A1IEG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | N4 | sing | 1.46Å | 1.46Å | |
| N4 | C12 | sing | 1.47Å | 1.46Å | |
| N4 | C10 | sing | 1.39Å | 1.45Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| C9 | C10 | doub | 1.40Å | 1.39Å | Aromatic |
| C9 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | N3 | sing | 1.33Å | 1.33Å | Aromatic |
| C13 | C16 | sing | 1.55Å | 1.53Å | |
| C13 | C14 | sing | 1.54Å | 1.53Å | |
| C8 | C7 | sing | 1.51Å | 1.50Å | |
| C7 | N2 | doub | 1.32Å | 1.34Å | Aromatic |
| N3 | C6 | doub | 1.32Å | 1.34Å | Aromatic |
| C16 | S | sing | 1.83Å | 1.79Å | |
| C6 | N2 | sing | 1.33Å | 1.35Å | Aromatic |
| C6 | N1 | sing | 1.38Å | 1.38Å | |
| C14 | C15 | sing | 1.54Å | 1.52Å | |
| C2 | N1 | sing | 1.47Å | 1.47Å | |
| C2 | C3 | sing | 1.54Å | 1.53Å | |
| C2 | C1 | sing | 1.51Å | 1.53Å | |
| N1 | C5 | sing | 1.48Å | 1.47Å | |
| O1 | S | doub | 1.42Å | 1.44Å | |
| C3 | C4 | sing | 1.55Å | 1.52Å | |
| S | C15 | sing | 1.83Å | 1.75Å | |
| S | O2 | doub | 1.42Å | 1.44Å | |
| O | C1 | doub | 1.21Å | 1.23Å | |
| C5 | C4 | sing | 1.55Å | 1.51Å | |
| C1 | N | sing | 1.35Å | 1.33Å | |
| N | C | sing | 1.46Å | 1.45Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.08Å | 1.08Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | 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 | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C5 | H20 | sing | 1.09Å | 1.10Å | |
| C5 | H21 | sing | 1.09Å | 1.10Å | |
| C4 | H22 | sing | 1.09Å | 1.10Å | |
| C4 | H23 | sing | 1.09Å | 1.10Å | |
| N | H24 | sing | 0.97Å | 1.00Å | |
| C | H25 | sing | 1.09Å | 1.10Å | |
| C | H26 | sing | 1.09Å | 1.10Å | |
| C | H27 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | N4 | C12 | 118.9° | 120.0° |
| C11 | N4 | C10 | 119.4° | 120.0° |
| N4 | C11 | H8 | 109.5° | 109.5° |
| N4 | C11 | H9 | 109.5° | 109.5° |
| N4 | C11 | H10 | 109.5° | 109.5° |
| C12 | N4 | C10 | 121.5° | 120.0° |
| N4 | C12 | C13 | 114.1° | 109.5° |
| N4 | C12 | H11 | 108.3° | 109.4° |
| N4 | C12 | H12 | 108.3° | 109.5° |
| N4 | C10 | C9 | 122.0° | 120.5° |
| N4 | C10 | N3 | 116.4° | 120.5° |
| C12 | C13 | C16 | 112.2° | 110.0° |
| C12 | C13 | C14 | 114.4° | 110.0° |
| C13 | C12 | H11 | 108.3° | 109.4° |
| C13 | C12 | H12 | 108.3° | 109.5° |
| C12 | C13 | H13 | 109.6° | 110.0° |
| C10 | C9 | C7 | 117.9° | 118.5° |
