A1AIP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | sing | 1.51Å | 1.49Å | |
| C1 | N | doub | 1.31Å | 1.33Å | Aromatic |
| N | N1 | sing | 1.40Å | 1.36Å | Aromatic |
| C2 | N1 | sing | 1.46Å | 1.46Å | |
| N1 | C3 | sing | 1.35Å | 1.34Å | Aromatic |
| C3 | C4 | doub | 1.37Å | 1.37Å | Aromatic |
| C1 | C4 | sing | 1.41Å | 1.42Å | Aromatic |
| C4 | C5 | sing | 1.48Å | 1.46Å | |
| C5 | C6 | doub | 1.36Å | 1.37Å | Aromatic |
| C6 | C7 | sing | 1.46Å | 1.44Å | Aromatic |
| C7 | C8 | doub | 1.40Å | 1.42Å | Aromatic |
| C8 | N2 | sing | 1.38Å | 1.36Å | |
| N2 | C9 | sing | 1.47Å | 1.46Å | |
| C9 | C10 | sing | 1.51Å | 1.52Å | |
| C10 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.41Å | Aromatic |
| C15 | C14 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | S | sing | 1.77Å | 1.73Å | |
| O | S | doub | 1.42Å | 1.45Å | |
| S | O1 | doub | 1.42Å | 1.44Å | |
| C16 | S | sing | 1.82Å | 1.75Å | |
| C17 | C16 | sing | 1.54Å | 1.52Å | |
| C18 | C17 | sing | 1.52Å | 1.51Å | |
| C13 | C18 | sing | 1.50Å | 1.51Å | |
| C19 | C9 | sing | 1.53Å | 1.55Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C21 | C19 | sing | 1.53Å | 1.52Å | |
| N3 | C8 | sing | 1.33Å | 1.35Å | Aromatic |
| C22 | N3 | doub | 1.32Å | 1.34Å | Aromatic |
| N4 | C22 | sing | 1.32Å | 1.34Å | Aromatic |
| C23 | N4 | doub | 1.33Å | 1.35Å | Aromatic |
| C7 | C23 | sing | 1.41Å | 1.40Å | Aromatic |
| N5 | C23 | sing | 1.37Å | 1.37Å | Aromatic |
| C5 | N5 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | H9 | sing | 1.08Å | 1.08Å | |
| C15 | H13 | sing | 1.08Å | 1.08Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.08Å | 1.08Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C9 | H | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| N2 | H10 | sing | 0.97Å | 1.00Å | |
| N5 | H1 | sing | 0.97Å | 1.00Å | |
| C | H4 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.08Å | 1.08Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | N | 120.2° | 126.0° |
| C | C1 | C4 | 128.2° | 125.9° |
| C1 | C | H4 | 109.5° | 109.5° |
| C1 | C | H3 | 109.5° | 109.5° |
| C1 | C | H2 | 109.5° | 109.4° |
| C1 | N | N1 | 104.1° | 108.6° |
| N | C1 | C4 | 111.4° | 108.1° |
| N | N1 | C2 | 119.3° | 125.9° |
| N | N1 | C3 | 113.1° | 108.2° |
| C2 | N1 | C3 | 127.4° | 125.9° |
| N1 | C2 | H7 | 109.5° | 109.5° |
| N1 | C2 | H5 | 109.5° | 109.5° |
| N1 | C2 | H6 | 109.5° | 109.5° |
| N1 | C3 | C4 | 106.9° | 107.6° |
| N1 | C3 | H8 | 126.6° | 126.2° |
| C3 | C4 | C1 | 104.5° | 107.5° |
| C3 | C4 | C5 | 125.8° | 126.3° |
| C4 | C3 | H8 | 126.6° | 126.2° |
| C1 | C4 | C5 | 129.6° | 126.3° |
