C8 | H5 | 109.4° | 109.5° |
| C9 | C8 | H6 | 109.3° | 109.5° |
| C8 | C9 | H7 | 109.2° | 109.5° |
| C8 | C9 | H8 | 109.2° | 109.5° |
| C8 | N2 | C7 | 113.2° | 111.0° |
| C8 | N2 | C11 | 113.1° | 110.7° |
| N2 | C8 | H5 | 109.3° | 109.5° |
| N2 | C8 | H6 | 109.4° | 109.5° |
| N1 | C7 | N2 | 123.5° | 125.0° |
| C7 | N2 | C11 | 116.1° | 111.1° |
| C9 | O | C10 | 110.2° | 113.8° |
| O | C9 | H7 | 109.2° | 109.5° |
| O | C9 | H8 | 109.2° | 109.5° |
| N2 | C11 | C10 | 109.8° | 109.3° |
| N2 | C11 | H3 | 109.4° | 109.5° |
| N2 | C11 | H4 | 109.4° | 109.6° |
| O | C10 | C11 | 111.7° | 109.2° |
| O | C10 | H9 | 108.9° | 109.5° |
| O | C10 | H10 | 108.9° | 109.5° |
| C10 | C11 | H3 | 109.4° | 109.5° |
| C10 | C11 | H4 | 109.4° | 109.5° |
| C11 | C10 | H9 | 108.9° | 109.5° |
| C11 | C10 | H10 | 108.9° | 109.5° |
| H3 | C11 | H4 | 109.5° | 109.5° |
| H5 | C8 | H6 | 109.5° | 109.5° |
| H7 | C9 | H8 | 109.5° | 109.5° |
| H9 | C10 | H10 | 109.5° | 109.6° |
| H11 | C12 | H12 | 109.5° | 109.5° |
| H13 | C13 | H14 | 109.4° | 109.6° |
| H21 | C16 | H22 | 109.5° | 109.5° |
| H23 | C15 | H24 | 109.5° | 109.5° |
| H25 | C17 | H26 | 109.5° | 109.4° |
| H28 | C | H29 | 109.5° | 109.4° |
| H28 | C | H30 | 109.5° | 109.5° |
| H29 | C | H30 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C23 | C24 | N6 | H17 | 180.0° | 180.0° |
| C23 | C24 | N6 | N5 | 178.2° | 179.9° |
| C24 | C23 | C22 | H16 | 180.0° | 179.9° |
| C23 | C24 | N6 | C21 | 0.1° | 0.0° |
| C24 | C23 | C22 | N7 | 0.1° | 0.0° |
| C24 | C23 | C22 | H15 | 179.9° | 180.0° |
| C24 | N6 | N5 | C21 | 178.4° | 179.9° |
| C24 | N6 | N5 | C20 | 180.0° | 179.6° |
| N6 | C24 | C23 | C22 | 0.9° | 0.0° |
| C24 | N6 | C21 | C19 | 180.0° | 179.9° |
| C24 | N6 | C21 | N7 | 2.0° | 0.0° |
| N6 | C24 | C23 | H16 | 179.1° | 179.9° |
| N6 | N5 | C20 | C19 | 1.1° | 0.5° |
| N5 | N6 | C21 | C19 | 1.5° | 0.0° |
| N5 | N6 | C21 | N7 | 176.5° | 179.9° |
| N5 | N6 | C24 | H17 | 1.8° | 0.1° |
| N6 | N5 | C20 | H18 | 178.9° | 180.0° |
| C20 | N5 | N6 | C21 | 1.6° | 0.3° |
| N5 | C20 | C19 | H18 | 180.0° | 179.5° |
| N5 | C20 | C19 | C21 | 0.2° | 0.5° |
| N5 | C20 | C19 | C18 | 177.3° | 179.8° |
| C23 | C22 | N7 | H15 | 180.0° | 179.9° |
| C23 | C22 | N7 | C21 | 1.7° | 0.0° |
| C22 | C23 | C24 | H17 | 179.1° | 180.0° |
| N6 | C21 | C19 | C20 | 0.7° | 0.3° |