| C9 | C10 | N3 | 121.5° | 119.1° |
| C10 | C9 | H7 | 121.1° | 120.8° |
| C9 | C7 | C8 | 121.6° | 120.4° |
| C9 | C7 | N2 | 121.9° | 119.2° |
| C7 | C9 | H7 | 121.1° | 120.7° |
| C10 | N3 | C6 | 116.3° | 120.6° |
| C16 | C13 | C14 | 101.5° | 106.6° |
| C13 | C16 | S | 105.1° | 102.6° |
| C16 | C13 | H13 | 109.5° | 110.0° |
| C13 | C16 | H18 | 110.6° | 110.8° |
| C13 | C16 | H19 | 110.5° | 110.8° |
| C13 | C14 | C15 | 107.0° | 108.7° |
| C14 | C13 | H13 | 109.4° | 110.1° |
| C13 | C14 | H14 | 110.1° | 109.7° |
| C13 | C14 | H15 | 110.1° | 109.6° |
| C8 | C7 | N2 | 116.5° | 120.4° |
| C7 | C8 | H4 | 109.5° | 109.5° |
| C7 | C8 | H5 | 109.5° | 109.5° |
| C7 | C8 | H6 | 109.5° | 109.5° |
| C7 | N2 | C6 | 115.5° | 121.0° |
| N3 | C6 | N2 | 126.8° | 121.6° |
| N3 | C6 | N1 | 112.7° | 119.1° |
| C16 | S | O1 | 110.4° | 109.4° |
| C16 | S | C15 | 96.5° | 97.0° |
| C16 | S | O2 | 110.2° | 109.4° |
| S | C16 | H18 | 110.5° | 110.8° |
| S | C16 | H19 | 110.5° | 110.8° |
| N2 | C6 | N1 | 120.5° | 119.2° |
| C6 | N1 | C2 | 124.0° | 111.0° |
| C6 | N1 | C5 | 123.1° | 111.0° |
| C14 | C15 | S | 104.5° | 105.1° |
| C15 | C14 | H14 | 110.1° | 109.7° |
| C15 | C14 | H15 | 110.1° | 109.6° |
| C14 | C15 | H16 | 110.7° | 110.3° |
| C14 | C15 | H17 | 110.7° | 110.3° |
| N1 | C2 | C3 | 103.3° | 107.2° |
| N1 | C2 | C1 | 114.9° | 109.9° |
| C2 | N1 | C5 | 111.6° | 108.6° |
| N1 | C2 | H1 | 109.5° | 109.9° |
| C3 | C2 | C1 | 111.7° | 109.9° |
| C2 | C3 | C4 | 103.5° | 103.0° |
| C3 | C2 | H1 | 108.7° | 109.9° |
| C2 | C3 | H2 | 110.9° | 110.7° |
| C2 | C3 | H3 | 110.9° | 110.7° |
| C2 | C1 | O | 119.7° | 120.0° |
| C2 | C1 | N | 117.3° | 120.0° |
| C1 | C2 | H1 | 108.7° | 110.0° |
| N1 | C5 | C4 | 104.1° | 104.8° |
| N1 | C5 | H20 | 110.8° | 110.4° |
| N1 | C5 | H21 | 110.8° | 110.3° |
| O1 | S | C15 | 110.1° | 109.3° |
| O1 | S | O2 | 117.7° | 120.0° |
| C3 | C4 | C5 | 103.9° | 101.7° |
| C4 | C3 | H2 | 110.9° | 110.7° |
| C4 | C3 | H3 | 110.9° | 110.7° |
| C3 | C4 | H22 | 110.8° | 111.0° |
| C3 | C4 | H23 | 110.8° | 111.0° |
| C15 | S | O2 | 109.9° | 109.3° |
| S | C15 | H16 | 110.7° | 110.3° |
| S | C15 | H17 | 110.7° | 110.4° |
| O | C1 | N | 123.0° | 119.9° |
| C4 | C5 | H20 | 110.8° | 110.4° |
| C4 | C5 | H21 | 110.8° | 110.4° |
| C5 | C4 | H22 | 110.8° | 111.0° |
| C5 | C4 | H23 | 110.9° | 110.9° |
