QEC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C12 | C13 | sing | 1.54Å | 1.56Å | |
| C12 | C14 | sing | 1.54Å | 1.55Å | |
| C13 | C15 | sing | 1.54Å | 1.56Å | |
| C14 | C15 | sing | 1.54Å | 1.55Å | |
| C15 | N7 | sing | 1.47Å | 1.47Å | |
| N7 | C19 | sing | 1.47Å | 1.47Å | |
| C19 | C5 | sing | 1.51Å | 1.51Å | |
| C5 | C1 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.38Å | Aromatic |
| C3 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C9 | C6 | sing | 1.39Å | 1.40Å | Aromatic |
| C9 | O1 | sing | 1.36Å | 1.37Å | |
| C17 | O1 | sing | 1.43Å | 1.43Å | |
| C6 | C18 | sing | 1.51Å | 1.51Å | |
| C18 | N4 | sing | 1.47Å | 1.48Å | |
| N6 | C22 | sing | 1.47Å | 1.45Å | |
| N6 | C10 | sing | 1.38Å | 1.34Å | |
| N2 | N4 | sing | 1.29Å | 1.37Å | Aromatic |
| N2 | C8 | doub | 1.31Å | 1.36Å | Aromatic |
| N4 | C4 | sing | 1.35Å | 1.34Å | Aromatic |
| C8 | C10 | sing | 1.46Å | 1.41Å | Aromatic |
| C8 | C7 | sing | 1.47Å | 1.41Å | Aromatic |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C10 | N3 | doub | 1.32Å | 1.34Å | Aromatic |
| C4 | C7 | doub | 1.37Å | 1.47Å | Aromatic |
| N3 | C11 | sing | 1.33Å | 1.35Å | Aromatic |
| C7 | N1 | sing | 1.35Å | 1.35Å | Aromatic |
| C11 | N1 | doub | 1.32Å | 1.35Å | Aromatic |
| C11 | N5 | sing | 1.38Å | 1.33Å | |
| C21 | C20 | sing | 1.53Å | 1.49Å | |
| C20 | C16 | sing | 1.53Å | 1.51Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| N5 | H29 | sing | 0.97Å | 1.00Å | |
| N5 | H28 | sing | 0.97Å | 1.00Å | |
| N6 | H30 | sing | 0.97Å | 1.00Å | |
| N7 | H31 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C12 | C14 | 89.1° | 87.1° |
| C12 | C13 | C15 | 87.9° | 87.1° |
| C13 | C12 | H5 | 114.3° | 113.7° |
| C13 | C12 | H6 | 114.3° | 113.6° |
| C12 | C13 | H7 | 114.6° | 113.6° |
| C12 | C13 | H8 | 114.6° | 113.6° |
| C12 | C14 | C15 | 88.1° | 87.1° |
| C14 | C12 | H5 | 114.3° | 113.6° |
| C14 | C12 | H6 | 114.3° | 113.6° |
| C12 | C14 | H10 | 114.5° | 113.7° |
| C12 | C14 | H9 | 114.5° | 113.6° |
| C13 | C15 | C14 | 89.2° | 87.1° |
| C13 | C15 | N7 | 112.8° | 113.6° |
| C15 | C13 | H7 | 114.6° | 113.6° |
| C15 | C13 | H8 | 114.5° | 113.6° |
| C13 | C15 | H11 | 113.2° | 113.6° |
| C14 | C15 | N7 | 111.4° | 113.6° |
| C15 | C14 | H10 | 114.5° | 113.6° |
| C15 | C14 | H9 | 114.6° | 113.6° |
| C14 | C15 | H11 | 113.2° | 113.6° |
| C15 | N7 | C19 | 115.6° | 111.0° |
| N7 | C15 | H11 | 114.6° | 112.9° |
| C15 | N7 | H31 | 107.9° | 111.0° |
| N7 | C19 | C5 | 110.4° | 109.5° |