| N6 | C21 | N7 | C22 | 2.8° | 0.0° |
| N6 | C21 | C19 | N7 | 177.8° | 180.0° |
| N6 | C21 | C19 | C18 | 178.1° | 180.0° |
| C21 | N6 | C24 | H17 | 179.9° | 180.0° |
| C20 | C19 | C21 | C18 | 177.4° | 179.7° |
| C20 | C19 | C21 | N7 | 177.1° | 179.7° |
| C20 | C19 | C18 | O2 | 10.7° | 179.6° |
| C20 | C19 | C18 | N4 | 166.7° | 0.3° |
| C22 | N7 | C21 | C19 | 179.8° | 180.0° |
| N7 | C22 | C23 | H16 | 179.8° | 180.0° |
| C21 | C19 | C18 | O2 | 172.4° | 0.0° |
| C21 | C19 | C18 | N4 | 10.2° | 180.0° |
| C21 | C19 | C20 | H18 | 179.7° | 180.0° |
| N7 | C21 | C19 | C18 | 0.4° | 0.1° |
| C21 | N7 | C22 | H15 | 178.3° | 180.0° |
| C19 | C18 | O2 | N4 | 177.1° | 180.0° |
| C19 | C18 | N4 | C3 | 166.7° | 176.1° |
| C18 | C19 | C20 | H18 | 2.7° | 0.3° |
| C19 | C18 | N4 | H19 | 13.2° | 3.9° |
| O1 | C17 | C14 | C15 | 64.0° | 65.3° |
| O1 | C17 | C14 | H25 | 120.3° | 120.0° |
| O1 | C17 | C14 | H26 | 120.3° | 120.0° |
| O1 | C17 | C14 | C13 | 59.4° | 175.0° |
| O1 | C17 | C14 | H1 | 177.8° | 54.9° |
| O1 | C17 | H25 | H26 | 119.1° | 120.0° |
| O2 | C18 | N4 | C3 | 10.5° | 4.0° |
| O2 | C18 | N4 | H19 | 169.5° | 176.0° |
| C18 | N4 | C3 | H19 | 180.0° | 180.0° |
| C18 | N4 | C3 | C2 | 5.7° | 25.6° |
| C18 | N4 | C3 | C4 | 174.1° | 154.4° |
| C16 | C15 | C14 | H23 | 120.3° | 120.0° |
| C16 | C15 | C14 | H24 | 120.3° | 119.9° |
| C16 | C15 | C14 | C17 | 178.6° | 177.6° |
| C15 | C16 | N3 | H21 | 120.3° | 119.9° |
| C15 | C16 | N3 | H22 | 120.4° | 120.1° |
| C16 | C15 | C14 | C13 | 55.9° | 57.7° |
| C15 | C16 | N3 | C4 | 173.3° | 174.2° |
| C15 | C16 | N3 | C12 | 52.7° | 61.7° |
| C16 | C15 | C14 | H1 | 60.4° | 62.2° |
| C15 | C16 | H21 | H22 | 118.9° | 120.1° |
| C16 | C15 | H23 | H24 | 119.2° | 120.1° |
| C15 | C14 | C17 | C13 | 123.3° | 119.7° |
| C15 | C14 | C17 | H1 | 118.2° | 120.2° |
| C14 | C15 | C16 | N3 | 54.2° | 59.2° |
| C15 | C14 | C13 | H1 | 116.3° | 119.9° |
| C15 | C14 | C13 | C12 | 56.3° | 57.6° |
| C15 | C14 | C13 | H13 | 176.7° | 177.6° |
| C15 | C14 | C13 | H14 | 64.0° | 62.3° |
| C14 | C15 | C16 | H21 | 174.6° | 60.7° |
| C14 | C15 | C16 | H22 | 66.1° | 179.2° |
| C14 | C15 | H23 | H24 | 119.1° | 120.1° |
| C15 | C14 | C17 | H25 | 56.4° | 54.7° |
| C15 | C14 | C17 | H26 | 175.7° | 174.7° |
| C17 | C14 | C13 | H1 | 118.6° | 120.1° |
| C17 | C14 | C13 | C12 | 178.5° | 177.6° |