| C1 | N | C | 121.9° | 120.0° |
| C1 | N | H24 | 119.1° | 119.9° |
| C | N | H24 | 119.0° | 120.0° |
| N | C | H25 | 109.5° | 109.4° |
| N | C | H26 | 109.5° | 109.4° |
| N | C | H27 | 109.5° | 109.5° |
| H2 | C3 | H3 | 109.5° | 110.8° |
| H4 | C8 | H5 | 109.5° | 109.5° |
| H4 | C8 | H6 | 109.5° | 109.5° |
| H5 | C8 | H6 | 109.5° | 109.5° |
| H8 | C11 | H9 | 109.5° | 109.5° |
| H8 | C11 | H10 | 109.4° | 109.4° |
| H9 | C11 | H10 | 109.5° | 109.4° |
| H11 | C12 | H12 | 109.5° | 109.5° |
| H14 | C14 | H15 | 109.5° | 109.5° |
| H16 | C15 | H17 | 109.5° | 110.3° |
| H18 | C16 | H19 | 109.5° | 110.8° |
| H20 | C5 | H21 | 109.5° | 110.5° |
| H22 | C4 | H23 | 109.5° | 110.9° |
| H25 | C | H26 | 109.5° | 109.5° |
| H25 | C | H27 | 109.5° | 109.5° |
| H26 | C | H27 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | N4 | C12 | C10 | 174.1° | 180.0° |
| C11 | N4 | C12 | C13 | 77.7° | 90.0° |
| C11 | N4 | C10 | C9 | 3.9° | 5.0° |
| C11 | N4 | C10 | N3 | 176.8° | 175.0° |
| N4 | C11 | H8 | H9 | 120.0° | 120.0° |
| N4 | C11 | H8 | H10 | 120.0° | 120.0° |
| N4 | C11 | H9 | H10 | 120.0° | 120.0° |
| C11 | N4 | C12 | H11 | 43.0° | 30.0° |
| C11 | N4 | C12 | H12 | 161.6° | 150.0° |
| N4 | C12 | C13 | H11 | 120.7° | 120.0° |
| N4 | C12 | C13 | H12 | 120.7° | 120.0° |
| C12 | N4 | C10 | C9 | 177.9° | 175.0° |
| C12 | N4 | C10 | N3 | 2.7° | 5.0° |
| N4 | C12 | C13 | C16 | 153.5° | 175.0° |
| N4 | C12 | C13 | C14 | 38.6° | 67.8° |
| C12 | N4 | C11 | H8 | 180.0° | 90.0° |
| C12 | N4 | C11 | H9 | 60.0° | 150.0° |
| C12 | N4 | C11 | H10 | 60.0° | 30.0° |
| N4 | C12 | H11 | H12 | 117.9° | 120.0° |
| N4 | C12 | C13 | H13 | 84.6° | 53.6° |
| C10 | N4 | C12 | C13 | 108.2° | 90.0° |
| N4 | C10 | C9 | N3 | 179.3° | 179.9° |
| N4 | C10 | C9 | C7 | 179.9° | 180.0° |
| N4 | C10 | N3 | C6 | 179.2° | 179.8° |
| N4 | C10 | C9 | H7 | 0.1° | 0.1° |
| C10 | N4 | C11 | H8 | 5.8° | 90.0° |
| C10 | N4 | C11 | H9 | 114.3° | 30.0° |
| C10 | N4 | C11 | H10 | 125.8° | 150.0° |
| C10 | N4 | C12 | H11 | 131.1° | 150.0° |
| C10 | N4 | C12 | H12 | 12.5° | 30.0° |
| C12 | C13 | C16 | C14 | 122.6° | 119.3° |
| C12 | C13 | C16 | H13 | 121.9° | 121.4° |
| C12 | C13 | C14 | H13 | 123.3° | 121.4° |
| C12 | C13 | C16 | S | 165.3° | 161.8° |
| C12 | C13 | C14 | C15 | 174.2° | 166.5° |
| C13 | C12 | H11 | H12 | 117.9° | 120.0° |
| C12 | C13 | C14 | H14 | 54.6° | 46.6° |