| N7 | C19 | H20 | 109.2° | 109.5° |
| N7 | C19 | H21 | 109.2° | 109.4° |
| C19 | N7 | H31 | 107.9° | 111.0° |
| C19 | C5 | C1 | 121.1° | 120.0° |
| C19 | C5 | C3 | 120.5° | 120.0° |
| C5 | C19 | H20 | 109.3° | 109.5° |
| C5 | C19 | H21 | 109.2° | 109.5° |
| C1 | C5 | C3 | 118.4° | 120.0° |
| C5 | C1 | C2 | 121.0° | 120.1° |
| C5 | C1 | H1 | 119.5° | 119.9° |
| C5 | C3 | C9 | 120.8° | 120.0° |
| C5 | C3 | H3 | 119.6° | 120.0° |
| C1 | C2 | C6 | 121.2° | 120.1° |
| C2 | C1 | H1 | 119.5° | 120.0° |
| C1 | C2 | H2 | 119.4° | 119.9° |
| C3 | C9 | C6 | 120.9° | 119.9° |
| C3 | C9 | O1 | 123.8° | 120.1° |
| C9 | C3 | H3 | 119.6° | 120.0° |
| C2 | C6 | C9 | 117.7° | 119.9° |
| C2 | C6 | C18 | 118.5° | 120.0° |
| C6 | C2 | H2 | 119.4° | 120.0° |
| C6 | C9 | O1 | 115.4° | 120.0° |
| C9 | C6 | C18 | 123.7° | 120.0° |
| C9 | O1 | C17 | 117.8° | 117.0° |
| O1 | C17 | H15 | 109.5° | 109.5° |
| O1 | C17 | H16 | 109.5° | 109.4° |
| O1 | C17 | H17 | 109.5° | 109.4° |
| C6 | C18 | N4 | 106.1° | 109.4° |
| C6 | C18 | H19 | 110.3° | 109.5° |
| C6 | C18 | H18 | 110.3° | 109.5° |
| C18 | N4 | N2 | 117.6° | 124.1° |
| C18 | N4 | C4 | 127.6° | 124.1° |
| N4 | C18 | H19 | 110.3° | 109.5° |
| N4 | C18 | H18 | 110.3° | 109.5° |
| C22 | N6 | C10 | 123.2° | 120.0° |
| N6 | C22 | C21 | 109.2° | 109.5° |
| N6 | C22 | H27 | 109.5° | 109.5° |
| N6 | C22 | H26 | 109.5° | 109.4° |
| C22 | N6 | H30 | 105.9° | 120.0° |
| N6 | C10 | C8 | 121.7° | 121.1° |
| N6 | C10 | N3 | 118.1° | 121.1° |
| C10 | N6 | H30 | 106.0° | 120.0° |
| N4 | N2 | C8 | 105.2° | 110.7° |
| N2 | N4 | C4 | 114.5° | 111.8° |
| N2 | C8 | C10 | 129.9° | 137.0° |
| N2 | C8 | C7 | 110.9° | 106.1° |
| N4 | C4 | C7 | 104.4° | 106.9° |
| N4 | C4 | H4 | 127.8° | 126.5° |
| C10 | C8 | C7 | 118.9° | 117.0° |
| C8 | C10 | N3 | 119.6° | 117.8° |
| C8 | C7 | C4 | 104.9° | 104.4° |
| C8 | C7 | N1 | 120.5° | 118.2° |
| C22 | C21 | C20 | 115.4° | 109.5° |
| C22 | C21 | H24 | 107.9° | 109.5° |
| C22 | C21 | H25 | 108.0° | 109.5° |
| C21 | C22 | H27 | 109.6° | 109.5° |
| C21 | C22 | H26 | 109.6° | 109.5° |
| C10 | N3 | C11 | 118.0° | 122.4° |
| C4 | C7 | N1 | 134.5° | 137.4° |
| C7 | C4 | H4 | 127.8° | 126.6° |
| N3 | C11 | N1 | 125.9° | 124.2° |
| N3 | C11 | N5 | 117.1° | 118.0° |
| C7 | N1 | C11 | 116.9° | 120.6° |
| N1 | C11 | N5 | 117.0° | 117.9° |
| C11 | N5 | H29 | 109.5° | 120.0° |
| C11 | N5 | H28 | 109.5° | 120.0° |
| C21 | C20 | C16 | 112.6° | 109.5° |
| C21 | C20 | H23 | 108.7° | 109.4° |
| C21 | C20 | H22 | 108.7° | 109.4° |
