A1H2Y
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C8 | C7 | sing | 1.54Å | 1.56Å | |
| C8 | N5 | sing | 1.48Å | 1.46Å | |
| C3 | C2 | sing | 1.53Å | 1.55Å | |
| C7 | C6 | sing | 1.54Å | 1.51Å | |
| C2 | C4 | sing | 1.53Å | 1.55Å | |
| C2 | N1 | sing | 1.47Å | 1.51Å | |
| O29 | C28 | doub | 1.22Å | 1.24Å | |
| C4 | N5 | sing | 1.47Å | 1.52Å | |
| N5 | C6 | sing | 1.48Å | 1.50Å | |
| N1 | C28 | sing | 1.35Å | 1.36Å | |
| C28 | C24 | sing | 1.47Å | 1.38Å | |
| C24 | N25 | sing | 1.37Å | 1.37Å | Aromatic |
| C24 | C23 | doub | 1.38Å | 1.41Å | Aromatic |
| C27 | N25 | sing | 1.46Å | 1.49Å | |
| N25 | N26 | sing | 1.28Å | 1.35Å | Aromatic |
| C32 | O31 | sing | 1.43Å | 1.47Å | |
| C23 | C10 | sing | 1.41Å | 1.40Å | Aromatic |
| O31 | C19 | sing | 1.36Å | 1.40Å | |
| N26 | C10 | doub | 1.32Å | 1.34Å | Aromatic |
| C10 | C9 | sing | 1.48Å | 1.41Å | |
| C19 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
| C19 | C18 | sing | 1.39Å | 1.42Å | Aromatic |
| C20 | C21 | sing | 1.39Å | 1.38Å | Aromatic |
| C18 | C17 | doub | 1.39Å | 1.39Å | Aromatic |
| C9 | N15 | doub | 1.33Å | 1.37Å | Aromatic |
| C9 | C11 | sing | 1.40Å | 1.41Å | Aromatic |
| N15 | C14 | sing | 1.32Å | 1.35Å | Aromatic |
| C21 | O30 | sing | 1.36Å | 1.38Å | |
| C21 | C22 | doub | 1.39Å | 1.42Å | Aromatic |
| C17 | C22 | sing | 1.39Å | 1.40Å | Aromatic |
| C17 | N16 | sing | 1.40Å | 1.36Å | |
| O30 | C33 | sing | 1.43Å | 1.44Å | |
| C11 | C12 | doub | 1.38Å | 1.41Å | Aromatic |
| C14 | N16 | sing | 1.39Å | 1.35Å | |
| C14 | N13 | doub | 1.33Å | 1.38Å | Aromatic |
| C12 | N13 | sing | 1.32Å | 1.42Å | Aromatic |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C7 | H71 | sing | 1.09Å | 1.10Å | |
| C7 | H72 | sing | 1.09Å | 1.10Å | |
| C8 | H81 | sing | 1.09Å | 1.10Å | |
| C8 | H82 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| N1 | H13 | sing | 0.97Å | 1.00Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C3 | H33 | sing | 1.09Å | 1.10Å | |
| C3 | H31 | sing | 1.09Å | 1.10Å | |
| C3 | H32 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H42 | sing | 1.09Å | 1.10Å | |
| C4 | H41 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C27 | H83 | sing | 1.09Å | 1.10Å | |
| C27 | H84 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| N16 | H16 | sing | 0.97Å | 1.00Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C33 | H9A | sing | 1.09Å | 1.10Å | |
| C33 | H88 | sing | 1.09Å | 1.10Å | |
| C33 | H89 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C32 | H85 | sing | 1.09Å | 1.10Å | |
| C32 | H86 | sing | 1.09Å | 1.10Å | |
| C32 | H87 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C7 | C8 | N5 | 90.0° | 86.2° |