| C12 | C13 | C14 | H15 | 66.2° | 73.7° |
| C12 | C13 | C16 | H18 | 75.4° | 79.9° |
| C12 | C13 | C16 | H19 | 46.0° | 43.5° |
| C10 | C9 | C7 | H7 | 180.0° | 179.9° |
| C10 | C9 | C7 | C8 | 179.8° | 179.8° |
| C10 | C9 | C7 | N2 | 2.7° | 0.0° |
| C9 | C10 | N3 | C6 | 0.1° | 0.3° |
| C7 | C9 | C10 | N3 | 0.6° | 0.0° |
| C9 | C7 | C8 | N2 | 177.6° | 179.7° |
| C9 | C7 | N2 | C6 | 3.8° | 0.2° |
| C9 | C7 | C8 | H4 | 177.6° | 89.7° |
| C9 | C7 | C8 | H5 | 62.4° | 30.3° |
| C9 | C7 | C8 | H6 | 57.6° | 150.3° |
| C10 | N3 | C6 | N2 | 1.2° | 0.5° |
| C10 | N3 | C6 | N1 | 179.5° | 180.0° |
| N3 | C10 | C9 | H7 | 179.4° | 179.9° |
| C16 | C13 | C14 | H13 | 115.6° | 119.3° |
| C13 | C16 | S | H18 | 119.3° | 118.3° |
| C13 | C16 | S | H19 | 119.3° | 118.3° |
| C16 | C13 | C14 | C15 | 53.1° | 47.2° |
| C13 | C16 | S | O1 | 94.8° | 90.2° |
| C13 | C16 | S | C15 | 19.4° | 23.2° |
| C13 | C16 | S | O2 | 133.5° | 136.6° |
| C16 | C13 | C12 | H11 | 85.8° | 65.0° |
| C16 | C13 | C12 | H12 | 32.8° | 55.0° |
| C16 | C13 | C14 | H14 | 66.5° | 72.7° |
| C16 | C13 | C14 | H15 | 172.7° | 167.0° |
| C13 | C16 | H18 | H19 | 122.0° | 123.4° |
| C14 | C13 | C16 | S | 42.7° | 42.4° |
| C13 | C14 | C15 | H14 | 119.6° | 119.9° |
| C13 | C14 | C15 | H15 | 119.6° | 119.8° |
| C13 | C14 | C15 | S | 38.8° | 27.9° |
| C14 | C13 | C12 | H11 | 159.2° | 52.2° |
| C14 | C13 | C12 | H12 | 82.1° | 172.2° |
| C13 | C14 | H14 | H15 | 121.2° | 120.3° |
| C13 | C14 | C15 | H16 | 158.0° | 146.8° |
| C13 | C14 | C15 | H17 | 80.4° | 91.0° |
| C14 | C13 | C16 | H18 | 162.0° | 160.7° |
| C14 | C13 | C16 | H19 | 76.5° | 75.8° |
| C8 | C7 | N2 | C6 | 178.5° | 180.0° |
| C7 | C8 | H4 | H5 | 120.0° | 120.0° |
| C7 | C8 | H4 | H6 | 120.0° | 120.0° |
| C7 | C8 | H5 | H6 | 120.0° | 120.0° |
| C8 | C7 | C9 | H7 | 0.2° | 0.4° |
| C7 | N2 | C6 | N3 | 3.2° | 0.5° |
| C7 | N2 | C6 | N1 | 177.6° | 180.0° |
| N2 | C7 | C8 | H4 | 0.0° | 90.0° |
| N2 | C7 | C8 | H5 | 120.0° | 149.9° |
| N2 | C7 | C8 | H6 | 120.0° | 29.9° |
| N2 | C7 | C9 | H7 | 177.3° | 179.9° |
| N3 | C6 | N2 | N1 | 179.2° | 179.5° |
| N3 | C6 | N1 | C2 | 9.7° | 180.0° |
| N3 | C6 | N1 | C5 | 175.6° | 59.2° |
| C16 | S | C15 | C14 | 10.8° | 2.1° |
| C16 | S | O1 | C15 | 105.3° | 105.1° |
| C16 | S | O1 | O2 | 127.7° | 127.5° |
| C16 | S | C15 | O2 | 114.3° | 113.4° |