| C20 | C21 | H24 | 108.0° | 109.4° |
| C20 | C21 | H25 | 108.0° | 109.5° |
| C20 | C16 | H14 | 109.5° | 109.5° |
| C20 | C16 | H12 | 109.5° | 109.5° |
| C20 | C16 | H13 | 109.5° | 109.5° |
| C16 | C20 | H23 | 108.7° | 109.5° |
| C16 | C20 | H22 | 108.7° | 109.5° |
| H5 | C12 | H6 | 109.5° | 112.9° |
| H7 | C13 | H8 | 109.5° | 112.9° |
| H10 | C14 | H9 | 109.5° | 112.9° |
| H14 | C16 | H12 | 109.4° | 109.5° |
| H14 | C16 | H13 | 109.5° | 109.4° |
| H12 | C16 | H13 | 109.5° | 109.4° |
| H15 | C17 | H16 | 109.5° | 109.5° |
| H15 | C17 | H17 | 109.5° | 109.5° |
| H16 | C17 | H17 | 109.4° | 109.5° |
| H19 | C18 | H18 | 109.5° | 109.5° |
| H20 | C19 | H21 | 109.5° | 109.5° |
| H23 | C20 | H22 | 109.5° | 109.5° |
| H24 | C21 | H25 | 109.5° | 109.4° |
| H27 | C22 | H26 | 109.5° | 109.5° |
| H29 | N5 | H28 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C12 | C14 | H5 | 116.4° | 114.6° |
| C13 | C12 | C14 | H6 | 116.4° | 114.5° |
| C12 | C13 | C15 | H7 | 116.1° | 114.6° |
| C12 | C13 | C15 | H8 | 116.2° | 114.6° |
| C13 | C12 | C14 | C15 | 17.9° | 25.4° |
| C12 | C13 | C15 | N7 | 130.8° | 140.0° |
| C13 | C12 | H5 | H6 | 129.6° | 131.2° |
| C12 | C13 | H7 | H8 | 130.3° | 131.3° |
| C13 | C12 | C14 | H10 | 134.1° | 140.0° |
| C13 | C12 | C14 | H9 | 98.3° | 89.1° |
| C12 | C13 | C15 | H11 | 97.1° | 89.1° |
| C12 | C14 | C15 | H10 | 116.2° | 114.6° |
| C12 | C14 | C15 | H9 | 116.2° | 114.6° |
| C12 | C14 | C15 | N7 | 132.1° | 140.0° |
| C14 | C12 | H5 | H6 | 129.7° | 131.2° |
| C14 | C12 | C13 | H7 | 98.3° | 89.1° |
| C14 | C12 | C13 | H8 | 134.0° | 140.0° |
| C12 | C14 | H10 | H9 | 130.2° | 131.3° |
| C12 | C14 | C15 | H11 | 97.0° | 89.1° |
| C13 | C15 | C14 | N7 | 114.2° | 114.6° |
| C13 | C15 | C14 | H11 | 115.0° | 114.5° |
| C13 | C15 | N7 | H11 | 131.4° | 131.3° |
| C13 | C15 | N7 | C19 | 98.3° | 155.0° |
| C15 | C13 | C12 | H5 | 98.5° | 89.2° |
| C15 | C13 | C12 | H6 | 134.3° | 139.9° |
| C15 | C13 | H7 | H8 | 130.3° | 131.2° |
| C13 | C15 | C14 | H10 | 134.1° | 140.0° |
| C13 | C15 | C14 | H9 | 98.2° | 89.1° |
| C13 | C15 | N7 | H31 | 140.8° | 81.0° |
| C14 | C15 | N7 | H11 | 130.1° | 131.2° |
| C14 | C15 | N7 | C19 | 163.1° | 107.5° |
| C15 | C14 | C12 | H5 | 98.5° | 89.2° |
| C15 | C14 | C12 | H6 | 134.3° | 140.0° |
| C14 | C15 | C13 | H7 | 98.2° | 89.1° |
| C14 | C15 | C13 | H8 | 134.1° | 140.0° |
| C15 | C14 | H10 | H9 | 130.2° | 131.2° |
| C14 | C15 | N7 | H31 | 42.3° | 16.5° |
| C15 | N7 | C19 | H31 | 120.9° | 124.0° |