| C4 | C5 | C6 | 128.6° | 125.3° |
| C4 | C5 | N5 | 122.2° | 125.3° |
| C5 | C6 | C7 | 106.9° | 106.8° |
| C6 | C5 | N5 | 109.2° | 109.5° |
| C5 | C6 | H9 | 126.5° | 126.6° |
| C6 | C7 | C8 | 137.4° | 135.0° |
| C6 | C7 | C23 | 107.0° | 106.4° |
| C7 | C6 | H9 | 126.6° | 126.6° |
| C7 | C8 | N2 | 120.6° | 120.8° |
| C7 | C8 | N3 | 120.3° | 118.3° |
| C8 | C7 | C23 | 115.5° | 118.6° |
| C8 | N2 | C9 | 125.5° | 120.0° |
| N2 | C8 | N3 | 119.0° | 120.9° |
| C8 | N2 | H10 | 105.3° | 120.0° |
| N2 | C9 | C10 | 112.8° | 109.5° |
| N2 | C9 | C19 | 110.0° | 109.4° |
| N2 | C9 | H | 107.9° | 109.5° |
| C9 | N2 | H10 | 105.3° | 120.0° |
| C9 | C10 | C11 | 120.8° | 120.3° |
| C9 | C10 | C15 | 120.9° | 120.3° |
| C10 | C9 | C19 | 111.8° | 109.5° |
| C10 | C9 | H | 107.2° | 109.5° |
| C10 | C11 | C12 | 120.9° | 119.9° |
| C11 | C10 | C15 | 118.2° | 119.5° |
| C10 | C11 | H11 | 119.5° | 120.1° |
| C11 | C12 | C13 | 121.9° | 120.9° |
| C11 | C12 | H12 | 119.0° | 119.5° |
| C12 | C11 | H11 | 119.5° | 120.0° |
| C12 | C13 | C14 | 116.7° | 118.8° |
| C12 | C13 | C18 | 119.3° | 116.5° |
| C13 | C12 | H12 | 119.1° | 119.5° |
| C13 | C14 | C15 | 121.5° | 120.3° |
| C13 | C14 | S | 122.1° | 121.9° |
| C14 | C13 | C18 | 124.0° | 124.7° |
| C14 | C15 | C10 | 120.7° | 120.6° |
| C15 | C14 | S | 116.3° | 117.8° |
| C14 | C15 | H13 | 119.7° | 119.7° |
| C10 | C15 | H13 | 119.7° | 119.7° |
| C14 | S | O | 108.8° | 104.4° |
| C14 | S | O1 | 108.7° | 104.4° |
| C14 | S | C16 | 103.0° | 103.6° |
| O | S | O1 | 117.7° | 121.2° |
| O | S | C16 | 108.9° | 110.7° |
| O1 | S | C16 | 108.7° | 110.7° |
| S | C16 | C17 | 109.2° | 107.1° |
| S | C16 | H15 | 109.5° | 109.9° |
| S | C16 | H14 | 109.6° | 109.9° |
| C16 | C17 | C18 | 108.7° | 109.1° |
| C16 | C17 | H16 | 109.7° | 109.5° |
| C16 | C17 | H17 | 109.7° | 109.6° |
| C17 | C16 | H15 | 109.6° | 109.9° |
| C17 | C16 | H14 | 109.5° | 109.9° |
| C17 | C18 | C13 | 112.5° | 113.8° |
| C18 | C17 | H16 | 109.7° | 109.6° |
| C18 | C17 | H17 | 109.7° | 109.6° |
| C17 | C18 | H18 | 108.7° | 108.6° |
| C17 | C18 | H19 | 108.7° | 108.6° |
| C13 | C18 | H18 | 108.7° | 108.6° |
| C13 | C18 | H19 | 108.7° | 108.6° |
| C9 | C19 | C20 | 111.5° | 109.5° |
| C9 | C19 | C21 | 111.8° | 109.5° |
| C19 | C9 | H | 106.9° | 109.5° |
| C9 | C19 | H20 | 107.5° | 109.5° |
| C20 | C19 | C21 | 110.4° | 109.5° |
| C19 | C20 | H22 | 109.5° | 109.5° |
| C19 | C20 | H21 | 109.5° | 109.4° |
| C19 | C20 | H23 | 109.4° | 109.5° |
| C20 | C19 | H20 | 107.7° | 109.5° |
| C19 | C21 | H25 | 109.5° | 109.4° |
| C19 | C21 | H26 | 109.5° | 109.5° |