| S | C16 | C13 | H13 | 72.8° | 76.9° |
| C16 | S | C15 | H16 | 130.0° | 121.0° |
| C16 | S | C15 | H17 | 108.4° | 116.8° |
| S | C16 | H18 | H19 | 122.0° | 123.4° |
| N2 | C6 | N1 | C2 | 171.0° | 0.5° |
| N2 | C6 | N1 | C5 | 5.1° | 121.3° |
| C6 | N1 | C2 | C5 | 167.4° | 122.2° |
| C6 | N1 | C2 | C3 | 155.0° | 123.3° |
| C6 | N1 | C2 | C1 | 83.1° | 117.3° |
| C6 | N1 | C5 | C4 | 178.2° | 146.4° |
| C6 | N1 | C2 | H1 | 39.4° | 3.8° |
| C6 | N1 | C5 | H20 | 59.0° | 27.5° |
| C6 | N1 | C5 | H21 | 62.7° | 94.8° |
| C14 | C15 | S | O1 | 125.3° | 115.5° |
| C14 | C15 | S | H16 | 119.2° | 118.9° |
| C14 | C15 | S | H17 | 119.2° | 119.0° |
| C14 | C15 | S | O2 | 103.4° | 111.3° |
| C15 | C14 | C13 | H13 | 62.5° | 72.1° |
| C15 | C14 | H14 | H15 | 121.1° | 120.3° |
| C14 | C15 | H16 | H17 | 122.3° | 122.2° |
| N1 | C2 | C3 | C1 | 124.0° | 119.4° |
| N1 | C2 | C3 | H1 | 116.2° | 119.5° |
| N1 | C2 | C1 | H1 | 123.0° | 121.1° |
| N1 | C2 | C3 | C4 | 30.3° | 22.2° |
| N1 | C2 | C1 | O | 163.4° | 0.3° |
| C2 | N1 | C5 | C4 | 10.7° | 24.2° |
| N1 | C2 | C1 | N | 17.2° | 180.0° |
| N1 | C2 | C3 | H2 | 149.4° | 140.6° |
| N1 | C2 | C3 | H3 | 88.7° | 96.2° |
| C2 | N1 | C5 | H20 | 108.4° | 94.7° |
| C2 | N1 | C5 | H21 | 129.8° | 143.0° |
| C3 | C2 | C1 | H1 | 119.8° | 121.1° |
| C3 | C2 | N1 | C5 | 12.3° | 1.1° |
| C2 | C3 | C4 | H2 | 119.0° | 118.4° |
| C2 | C3 | C4 | H3 | 119.1° | 118.3° |
| C3 | C2 | C1 | O | 79.5° | 118.0° |
| C2 | C3 | C4 | C5 | 37.4° | 35.7° |
| C3 | C2 | C1 | N | 99.9° | 62.2° |
| C2 | C3 | H2 | H3 | 122.8° | 123.1° |
| C2 | C3 | C4 | H22 | 81.7° | 82.5° |
| C2 | C3 | C4 | H23 | 156.5° | 153.7° |
| C1 | C2 | N1 | C5 | 109.5° | 120.4° |
| C1 | C2 | C3 | C4 | 93.6° | 97.1° |
| C2 | C1 | O | N | 179.4° | 179.8° |
| C2 | C1 | N | C | 178.1° | 180.0° |
| C1 | C2 | C3 | H2 | 25.4° | 21.3° |
| C1 | C2 | C3 | H3 | 147.3° | 144.5° |
| C2 | C1 | N | H24 | 1.9° | 0.0° |
| N1 | C5 | C4 | C3 | 29.6° | 37.1° |
| N1 | C5 | C4 | H20 | 119.1° | 118.8° |
| N1 | C5 | C4 | H21 | 119.1° | 118.7° |
| C5 | N1 | C2 | H1 | 127.9° | 118.4° |
| N1 | C5 | H20 | H21 | 122.5° | 122.3° |
| N1 | C5 | C4 | H22 | 89.5° | 81.0° |
| N1 | C5 | C4 | H23 | 148.7° | 155.2° |
| O1 | S | C15 | O2 | 131.2° | 133.2° |
| O1 | S | C15 | H16 | 115.4° | 125.6° |
| O1 | S | C15 | H17 | 6.2° | 3.4° |
| O1 | S | C16 | H18 | 24.5° | 28.1° |