| C15 | N7 | C19 | C5 | 111.0° | 180.0° |
| N7 | C15 | C13 | H7 | 14.7° | 25.4° |
| N7 | C15 | C13 | H8 | 113.0° | 105.4° |
| N7 | C15 | C14 | H10 | 111.7° | 105.4° |
| N7 | C15 | C14 | H9 | 16.0° | 25.4° |
| C15 | N7 | C19 | H20 | 128.8° | 60.0° |
| C15 | N7 | C19 | H21 | 9.1° | 60.0° |
| N7 | C19 | C5 | H20 | 120.2° | 120.0° |
| N7 | C19 | C5 | H21 | 120.1° | 120.0° |
| N7 | C19 | C5 | C1 | 69.0° | 90.0° |
| N7 | C19 | C5 | C3 | 109.6° | 90.8° |
| C19 | N7 | C15 | H11 | 33.0° | 23.7° |
| N7 | C19 | H20 | H21 | 119.6° | 120.0° |
| C19 | C5 | C1 | C3 | 178.6° | 179.2° |
| C19 | C5 | C1 | C2 | 179.0° | 180.0° |
| C19 | C5 | C3 | C9 | 178.9° | 179.7° |
| C19 | C5 | C1 | H1 | 0.9° | 0.6° |
| C19 | C5 | C3 | H3 | 1.1° | 0.3° |
| C5 | C19 | H20 | H21 | 119.5° | 120.0° |
| C5 | C19 | N7 | H31 | 9.9° | 56.0° |
| C5 | C1 | C2 | H1 | 180.0° | 179.5° |
| C1 | C5 | C3 | C9 | 0.3° | 0.6° |
| C5 | C1 | C2 | C6 | 1.2° | 0.4° |
| C1 | C5 | C3 | H3 | 179.8° | 179.5° |
| C5 | C1 | C2 | H2 | 178.8° | 180.0° |
| C1 | C5 | C19 | H20 | 51.1° | 150.0° |
| C1 | C5 | C19 | H21 | 170.9° | 29.9° |
| C3 | C5 | C1 | C2 | 0.4° | 0.8° |
| C5 | C3 | C9 | H3 | 180.0° | 179.9° |
| C5 | C3 | C9 | C6 | 0.9° | 0.0° |
| C5 | C3 | C9 | O1 | 179.9° | 179.7° |
| C3 | C5 | C1 | H1 | 179.5° | 179.7° |
| C3 | C5 | C19 | H20 | 130.3° | 29.2° |
| C3 | C5 | C19 | H21 | 10.6° | 149.2° |
| C1 | C2 | C6 | H2 | 180.0° | 179.6° |
| C1 | C2 | C6 | C9 | 1.8° | 0.1° |
| C1 | C2 | C6 | C18 | 179.1° | 180.0° |
| C3 | C9 | C6 | C2 | 1.6° | 0.3° |
| C3 | C9 | C6 | O1 | 179.1° | 179.7° |
| C3 | C9 | O1 | C17 | 2.9° | 0.3° |
| C3 | C9 | C6 | C18 | 178.8° | 179.8° |
| C2 | C6 | C9 | C18 | 177.2° | 179.8° |
| C2 | C6 | C9 | O1 | 179.3° | 180.0° |
| C2 | C6 | C18 | N4 | 92.0° | 95.1° |
| C6 | C2 | C1 | H1 | 178.8° | 179.9° |
| C2 | C6 | C18 | H19 | 148.5° | 24.9° |
| C2 | C6 | C18 | H18 | 27.5° | 144.9° |
| C6 | C9 | O1 | C17 | 178.0° | 180.0° |
| C9 | C6 | C18 | N4 | 85.2° | 85.1° |
| C6 | C9 | C3 | H3 | 179.1° | 179.9° |
| C9 | C6 | C2 | H2 | 178.3° | 179.5° |
| C9 | C6 | C18 | H19 | 34.3° | 155.0° |
| C9 | C6 | C18 | H18 | 155.3° | 34.9° |
| O1 | C9 | C6 | C18 | 2.1° | 0.1° |
| O1 | C9 | C3 | H3 | 0.1° | 0.3° |
| C9 | O1 | C17 | H15 | 180.0° | 60.0° |
| C9 | O1 | C17 | H16 | 60.0° | 60.0° |
| C9 | O1 | C17 | H17 | 60.0° | 180.0° |
| O1 | C17 | H15 | H16 | 120.0° | 120.0° |
| O1 | C17 | H15 | H17 | 120.0° | 120.0° |
| O1 | C17 | H16 | H17 | 120.0° | 120.0° |
| C6 | C18 | N4 | H19 | 119.5° | 120.0° |