| C8 | C7 | C6 | 86.8° | 86.4° |
| C8 | C7 | H71 | 114.8° | 113.7° |
| C8 | C7 | H72 | 114.8° | 113.8° |
| C7 | C8 | H81 | 114.1° | 113.7° |
| C7 | C8 | H82 | 114.1° | 113.7° |
| C8 | N5 | C4 | 121.4° | 111.0° |
| C8 | N5 | C6 | 90.8° | 90.7° |
| N5 | C8 | H81 | 114.1° | 113.7° |
| N5 | C8 | H82 | 114.1° | 113.8° |
| C3 | C2 | C4 | 109.3° | 109.5° |
| C3 | C2 | N1 | 106.7° | 109.5° |
| C2 | C3 | H33 | 109.5° | 109.4° |
| C2 | C3 | H31 | 109.5° | 109.5° |
| C2 | C3 | H32 | 109.5° | 109.5° |
| C3 | C2 | H2 | 109.5° | 109.5° |
| C7 | C6 | N5 | 90.4° | 86.3° |
| C7 | C6 | H62 | 114.0° | 113.8° |
| C7 | C6 | H61 | 114.0° | 113.7° |
| C6 | C7 | H71 | 114.8° | 113.8° |
| C6 | C7 | H72 | 114.8° | 113.7° |
| C4 | C2 | N1 | 111.7° | 109.5° |
| C2 | C4 | N5 | 111.7° | 109.4° |
| C4 | C2 | H2 | 109.5° | 109.5° |
| C2 | C4 | H42 | 108.9° | 109.5° |
| C2 | C4 | H41 | 108.9° | 109.4° |
| C2 | N1 | C28 | 123.9° | 120.0° |
| C2 | N1 | H13 | 118.1° | 120.0° |
| N1 | C2 | H2 | 110.1° | 109.5° |
| O29 | C28 | N1 | 120.2° | 120.0° |
| O29 | C28 | C24 | 122.8° | 120.0° |
| C4 | N5 | C6 | 112.2° | 111.1° |
| N5 | C4 | H42 | 108.9° | 109.5° |
| N5 | C4 | H41 | 108.9° | 109.5° |
| N5 | C6 | H62 | 114.0° | 113.8° |
| N5 | C6 | H61 | 114.0° | 113.7° |
| N1 | C28 | C24 | 117.1° | 120.0° |
| C28 | N1 | H13 | 118.0° | 120.0° |
| C28 | C24 | N25 | 123.6° | 126.8° |
| C28 | C24 | C23 | 129.2° | 126.8° |
| N25 | C24 | C23 | 107.1° | 106.5° |
| C24 | N25 | C27 | 127.8° | 125.1° |
| C24 | N25 | N26 | 108.1° | 109.9° |
| C24 | C23 | C10 | 106.7° | 105.3° |
| C24 | C23 | H23 | 126.7° | 127.3° |
| C27 | N25 | N26 | 124.1° | 125.1° |
| N25 | C27 | H83 | 109.5° | 109.4° |
| N25 | C27 | H84 | 109.4° | 109.5° |
| N25 | C27 | H27 | 109.5° | 109.5° |
| N25 | N26 | C10 | 110.8° | 110.8° |
| C32 | O31 | C19 | 117.0° | 117.0° |
| O31 | C32 | H85 | 109.5° | 109.5° |
| O31 | C32 | H86 | 109.5° | 109.5° |
| O31 | C32 | H87 | 109.4° | 109.5° |
| C23 | C10 | N26 | 107.2° | 107.6° |
| C23 | C10 | C9 | 130.3° | 126.2° |
| C10 | C23 | H23 | 126.7° | 127.3° |
| O31 | C19 | C20 | 123.0° | 120.0° |
| O31 | C19 | C18 | 118.0° | 120.0° |
| N26 | C10 | C9 | 122.4° | 126.2° |
| C10 | C9 | N15 | 120.4° | 120.5° |
| C10 | C9 | C11 | 124.6° | 120.5° |
| C20 | C19 | C18 | 119.0° | 120.0° |
| C19 | C20 | C21 | 120.0° | 120.0° |
| C19 | C20 | H20 | 120.0° | 120.0° |
| C19 | C18 | C17 | 122.8° | 120.0° |
| C19 | C18 | H18 | 118.6° | 120.1° |
| C20 | C21 | O30 | 116.3° | 120.0° |
| C20 | C21 | C22 | 120.1° | 120.0° |
| C21 | C20 | H20 | 120.0° | 120.0° |
| C18 | C17 | C22 | 116.7° | 120.0° |
| C18 | C17 | N16 | 129.0° | 120.0° |