| O1 | S | C16 | H19 | 145.9° | 151.6° |
| C3 | C4 | C5 | H22 | 119.1° | 118.1° |
| C3 | C4 | C5 | H23 | 119.1° | 118.1° |
| C4 | C3 | C2 | H1 | 146.5° | 141.7° |
| C4 | C3 | H2 | H3 | 122.8° | 123.3° |
| C3 | C4 | C5 | H20 | 89.5° | 81.7° |
| C3 | C4 | C5 | H21 | 148.7° | 155.9° |
| C3 | C4 | H22 | H23 | 122.6° | 123.9° |
| S | C15 | C14 | H14 | 80.8° | 92.0° |
| S | C15 | C14 | H15 | 158.4° | 147.8° |
| S | C15 | H16 | H17 | 122.3° | 122.2° |
| C15 | S | C16 | H18 | 138.7° | 141.5° |
| C15 | S | C16 | H19 | 99.8° | 95.1° |
| O2 | S | C15 | H16 | 15.8° | 7.6° |
| O2 | S | C15 | H17 | 137.4° | 129.8° |
| O2 | S | C16 | H18 | 107.2° | 105.1° |
| O2 | S | C16 | H19 | 14.2° | 18.3° |
| O | C1 | N | C | 1.3° | 0.2° |
| O | C1 | C2 | H1 | 40.4° | 120.8° |
| O | C1 | N | H24 | 178.7° | 179.7° |
| C5 | C4 | C3 | H2 | 156.4° | 154.0° |
| C5 | C4 | C3 | H3 | 81.7° | 82.7° |
| C4 | C5 | H20 | H21 | 122.5° | 122.4° |
| C5 | C4 | H22 | H23 | 122.6° | 123.8° |
| C1 | N | C | H24 | 180.0° | 179.9° |
| N | C1 | C2 | H1 | 140.2° | 58.9° |
| C1 | N | C | H25 | 180.0° | 180.0° |
| C1 | N | C | H26 | 60.0° | 60.1° |
| C1 | N | C | H27 | 60.0° | 60.0° |
| N | C | H25 | H26 | 120.0° | 119.9° |
| N | C | H25 | H27 | 120.0° | 120.0° |
| N | C | H26 | H27 | 120.0° | 120.0° |
| H1 | C2 | C3 | H2 | 94.5° | 99.9° |
| H1 | C2 | C3 | H3 | 27.4° | 23.3° |
| H2 | C3 | C4 | H22 | 37.3° | 35.9° |
| H2 | C3 | C4 | H23 | 84.5° | 87.9° |
| H3 | C3 | C4 | H22 | 159.2° | 159.2° |
| H3 | C3 | C4 | H23 | 37.4° | 35.4° |
| H4 | C8 | H5 | H6 | 120.0° | 120.0° |
| H8 | C11 | H9 | H10 | 120.0° | 120.0° |
| H11 | C12 | C13 | H13 | 36.0° | 173.6° |
| H12 | C12 | C13 | H13 | 154.7° | 66.4° |
| H13 | C13 | C14 | H14 | 177.9° | 168.0° |
| H13 | C13 | C14 | H15 | 57.1° | 47.7° |
| H13 | C13 | C16 | H18 | 46.5° | 41.4° |
| H13 | C13 | C16 | H19 | 167.9° | 164.8° |
| H14 | C14 | C15 | H16 | 38.3° | 26.9° |
| H14 | C14 | C15 | H17 | 159.9° | 149.1° |
| H15 | C14 | C15 | H16 | 82.4° | 93.4° |
| H15 | C14 | C15 | H17 | 39.2° | 28.8° |
| H20 | C5 | C4 | H22 | 151.4° | 160.2° |
| H20 | C5 | C4 | H23 | 29.6° | 36.4° |
| H21 | C5 | C4 | H22 | 29.6° | 37.7° |
| H21 | C5 | C4 | H23 | 92.1° | 86.1° |
| H24 | N | C | H25 | 0.0° | 0.0° |
| H24 | N | C | H26 | 120.0° | 120.0° |
| H24 | N | C | H27 | 120.0° | 120.0° |
| H25 | C | H26 | H27 | 120.0° | 120.1° |