| C17 | C14 | C13 | H13 | 58.2° | 62.4° |
| C17 | C14 | C13 | H14 | 61.2° | 57.7° |
| C17 | C14 | C15 | H23 | 58.4° | 57.6° |
| C17 | C14 | C15 | H24 | 61.0° | 62.5° |
| C14 | C17 | H25 | H26 | 119.0° | 120.0° |
| C14 | C17 | O1 | H27 | 180.0° | 180.0° |
| N4 | C3 | C2 | C4 | 179.8° | 180.0° |
| N4 | C3 | C4 | N3 | 3.7° | 0.3° |
| N4 | C3 | C2 | C1 | 179.7° | 180.0° |
| N4 | C3 | C4 | C5 | 179.3° | 180.0° |
| N4 | C3 | C2 | H20 | 0.4° | 0.0° |
| C16 | N3 | C4 | C3 | 108.3° | 116.0° |
| C16 | N3 | C4 | C12 | 133.7° | 124.3° |
| C16 | N3 | C12 | C13 | 52.9° | 61.7° |
| C16 | N3 | C4 | C5 | 68.7° | 64.3° |
| C16 | N3 | C12 | H11 | 173.2° | 58.3° |
| C16 | N3 | C12 | H12 | 67.4° | 178.3° |
| N3 | C16 | H21 | H22 | 118.9° | 120.0° |
| N3 | C16 | C15 | H23 | 174.5° | 60.8° |
| N3 | C16 | C15 | H24 | 66.1° | 179.1° |
| C14 | C13 | C12 | N3 | 54.9° | 59.1° |
| C14 | C13 | C12 | H13 | 120.3° | 120.0° |
| C14 | C13 | C12 | H14 | 120.3° | 119.9° |
| C14 | C13 | C12 | H11 | 175.2° | 60.9° |
| C14 | C13 | C12 | H12 | 65.5° | 179.2° |
| C14 | C13 | H13 | H14 | 119.1° | 120.1° |
| C13 | C14 | C15 | H23 | 176.2° | 62.3° |
| C13 | C14 | C15 | H24 | 64.4° | 177.6° |
| C13 | C14 | C17 | H25 | 179.7° | 65.0° |
| C13 | C14 | C17 | H26 | 61.0° | 55.0° |
| C2 | C3 | C4 | N3 | 176.1° | 179.7° |
| C3 | C2 | C1 | H20 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.9° | 0.0° |
| C3 | C2 | C1 | C6 | 0.9° | 0.0° |
| C3 | C2 | C1 | N | 173.1° | 180.0° |
| C2 | C3 | N4 | H19 | 174.3° | 154.4° |
| C3 | C4 | N3 | C5 | 177.0° | 179.7° |
| C3 | C4 | N3 | C12 | 118.0° | 119.7° |
| C4 | C3 | C2 | C1 | 0.6° | 0.0° |
| C3 | C4 | C5 | C6 | 1.5° | 0.0° |
| C3 | C4 | C5 | H2 | 178.5° | 180.0° |
| C4 | C3 | N4 | H19 | 5.9° | 25.6° |
| C4 | C3 | C2 | H20 | 179.4° | 179.9° |
| C4 | N3 | C12 | C13 | 173.6° | 174.1° |
| N3 | C4 | C5 | C6 | 175.4° | 179.7° |
| N3 | C4 | C5 | H2 | 4.6° | 0.3° |
| C4 | N3 | C12 | H11 | 53.3° | 65.9° |
| C4 | N3 | C12 | H12 | 66.0° | 54.1° |
| C4 | N3 | C16 | H21 | 53.0° | 65.9° |
| C4 | N3 | C16 | H22 | 66.3° | 54.1° |
| N3 | C12 | C13 | H11 | 120.3° | 120.0° |
| N3 | C12 | C13 | H12 | 120.3° | 120.1° |
| C12 | N3 | C4 | C5 | 65.0° | 60.0° |
| N3 | C12 | H11 | H12 | 119.0° | 120.0° |
| N3 | C12 | C13 | H13 | 175.2° | 179.1° |
| N3 | C12 | C13 | H14 | 65.5° | 60.7° |