| C17 | C18 | H18 | 118.6° | 120.0° |
| N15 | C9 | C11 | 115.0° | 119.0° |
| C9 | N15 | C14 | 123.2° | 120.6° |
| C9 | C11 | C12 | 123.8° | 118.4° |
| C9 | C11 | H11 | 118.1° | 120.7° |
| N15 | C14 | N16 | 121.4° | 119.1° |
| N15 | C14 | N13 | 122.7° | 121.7° |
| O30 | C21 | C22 | 123.6° | 120.0° |
| C21 | O30 | C33 | 121.0° | 117.0° |
| C21 | C22 | C17 | 121.3° | 120.0° |
| C21 | C22 | H22 | 119.4° | 119.9° |
| C22 | C17 | N16 | 114.0° | 120.0° |
| C17 | C22 | H22 | 119.3° | 120.1° |
| C17 | N16 | C14 | 126.4° | 120.0° |
| C17 | N16 | H16 | 116.8° | 120.0° |
| O30 | C33 | H9A | 109.5° | 109.5° |
| O30 | C33 | H88 | 109.5° | 109.5° |
| O30 | C33 | H89 | 109.4° | 109.4° |
| C11 | C12 | N13 | 117.0° | 119.3° |
| C12 | C11 | H11 | 118.1° | 120.8° |
| C11 | C12 | H12 | 121.5° | 120.3° |
| N16 | C14 | N13 | 116.0° | 119.2° |
| C14 | N16 | H16 | 116.8° | 120.0° |
| C14 | N13 | C12 | 118.1° | 121.0° |
| N13 | C12 | H12 | 121.5° | 120.4° |
| H62 | C6 | H61 | 109.5° | 113.0° |
| H71 | C7 | H72 | 109.4° | 112.9° |
| H81 | C8 | H82 | 109.5° | 113.1° |
| H33 | C3 | H31 | 109.5° | 109.5° |
| H33 | C3 | H32 | 109.5° | 109.5° |
| H31 | C3 | H32 | 109.5° | 109.5° |
| H42 | C4 | H41 | 109.5° | 109.5° |
| H83 | C27 | H84 | 109.5° | 109.4° |
| H83 | C27 | H27 | 109.4° | 109.5° |
| H84 | C27 | H27 | 109.5° | 109.5° |
| H9A | C33 | H88 | 109.4° | 109.5° |
| H9A | C33 | H89 | 109.5° | 109.4° |
| H88 | C33 | H89 | 109.5° | 109.5° |
| H85 | C32 | H86 | 109.4° | 109.5° |
| H85 | C32 | H87 | 109.5° | 109.4° |
| H86 | C32 | H87 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C7 | C8 | N5 | H81 | 116.6° | 114.3° |
| C7 | C8 | N5 | H82 | 116.6° | 114.3° |
| C8 | C7 | C6 | H71 | 115.9° | 114.4° |
| C8 | C7 | C6 | H72 | 115.9° | 114.5° |
| C7 | C8 | N5 | C4 | 127.5° | 137.6° |
| C7 | C8 | N5 | C6 | 10.6° | 24.6° |
| C8 | C7 | C6 | H62 | 126.9° | 138.1° |
| C8 | C7 | C6 | H61 | 106.3° | 90.7° |
| C8 | C7 | H71 | H72 | 130.8° | 131.6° |
| C7 | C8 | H81 | H82 | 129.2° | 131.7° |
| C8 | N5 | C4 | C2 | 64.9° | 170.0° |
| C8 | N5 | C4 | C6 | 105.6° | 99.3° |
| C8 | N5 | C6 | H62 | 127.6° | 139.0° |
| C8 | N5 | C6 | H61 | 105.6° | 89.8° |
| N5 | C8 | C7 | H71 | 105.3° | 138.1° |
| N5 | C8 | C7 | H72 | 126.6° | 90.8° |
| N5 | C8 | H81 | H82 | 129.2° | 131.8° |
| C8 | N5 | C4 | H42 | 55.5° | 50.0° |
| C8 | N5 | C4 | H41 | 174.8° | 70.1° |
| C3 | C2 | C4 | N1 | 117.8° | 120.0° |
| C3 | C2 | C4 | H2 | 120.0° | 120.0° |
| C3 | C2 | N1 | H2 | 118.7° | 120.0° |
| C3 | C2 | C4 | N5 | 178.2° | 175.0° |
| C3 | C2 | N1 | C28 | 135.1° | 85.0° |
| C3 | C2 | N1 | H13 | 44.9° | 94.9° |
| C2 | C3 | H33 | H31 | 120.0° | 120.0° |