| C19 | C21 | H24 | 109.5° | 109.5° |
| C21 | C19 | H20 | 107.7° | 109.4° |
| C8 | N3 | C22 | 117.1° | 121.0° |
| N3 | C22 | N4 | 129.0° | 122.8° |
| N3 | C22 | H27 | 115.5° | 118.6° |
| C22 | N4 | C23 | 112.6° | 120.7° |
| N4 | C22 | H27 | 115.5° | 118.6° |
| N4 | C23 | C7 | 125.4° | 118.5° |
| N4 | C23 | N5 | 126.5° | 134.1° |
| C7 | C23 | N5 | 108.1° | 107.4° |
| C23 | N5 | C5 | 108.8° | 110.0° |
| C23 | N5 | H1 | 125.6° | 125.0° |
| C5 | N5 | H1 | 125.6° | 125.1° |
| H16 | C17 | H17 | 109.5° | 109.5° |
| H22 | C20 | H21 | 109.5° | 109.4° |
| H22 | C20 | H23 | 109.5° | 109.5° |
| H21 | C20 | H23 | 109.5° | 109.5° |
| H25 | C21 | H26 | 109.4° | 109.4° |
| H25 | C21 | H24 | 109.5° | 109.5° |
| H26 | C21 | H24 | 109.5° | 109.5° |
| H15 | C16 | H14 | 109.5° | 110.0° |
| H18 | C18 | H19 | 109.5° | 108.4° |
| H4 | C | H3 | 109.5° | 109.5° |
| H4 | C | H2 | 109.5° | 109.5° |
| H3 | C | H2 | 109.5° | 109.4° |
| H7 | C2 | H5 | 109.5° | 109.5° |
| H7 | C2 | H6 | 109.5° | 109.5° |
| H5 | C2 | H6 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | N | C4 | 176.3° | 180.0° |
| C | C1 | N | N1 | 176.5° | 180.0° |
| C | C1 | C4 | C3 | 176.6° | 180.0° |
| C | C1 | C4 | C5 | 6.0° | 0.0° |
| C1 | C | H4 | H3 | 120.0° | 120.1° |
| C1 | C | H4 | H2 | 120.0° | 120.0° |
| C1 | C | H3 | H2 | 120.0° | 120.0° |
| C1 | N | N1 | C2 | 174.7° | 179.7° |
| C1 | N | N1 | C3 | 0.4° | 0.0° |
| N | C1 | C4 | C3 | 0.6° | 0.0° |
| N | C1 | C4 | C5 | 178.1° | 180.0° |
| N | C1 | C | H4 | 0.0° | 90.0° |
| N | C1 | C | H3 | 120.0° | 150.0° |
| N | C1 | C | H2 | 120.0° | 30.0° |
| N | N1 | C2 | C3 | 174.4° | 179.6° |
| N | N1 | C3 | C4 | 0.8° | 0.0° |
| N1 | N | C1 | C4 | 0.1° | 0.0° |
| N | N1 | C3 | H8 | 179.2° | 180.0° |
| N | N1 | C2 | H7 | 0.0° | 90.3° |
| N | N1 | C2 | H5 | 120.0° | 29.7° |
| N | N1 | C2 | H6 | 120.0° | 149.6° |
| C2 | N1 | C3 | C4 | 173.9° | 179.7° |
| C2 | N1 | C3 | H8 | 6.1° | 0.3° |
| N1 | C2 | H7 | H5 | 120.0° | 120.0° |
| N1 | C2 | H7 | H6 | 120.0° | 120.0° |
| N1 | C2 | H5 | H6 | 120.0° | 120.0° |
| N1 | C3 | C4 | H8 | 180.0° | 180.0° |
| N1 | C3 | C4 | C1 | 0.8° | 0.0° |
| N1 | C3 | C4 | C5 | 178.4° | 180.0° |
| C3 | N1 | C2 | H7 | 174.4° | 90.0° |
| C3 | N1 | C2 | H5 | 65.6° | 150.0° |
| C3 | N1 | C2 | H6 | 54.4° | 30.0° |
| C3 | C4 | C1 | C5 | 177.5° | 180.0° |
| C3 | C4 | C5 | C6 | 163.1° | 40.0° |
| C3 | C4 | C5 | N5 | 18.5° | 140.0° |
| C1 | C4 | C5 | C6 | 13.9° | 140.0° |
| C1 | C4 | C5 | N5 | 164.5° | 40.0° |
| C4 | C1 | C | H4 | 175.7° | 90.0° |
| C4 | C1 | C | H3 | 55.7° | 30.0° |
| C4 | C1 | C | H2 | 64.4° | 150.0° |