| C6 | C18 | N4 | H18 | 119.5° | 120.0° |
| C6 | C18 | N4 | N2 | 71.6° | 55.0° |
| C6 | C18 | N4 | C4 | 102.2° | 125.0° |
| C18 | C6 | C2 | H2 | 0.9° | 0.4° |
| C6 | C18 | H19 | H18 | 121.6° | 120.1° |
| C18 | N4 | N2 | C4 | 174.6° | 180.0° |
| C18 | N4 | N2 | C8 | 175.0° | 180.0° |
| C18 | N4 | C4 | C7 | 175.4° | 180.0° |
| C18 | N4 | C4 | H4 | 4.6° | 0.0° |
| N4 | C18 | H19 | H18 | 121.6° | 120.0° |
| C22 | N6 | C10 | H30 | 121.9° | 180.0° |
| C22 | N6 | C10 | C8 | 132.5° | 180.0° |
| N6 | C22 | C21 | H27 | 120.0° | 120.0° |
| N6 | C22 | C21 | H26 | 119.9° | 120.0° |
| C22 | N6 | C10 | N3 | 56.1° | 0.0° |
| N6 | C22 | C21 | C20 | 166.9° | 180.0° |
| N6 | C22 | C21 | H24 | 72.3° | 60.0° |
| N6 | C22 | C21 | H25 | 46.0° | 60.0° |
| N6 | C22 | H27 | H26 | 120.1° | 119.9° |
| N6 | C10 | C8 | N2 | 10.0° | 0.1° |
| N6 | C10 | C8 | N3 | 171.3° | 180.0° |
| N6 | C10 | C8 | C7 | 176.6° | 180.0° |
| C10 | N6 | C22 | C21 | 64.1° | 180.0° |
| N6 | C10 | N3 | C11 | 175.7° | 179.9° |
| C10 | N6 | C22 | H27 | 175.9° | 60.0° |
| C10 | N6 | C22 | H26 | 55.8° | 60.0° |
| N4 | N2 | C8 | C10 | 174.7° | 180.0° |
| N4 | N2 | C8 | C7 | 0.9° | 0.1° |
| N2 | N4 | C4 | C7 | 1.4° | 0.0° |
| N2 | N4 | C4 | H4 | 178.5° | 180.0° |
| N2 | N4 | C18 | H19 | 168.9° | 174.9° |
| N2 | N4 | C18 | H18 | 47.9° | 65.0° |
| C8 | N2 | N4 | C4 | 0.4° | 0.1° |
| N2 | C8 | C10 | C7 | 173.4° | 179.9° |
| N2 | C8 | C10 | N3 | 178.6° | 179.9° |
| N2 | C8 | C7 | C4 | 1.7° | 0.1° |
| N2 | C8 | C7 | N1 | 176.8° | 180.0° |
| N4 | C4 | C7 | C8 | 1.8° | 0.0° |
| N4 | C4 | C7 | H4 | 180.0° | 180.0° |
| N4 | C4 | C7 | N1 | 176.4° | 179.9° |
| C4 | N4 | C18 | H19 | 17.3° | 5.1° |
| C4 | N4 | C18 | H18 | 138.3° | 115.0° |
| C10 | C8 | C7 | C4 | 176.3° | 180.0° |
| C8 | C10 | N3 | C11 | 4.0° | 0.0° |
| C10 | C8 | C7 | N1 | 2.2° | 0.1° |
| C8 | C10 | N6 | H30 | 105.7° | 0.0° |
| C7 | C8 | C10 | N3 | 5.2° | 0.0° |
| C8 | C7 | C4 | N1 | 178.3° | 179.9° |
| C8 | C7 | N1 | C11 | 1.8° | 0.0° |
| C8 | C7 | C4 | H4 | 178.1° | 180.0° |
| C22 | C21 | C20 | H24 | 120.8° | 120.0° |
| C22 | C21 | C20 | H25 | 120.9° | 120.0° |
| C22 | C21 | C20 | C16 | 166.2° | 180.0° |
| C22 | C21 | C20 | H23 | 45.7° | 60.0° |
| C22 | C21 | C20 | H22 | 73.3° | 60.0° |
| C22 | C21 | H24 | H25 | 117.3° | 120.0° |
| C21 | C22 | H27 | H26 | 120.2° | 120.0° |
| C21 | C22 | N6 | H30 | 174.0° | 0.0° |
| C10 | N3 | C11 | N1 | 0.2° | 0.1° |
| C10 | N3 | C11 | N5 | 179.4° | 180.0° |
| N3 | C10 | N6 | H30 | 65.8° | 180.0° |