| C2 | C3 | H33 | H32 | 120.0° | 120.0° |
| C2 | C3 | H31 | H32 | 120.0° | 120.0° |
| C3 | C2 | C4 | H42 | 57.9° | 65.0° |
| C3 | C2 | C4 | H41 | 61.5° | 55.0° |
| C7 | C6 | N5 | C4 | 135.7° | 137.4° |
| C7 | C6 | N5 | H62 | 116.6° | 114.4° |
| C7 | C6 | N5 | H61 | 116.6° | 114.4° |
| C7 | C6 | H62 | H61 | 129.1° | 131.6° |
| C6 | C7 | H71 | H72 | 130.8° | 131.6° |
| C6 | C7 | C8 | H81 | 106.0° | 90.6° |
| C6 | C7 | C8 | H82 | 127.2° | 138.0° |
| C4 | C2 | N1 | H2 | 121.9° | 120.0° |
| C2 | C4 | N5 | H42 | 120.3° | 120.0° |
| C2 | C4 | N5 | H41 | 120.3° | 119.9° |
| C2 | C4 | N5 | C6 | 170.4° | 90.7° |
| C4 | C2 | N1 | C28 | 105.5° | 155.0° |
| C4 | C2 | N1 | H13 | 74.5° | 25.1° |
| C4 | C2 | C3 | H33 | 180.0° | 60.0° |
| C4 | C2 | C3 | H31 | 60.0° | 180.0° |
| C4 | C2 | C3 | H32 | 60.0° | 60.0° |
| C2 | C4 | H42 | H41 | 119.0° | 120.0° |
| C2 | N1 | C28 | O29 | 3.1° | 4.7° |
| N1 | C2 | C4 | N5 | 64.0° | 55.0° |
| C2 | N1 | C28 | H13 | 180.0° | 179.9° |
| C2 | N1 | C28 | C24 | 175.8° | 175.4° |
| N1 | C2 | C3 | H33 | 59.1° | 180.0° |
| N1 | C2 | C3 | H31 | 60.9° | 60.0° |
| N1 | C2 | C3 | H32 | 179.1° | 60.0° |
| N1 | C2 | C4 | H42 | 175.7° | 175.0° |
| N1 | C2 | C4 | H41 | 56.3° | 65.0° |
| O29 | C28 | N1 | C24 | 179.0° | 180.0° |
| O29 | C28 | C24 | N25 | 30.1° | 5.6° |
| O29 | C28 | C24 | C23 | 146.8° | 174.5° |
| O29 | C28 | N1 | H13 | 176.8° | 175.4° |
| C4 | N5 | C6 | H62 | 107.7° | 108.2° |
| C4 | N5 | C6 | H61 | 19.0° | 23.1° |
| C4 | N5 | C8 | H81 | 11.0° | 23.3° |
| C4 | N5 | C8 | H82 | 115.9° | 108.1° |
| N5 | C4 | C2 | H2 | 58.2° | 65.0° |
| N5 | C4 | H42 | H41 | 119.0° | 120.0° |
| N5 | C6 | H62 | H61 | 129.1° | 131.6° |
| N5 | C6 | C7 | H71 | 105.6° | 138.0° |
| N5 | C6 | C7 | H72 | 126.2° | 90.8° |
| C6 | N5 | C8 | H81 | 105.9° | 89.7° |
| C6 | N5 | C8 | H82 | 127.2° | 138.9° |
| C6 | N5 | C4 | H42 | 50.1° | 149.3° |
| C6 | N5 | C4 | H41 | 69.2° | 29.2° |
| N1 | C28 | C24 | N25 | 151.0° | 174.5° |
| N1 | C28 | C24 | C23 | 32.1° | 5.4° |
| C28 | N1 | C2 | H2 | 16.4° | 35.0° |
| C28 | C24 | N25 | C23 | 177.5° | 179.9° |
| C28 | C24 | N25 | C27 | 1.1° | 0.1° |
| C28 | C24 | N25 | N26 | 178.7° | 179.9° |
| C28 | C24 | C23 | C10 | 179.1° | 179.8° |
| C24 | C28 | N1 | H13 | 4.2° | 4.5° |
| C28 | C24 | C23 | H23 | 0.9° | 0.2° |
| C24 | N25 | C27 | N26 | 177.2° | 180.0° |
| N25 | C24 | C23 | C10 | 1.8° | 0.2° |
| C24 | N25 | N26 | C10 | 4.6° | 0.2° |
| N25 | C24 | C23 | H23 | 178.2° | 179.9° |
| C24 | N25 | C27 | H83 | 177.2° | 91.0° |
| C24 | N25 | C27 | H84 | 62.8° | 149.1° |
| C24 | N25 | C27 | H27 | 57.2° | 29.0° |
| C23 | C24 | N25 | C27 | 178.6° | 180.0° |