| C1 | C4 | C3 | H8 | 179.2° | 180.0° |
| C4 | C5 | C6 | N5 | 178.5° | 180.0° |
| C4 | C5 | C6 | C7 | 179.8° | 180.0° |
| C4 | C5 | N5 | C23 | 179.5° | 180.0° |
| C4 | C5 | C6 | H9 | 0.2° | 0.0° |
| C4 | C5 | N5 | H1 | 0.5° | 0.0° |
| C5 | C4 | C3 | H8 | 1.6° | 0.0° |
| C5 | C6 | C7 | H9 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 175.7° | 180.0° |
| C5 | C6 | C7 | C23 | 0.9° | 0.0° |
| C6 | C5 | N5 | C23 | 1.8° | 0.0° |
| C6 | C5 | N5 | H1 | 178.2° | 180.0° |
| C6 | C7 | C8 | C23 | 176.4° | 180.0° |
| C6 | C7 | C8 | N2 | 1.9° | 0.0° |
| C6 | C7 | C8 | N3 | 178.9° | 179.9° |
| C6 | C7 | C23 | N4 | 178.5° | 180.0° |
| C6 | C7 | C23 | N5 | 0.2° | 0.0° |
| C7 | C6 | C5 | N5 | 1.6° | 0.0° |
| C7 | C8 | N2 | N3 | 177.0° | 179.9° |
| C7 | C8 | N2 | C9 | 167.8° | 180.0° |
| C7 | C8 | N3 | C22 | 1.6° | 0.1° |
| C8 | C7 | C23 | N4 | 1.1° | 0.0° |
| C8 | C7 | C23 | N5 | 177.7° | 180.0° |
| C8 | C7 | C6 | H9 | 4.3° | 0.0° |
| C7 | C8 | N2 | H10 | 70.1° | 0.0° |
| C8 | N2 | C9 | H10 | 122.2° | 180.0° |
| C8 | N2 | C9 | C10 | 93.3° | 155.0° |
| C8 | N2 | C9 | C19 | 141.1° | 85.0° |
| N2 | C8 | N3 | C22 | 175.4° | 180.0° |
| N2 | C8 | C7 | C23 | 174.5° | 180.0° |
| C8 | N2 | C9 | H | 24.9° | 35.0° |
| N2 | C9 | C10 | C19 | 124.6° | 120.0° |
| N2 | C9 | C10 | H | 118.6° | 120.0° |
| N2 | C9 | C10 | C11 | 124.3° | 40.0° |
| N2 | C9 | C10 | C15 | 52.0° | 140.3° |
| N2 | C9 | C19 | H | 116.8° | 120.0° |
| N2 | C9 | C19 | C20 | 57.5° | 60.0° |
| N2 | C9 | C19 | C21 | 178.3° | 60.0° |
| C9 | N2 | C8 | N3 | 15.2° | 0.0° |
| N2 | C9 | C19 | H20 | 60.3° | 180.0° |
| C9 | C10 | C11 | C15 | 176.3° | 179.7° |
| C9 | C10 | C11 | C12 | 175.2° | 179.4° |
| C9 | C10 | C15 | C14 | 175.2° | 179.7° |
| C10 | C9 | C19 | H | 117.0° | 120.0° |
| C10 | C9 | C19 | C20 | 176.3° | 180.0° |
| C10 | C9 | C19 | C21 | 52.2° | 59.9° |
| C9 | C10 | C15 | H13 | 4.8° | 0.2° |
| C9 | C10 | C11 | H11 | 4.8° | 0.6° |
| C10 | C9 | C19 | H20 | 65.9° | 60.0° |
| C10 | C9 | N2 | H10 | 144.5° | 25.0° |
| C10 | C11 | C12 | H11 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 0.9° | 0.0° |
| C11 | C10 | C15 | C14 | 1.1° | 0.0° |
| C11 | C10 | C9 | C19 | 111.1° | 80.0° |
| C11 | C10 | C15 | H13 | 178.8° | 180.0° |
| C10 | C11 | C12 | H12 | 179.1° | 179.9° |
| C11 | C10 | C9 | H | 5.7° | 160.0° |
| C11 | C12 | C13 | H12 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 0.5° | 0.7° |
| C12 | C11 | C10 | C15 | 1.1° | 0.3° |
| C11 | C12 | C13 | C18 | 177.3° | 178.9° |
| C12 | C13 | C14 | C18 | 177.8° | 179.6° |
| C12 | C13 | C14 | C15 | 0.5° | 1.1° |
| C12 | C13 | C14 | S | 178.1° | 178.1° |