| C4 | C7 | N1 | C11 | 179.8° | 179.9° |
| N3 | C11 | N1 | C7 | 3.2° | 0.1° |
| N3 | C11 | N1 | N5 | 179.2° | 179.9° |
| N3 | C11 | N5 | H29 | 0.0° | 0.0° |
| N3 | C11 | N5 | H28 | 120.0° | 180.0° |
| C7 | N1 | C11 | N5 | 177.6° | 179.9° |
| N1 | C7 | C4 | H4 | 3.6° | 0.1° |
| N1 | C11 | N5 | H29 | 179.3° | 179.9° |
| N1 | C11 | N5 | H28 | 60.7° | 0.2° |
| C11 | N5 | H29 | H28 | 120.0° | 179.9° |
| C21 | C20 | C16 | H23 | 120.5° | 120.0° |
| C21 | C20 | C16 | H22 | 120.4° | 120.0° |
| C21 | C20 | C16 | H14 | 180.0° | 60.0° |
| C21 | C20 | C16 | H12 | 60.0° | 60.0° |
| C21 | C20 | C16 | H13 | 60.0° | 180.0° |
| C21 | C20 | H23 | H22 | 118.6° | 119.9° |
| C20 | C21 | H24 | H25 | 117.3° | 119.9° |
| C20 | C21 | C22 | H27 | 46.9° | 60.0° |
| C20 | C21 | C22 | H26 | 73.2° | 60.0° |
| C20 | C16 | H14 | H12 | 120.0° | 120.0° |
| C20 | C16 | H14 | H13 | 120.0° | 120.0° |
| C20 | C16 | H12 | H13 | 120.0° | 120.0° |
| C16 | C20 | H23 | H22 | 118.6° | 120.0° |
| C16 | C20 | C21 | H24 | 72.9° | 60.0° |
| C16 | C20 | C21 | H25 | 45.3° | 60.0° |
| H1 | C1 | C2 | H2 | 1.2° | 0.5° |
| H5 | C12 | C13 | H7 | 145.3° | 156.3° |
| H5 | C12 | C13 | H8 | 17.6° | 25.4° |
| H5 | C12 | C14 | H10 | 17.7° | 25.4° |
| H5 | C12 | C14 | H9 | 145.3° | 156.3° |
| H6 | C12 | C13 | H7 | 18.1° | 25.4° |
| H6 | C12 | C13 | H8 | 109.6° | 105.5° |
| H6 | C12 | C14 | H10 | 109.5° | 105.5° |
| H6 | C12 | C14 | H9 | 18.1° | 25.5° |
| H7 | C13 | C15 | H11 | 146.8° | 156.4° |
| H8 | C13 | C15 | H11 | 19.1° | 25.5° |
| H10 | C14 | C15 | H11 | 19.2° | 25.5° |
| H9 | C14 | C15 | H11 | 146.8° | 156.3° |
| H11 | C15 | N7 | H31 | 87.9° | 147.7° |
| H14 | C16 | H12 | H13 | 120.0° | 120.0° |
| H14 | C16 | C20 | H23 | 59.5° | 60.0° |
| H14 | C16 | C20 | H22 | 59.6° | 180.0° |
| H12 | C16 | C20 | H23 | 179.5° | 180.0° |
| H12 | C16 | C20 | H22 | 60.4° | 59.9° |
| H13 | C16 | C20 | H23 | 60.5° | 60.0° |
| H13 | C16 | C20 | H22 | 179.6° | 60.0° |
| H15 | C17 | H16 | H17 | 120.0° | 120.0° |
| H20 | C19 | N7 | H31 | 110.3° | 64.0° |
| H21 | C19 | N7 | H31 | 130.0° | 176.0° |
| H23 | C20 | C21 | H24 | 166.6° | 180.0° |
| H23 | C20 | C21 | H25 | 75.1° | 60.1° |
| H22 | C20 | C21 | H24 | 47.5° | 60.1° |
| H22 | C20 | C21 | H25 | 165.8° | 180.0° |
| H24 | C21 | C22 | H27 | 167.8° | 180.0° |
| H24 | C21 | C22 | H26 | 47.7° | 60.0° |
| H25 | C21 | C22 | H27 | 74.0° | 60.0° |
| H25 | C21 | C22 | H26 | 165.9° | 179.9° |
| H27 | C22 | N6 | H30 | 54.0° | 120.0° |
| H26 | C22 | N6 | H30 | 66.0° | 120.0° |