| C12 | N3 | C16 | H21 | 173.0° | 58.3° |
| C12 | N3 | C16 | H22 | 67.7° | 178.3° |
| C12 | C13 | C14 | H1 | 59.9° | 62.3° |
| C13 | C12 | H11 | H12 | 119.0° | 119.9° |
| C12 | C13 | H13 | H14 | 119.1° | 120.1° |
| C2 | C1 | C6 | N | 174.0° | 180.0° |
| C2 | C1 | C6 | C5 | 1.5° | 0.0° |
| C2 | C1 | N | C | 16.0° | 0.1° |
| C2 | C1 | C6 | N1 | 172.4° | 180.0° |
| C2 | C1 | N | C7 | 170.6° | 180.0° |
| C4 | C5 | C6 | C1 | 1.8° | 0.0° |
| C4 | C5 | C6 | H2 | 180.0° | 180.0° |
| C4 | C5 | C6 | N1 | 170.8° | 180.0° |
| C1 | C6 | C5 | N1 | 172.7° | 179.9° |
| C6 | C1 | N | C | 170.9° | 180.0° |
| C6 | C1 | N | C7 | 2.6° | 0.1° |
| C1 | C6 | N1 | C7 | 0.1° | 0.1° |
| C1 | C6 | C5 | H2 | 178.2° | 180.0° |
| C6 | C1 | C2 | H20 | 179.1° | 179.9° |
| N | C1 | C6 | C5 | 175.5° | 180.0° |
| C1 | N | C | C7 | 171.8° | 179.9° |
| N | C1 | C6 | N1 | 1.6° | 0.1° |
| C1 | N | C7 | N1 | 2.9° | 0.0° |
| C1 | N | C7 | N2 | 173.3° | 180.0° |
| N | C1 | C2 | H20 | 6.9° | 0.0° |
| C1 | N | C | H28 | 180.0° | 85.0° |
| C1 | N | C | H29 | 60.0° | 155.0° |
| C1 | N | C | H30 | 60.0° | 35.0° |
| C5 | C6 | N1 | C7 | 173.0° | 180.0° |
| C | N | C7 | N1 | 170.1° | 180.0° |
| C | N | C7 | N2 | 13.7° | 0.1° |
| N | C | H28 | H29 | 120.0° | 120.0° |
| N | C | H28 | H30 | 120.0° | 120.0° |
| N | C | H29 | H30 | 120.0° | 120.0° |
| C6 | N1 | C7 | N | 1.9° | 0.0° |
| C6 | N1 | C7 | N2 | 174.3° | 180.0° |
| N1 | C6 | C5 | H2 | 9.2° | 0.0° |
| N | C7 | N2 | C8 | 63.2° | 115.1° |
| N | C7 | N1 | N2 | 176.2° | 180.0° |
| N | C7 | N2 | C11 | 163.5° | 121.3° |
| C7 | N | C | H28 | 8.2° | 94.9° |
| C7 | N | C | H29 | 111.8° | 25.0° |
| C7 | N | C | H30 | 128.2° | 145.1° |
| C9 | C8 | N2 | H5 | 120.1° | 119.9° |
| C9 | C8 | N2 | H6 | 120.1° | 120.0° |
| C9 | C8 | N2 | C7 | 173.4° | 177.6° |
| C8 | C9 | O | H7 | 120.2° | 119.9° |
| C8 | C9 | O | H8 | 120.2° | 120.0° |
| C9 | C8 | N2 | C11 | 51.9° | 58.6° |
| C8 | C9 | O | C10 | 62.0° | 58.7° |
| C9 | C8 | H5 | H6 | 119.8° | 120.1° |
| C8 | C9 | H7 | H8 | 119.5° | 120.1° |
| C8 | N2 | C7 | N1 | 112.6° | 65.0° |
| C8 | N2 | C7 | C11 | 133.3° | 123.6° |
| N2 | C8 | C9 | O | 57.0° | 56.8° |
| C8 | N2 | C11 | C10 | 50.3° | 58.6° |
| C8 | N2 | C11 | H3 | 69.7° | 178.5° |
| C8 | N2 | C11 | H4 | 170.4° | 61.4° |
| N2 | C8 | H5 | H6 | 119.8° | 120.1° |
| N2 | C8 | C9 | H7 | 63.2° | 63.1° |