| C12 | C13 | C18 | C17 | 157.1° | 155.8° |
| C12 | C13 | C18 | H18 | 82.4° | 83.1° |
| C12 | C13 | C18 | H19 | 36.7° | 34.7° |
| C13 | C12 | C11 | H11 | 179.1° | 180.0° |
| C13 | C14 | C15 | S | 178.6° | 179.2° |
| C13 | C14 | C15 | C10 | 0.9° | 0.7° |
| C13 | C14 | S | O | 129.9° | 103.4° |
| C13 | C14 | S | O1 | 100.8° | 128.5° |
| C13 | C14 | S | C16 | 14.5° | 12.5° |
| C14 | C13 | C18 | C17 | 25.2° | 24.7° |
| C13 | C14 | C15 | H13 | 179.1° | 179.3° |
| C14 | C13 | C18 | H18 | 95.3° | 96.5° |
| C14 | C13 | C18 | H19 | 145.6° | 145.8° |
| C14 | C13 | C12 | H12 | 179.5° | 179.2° |
| C14 | C15 | C10 | H13 | 180.0° | 180.0° |
| C15 | C14 | S | O | 51.5° | 75.8° |
| C15 | C14 | S | O1 | 77.9° | 52.3° |
| C15 | C14 | S | C16 | 166.9° | 168.2° |
| C15 | C14 | C13 | C18 | 177.2° | 178.5° |
| C10 | C15 | C14 | S | 177.8° | 178.5° |
| C15 | C10 | C9 | C19 | 72.6° | 99.7° |
| C15 | C10 | C11 | H11 | 178.9° | 179.6° |
| C15 | C10 | C9 | H | 170.6° | 20.3° |
| C14 | S | O | O1 | 124.2° | 117.1° |
| C14 | S | O | C16 | 111.6° | 110.9° |
| C14 | S | O1 | C16 | 111.5° | 110.9° |
| C14 | S | C16 | C17 | 47.0° | 44.9° |
| S | C14 | C13 | C18 | 4.2° | 2.3° |
| S | C14 | C15 | H13 | 2.2° | 1.5° |
| C14 | S | C16 | H15 | 72.9° | 74.5° |
| C14 | S | C16 | H14 | 167.0° | 164.3° |
| O | S | O1 | C16 | 124.3° | 132.0° |
| O | S | C16 | C17 | 162.4° | 66.5° |
| O | S | C16 | H15 | 42.4° | 174.1° |
| O | S | C16 | H14 | 77.7° | 52.9° |
| O1 | S | C16 | C17 | 68.2° | 156.3° |
| O1 | S | C16 | H15 | 171.8° | 36.9° |
| O1 | S | C16 | H14 | 51.7° | 84.3° |
| S | C16 | C17 | H15 | 119.9° | 119.4° |
| S | C16 | C17 | H14 | 120.0° | 119.4° |
| S | C16 | C17 | C18 | 73.1° | 71.4° |
| S | C16 | C17 | H16 | 167.0° | 48.5° |
| S | C16 | C17 | H17 | 46.8° | 168.6° |
| S | C16 | H15 | H14 | 120.1° | 121.2° |
| C16 | C17 | C18 | H16 | 119.9° | 119.9° |
| C16 | C17 | C18 | H17 | 119.9° | 120.0° |
| C16 | C17 | C18 | C13 | 60.2° | 61.5° |
| C16 | C17 | H16 | H17 | 120.4° | 120.2° |
| C17 | C16 | H15 | H14 | 120.1° | 121.2° |
| C16 | C17 | C18 | H18 | 60.2° | 59.7° |
| C16 | C17 | C18 | H19 | 179.3° | 177.4° |
| C17 | C18 | C13 | H18 | 120.5° | 121.1° |
| C17 | C18 | C13 | H19 | 120.5° | 121.1° |
| C18 | C17 | H16 | H17 | 120.4° | 120.3° |
| C18 | C17 | C16 | H15 | 46.9° | 48.0° |
| C18 | C17 | C16 | H14 | 166.9° | 169.2° |
| C17 | C18 | H18 | H19 | 118.6° | 117.8° |
| C13 | C18 | C17 | H16 | 179.9° | 58.4° |
| C13 | C18 | C17 | H17 | 59.7° | 178.6° |
| C13 | C18 | H18 | H19 | 118.6° | 117.9° |
| C18 | C13 | C12 | H12 | 2.7° | 1.2° |
| C9 | C19 | C20 | C21 | 124.9° | 120.1° |