| N2 | C8 | C9 | H8 | 177.2° | 176.8° |
| N1 | C7 | N2 | C11 | 20.7° | 58.7° |
| C7 | N2 | C11 | C10 | 176.3° | 177.6° |
| C7 | N2 | C11 | H3 | 63.7° | 57.6° |
| C7 | N2 | C11 | H4 | 56.3° | 62.4° |
| C7 | N2 | C8 | H5 | 66.5° | 62.5° |
| C7 | N2 | C8 | H6 | 53.3° | 57.6° |
| C9 | O | C10 | C11 | 61.1° | 58.6° |
| O | C9 | C8 | H5 | 63.1° | 63.1° |
| O | C9 | C8 | H6 | 177.1° | 176.8° |
| O | C9 | H7 | H8 | 119.5° | 120.1° |
| C9 | O | C10 | H9 | 59.2° | 178.6° |
| C9 | O | C10 | H10 | 178.6° | 61.3° |
| N2 | C11 | C10 | O | 54.3° | 56.9° |
| N2 | C11 | C10 | H3 | 120.0° | 119.9° |
| N2 | C11 | C10 | H4 | 120.0° | 120.1° |
| N2 | C11 | H3 | H4 | 119.9° | 120.1° |
| C11 | N2 | C8 | H5 | 68.2° | 61.4° |
| C11 | N2 | C8 | H6 | 171.9° | 178.5° |
| N2 | C11 | C10 | H9 | 66.0° | 176.8° |
| N2 | C11 | C10 | H10 | 174.7° | 63.1° |
| O | C10 | C11 | H9 | 120.4° | 119.9° |
| O | C10 | C11 | H10 | 120.3° | 119.9° |
| O | C10 | C11 | H3 | 65.7° | 176.8° |
| O | C10 | C11 | H4 | 174.4° | 63.2° |
| C10 | O | C9 | H7 | 58.1° | 61.2° |
| C10 | O | C9 | H8 | 177.8° | 178.6° |
| O | C10 | H9 | H10 | 119.0° | 120.1° |
| C10 | C11 | H3 | H4 | 119.9° | 120.1° |
| C11 | C10 | H9 | H10 | 119.0° | 120.1° |
| H1 | C14 | C13 | H13 | 60.4° | 57.7° |
| H1 | C14 | C13 | H14 | 179.8° | 177.8° |
| H1 | C14 | C15 | H23 | 59.9° | 177.8° |
| H1 | C14 | C15 | H24 | 179.3° | 57.7° |
| H1 | C14 | C17 | H25 | 61.8° | 174.9° |
| H1 | C14 | C17 | H26 | 57.5° | 65.1° |
| H3 | C11 | C10 | H9 | 173.9° | 63.3° |
| H3 | C11 | C10 | H10 | 54.6° | 56.8° |
| H4 | C11 | C10 | H9 | 54.0° | 56.7° |
| H4 | C11 | C10 | H10 | 65.3° | 176.9° |
| H5 | C8 | C9 | H7 | 176.8° | 176.9° |
| H5 | C8 | C9 | H8 | 57.1° | 56.9° |
| H6 | C8 | C9 | H7 | 56.9° | 56.8° |
| H6 | C8 | C9 | H8 | 62.7° | 63.2° |
| H11 | C12 | C13 | H13 | 64.5° | 59.1° |
| H11 | C12 | C13 | H14 | 54.8° | 179.3° |
| H12 | C12 | C13 | H13 | 54.9° | 60.9° |
| H12 | C12 | C13 | H14 | 174.2° | 59.3° |
| H15 | C22 | C23 | H16 | 0.2° | 0.1° |
| H16 | C23 | C24 | H17 | 1.0° | 0.1° |
| H21 | C16 | C15 | H23 | 65.1° | 179.3° |
| H21 | C16 | C15 | H24 | 54.3° | 59.2° |
| H22 | C16 | C15 | H23 | 54.1° | 59.2° |
| H22 | C16 | C15 | H24 | 173.6° | 60.9° |
| H25 | C17 | O1 | H27 | 59.7° | 60.0° |
| H26 | C17 | O1 | H27 | 59.7° | 60.0° |
| H28 | C | H29 | H30 | 120.0° | 120.0° |