| C9 | C19 | C20 | H20 | 117.7° | 120.0° |
| C9 | C19 | C21 | H20 | 117.9° | 120.0° |
| C9 | C19 | C20 | H22 | 180.0° | 60.0° |
| C9 | C19 | C20 | H21 | 60.0° | 60.0° |
| C9 | C19 | C20 | H23 | 60.0° | 180.0° |
| C9 | C19 | C21 | H25 | 180.0° | 60.0° |
| C9 | C19 | C21 | H26 | 60.0° | 59.9° |
| C9 | C19 | C21 | H24 | 60.0° | 180.0° |
| C19 | C9 | N2 | H10 | 18.9° | 95.0° |
| C20 | C19 | C21 | H20 | 117.4° | 119.9° |
| C19 | C20 | H22 | H21 | 120.0° | 119.9° |
| C19 | C20 | H22 | H23 | 120.0° | 120.0° |
| C19 | C20 | H21 | H23 | 120.0° | 120.0° |
| C20 | C19 | C21 | H25 | 55.3° | 60.1° |
| C20 | C19 | C21 | H26 | 175.2° | 180.0° |
| C20 | C19 | C21 | H24 | 64.8° | 59.9° |
| C20 | C19 | C9 | H | 59.3° | 60.0° |
| C21 | C19 | C20 | H22 | 55.0° | 180.0° |
| C21 | C19 | C20 | H21 | 65.0° | 60.1° |
| C21 | C19 | C20 | H23 | 175.1° | 59.9° |
| C19 | C21 | H25 | H26 | 120.0° | 119.9° |
| C19 | C21 | H25 | H24 | 120.0° | 120.0° |
| C19 | C21 | H26 | H24 | 120.0° | 120.1° |
| C21 | C19 | C9 | H | 64.8° | 180.0° |
| C8 | N3 | C22 | N4 | 0.9° | 0.0° |
| N3 | C8 | C7 | C23 | 2.5° | 0.1° |
| C8 | N3 | C22 | H27 | 179.1° | 180.0° |
| N3 | C8 | N2 | H10 | 106.9° | 180.0° |
| N3 | C22 | N4 | H27 | 180.0° | 180.0° |
| N3 | C22 | N4 | C23 | 2.2° | 0.0° |
| C22 | N4 | C23 | C7 | 1.0° | 0.0° |
| C22 | N4 | C23 | N5 | 179.6° | 180.0° |
| N4 | C23 | C7 | N5 | 178.8° | 180.0° |
| N4 | C23 | N5 | C5 | 177.5° | 180.0° |
| C23 | N4 | C22 | H27 | 177.8° | 180.0° |
| N4 | C23 | N5 | H1 | 2.5° | 0.0° |
| C7 | C23 | N5 | C5 | 1.3° | 0.0° |
| C23 | C7 | C6 | H9 | 179.1° | 180.0° |
| C7 | C23 | N5 | H1 | 178.7° | 180.0° |
| C23 | N5 | C5 | H1 | 180.0° | 180.0° |
| N5 | C5 | C6 | H9 | 178.3° | 180.0° |
| H16 | C17 | C16 | H15 | 73.0° | 167.9° |
| H16 | C17 | C16 | H14 | 47.0° | 70.9° |
| H16 | C17 | C18 | H18 | 59.6° | 179.5° |
| H16 | C17 | C18 | H19 | 59.4° | 62.8° |
| H17 | C17 | C16 | H15 | 166.7° | 71.9° |
| H17 | C17 | C16 | H14 | 73.2° | 49.2° |
| H17 | C17 | C18 | H18 | 179.9° | 60.3° |
| H17 | C17 | C18 | H19 | 60.8° | 57.4° |
| H22 | C20 | H21 | H23 | 120.0° | 120.0° |
| H22 | C20 | C19 | H20 | 62.3° | 60.1° |
| H21 | C20 | C19 | H20 | 177.7° | 180.0° |
| H23 | C20 | C19 | H20 | 57.7° | 60.0° |
| H25 | C21 | H26 | H24 | 120.0° | 120.0° |
| H25 | C21 | C19 | H20 | 62.1° | 180.0° |
| H26 | C21 | C19 | H20 | 57.9° | 60.1° |
| H24 | C21 | C19 | H20 | 177.9° | 60.0° |
| H12 | C12 | C11 | H11 | 0.9° | 0.0° |
| H | C9 | C19 | H20 | 177.1° | 60.0° |
| H | C9 | N2 | H10 | 97.3° | 145.0° |
| H4 | C | H3 | H2 | 120.0° | 120.0° |
| H7 | C2 | H5 | H6 | 120.0° | 120.0° |