| C23 | C24 | N25 | N26 | 3.8° | 0.0° |
| C24 | C23 | C10 | H23 | 180.0° | 179.9° |
| C24 | C23 | C10 | N26 | 0.9° | 0.3° |
| C24 | C23 | C10 | C9 | 178.0° | 179.9° |
| C27 | N25 | N26 | C10 | 177.7° | 179.8° |
| N25 | C27 | H83 | H84 | 120.0° | 120.0° |
| N25 | C27 | H83 | H27 | 120.0° | 120.0° |
| N25 | C27 | H84 | H27 | 120.0° | 120.0° |
| N25 | N26 | C10 | C23 | 3.4° | 0.3° |
| N25 | N26 | C10 | C9 | 179.3° | 179.9° |
| N26 | N25 | C27 | H83 | 0.0° | 89.1° |
| N26 | N25 | C27 | H84 | 120.0° | 30.9° |
| N26 | N25 | C27 | H27 | 120.0° | 150.9° |
| C32 | O31 | C19 | C20 | 12.7° | 0.0° |
| C32 | O31 | C19 | C18 | 169.8° | 180.0° |
| O31 | C32 | H85 | H86 | 120.0° | 120.1° |
| O31 | C32 | H85 | H87 | 120.0° | 120.0° |
| O31 | C32 | H86 | H87 | 120.0° | 120.0° |
| C23 | C10 | N26 | C9 | 177.4° | 179.7° |
| C23 | C10 | C9 | N15 | 6.7° | 0.0° |
| C23 | C10 | C9 | C11 | 171.1° | 179.9° |
| O31 | C19 | C20 | C18 | 177.4° | 180.0° |
| O31 | C19 | C20 | C21 | 179.2° | 179.7° |
| O31 | C19 | C18 | C17 | 177.4° | 180.0° |
| O31 | C19 | C18 | H18 | 2.6° | 0.0° |
| O31 | C19 | C20 | H20 | 0.8° | 0.0° |
| C19 | O31 | C32 | H85 | 180.0° | 59.9° |
| C19 | O31 | C32 | H86 | 60.0° | 180.0° |
| C19 | O31 | C32 | H87 | 60.0° | 60.0° |
| N26 | C10 | C9 | N15 | 170.0° | 179.7° |
| N26 | C10 | C9 | C11 | 12.3° | 0.3° |
| N26 | C10 | C23 | H23 | 179.1° | 179.8° |
| C10 | C9 | N15 | C11 | 177.9° | 180.0° |
| C10 | C9 | N15 | C14 | 179.0° | 180.0° |
| C10 | C9 | C11 | C12 | 178.4° | 180.0° |
| C10 | C9 | C11 | H11 | 1.6° | 0.3° |
| C9 | C10 | C23 | H23 | 2.0° | 0.1° |
| C19 | C20 | C21 | H20 | 180.0° | 179.6° |
| C20 | C19 | C18 | C17 | 0.1° | 0.0° |
| C19 | C20 | C21 | O30 | 179.9° | 180.0° |
| C19 | C20 | C21 | C22 | 1.1° | 0.6° |
| C20 | C19 | C18 | H18 | 179.9° | 180.0° |
| C18 | C19 | C20 | C21 | 1.8° | 0.3° |
| C19 | C18 | C17 | H18 | 180.0° | 180.0° |
| C19 | C18 | C17 | C22 | 2.6° | 0.0° |
| C19 | C18 | C17 | N16 | 176.5° | 179.7° |
| C18 | C19 | C20 | H20 | 178.2° | 179.9° |
| C20 | C21 | O30 | C22 | 178.9° | 179.4° |
| C20 | C21 | C22 | C17 | 1.5° | 0.6° |
| C20 | C21 | O30 | C33 | 178.5° | 0.6° |
| C20 | C21 | C22 | H22 | 178.5° | 179.4° |
| C18 | C17 | C22 | C21 | 3.2° | 0.3° |
| C18 | C17 | C22 | N16 | 174.8° | 179.7° |
| C18 | C17 | N16 | C14 | 12.2° | 38.7° |
| C18 | C17 | N16 | H16 | 167.8° | 141.3° |
| C18 | C17 | C22 | H22 | 176.8° | 179.7° |
| N15 | C9 | C11 | C12 | 3.7° | 0.0° |
| C9 | N15 | C14 | N16 | 177.7° | 179.7° |
| C9 | N15 | C14 | N13 | 2.6° | 0.3° |
| N15 | C9 | C11 | H11 | 176.2° | 179.7° |
| C11 | C9 | N15 | C14 | 3.1° | 0.1° |
| C9 | C11 | C12 | H11 | 180.0° | 179.7° |
| C9 | C11 | C12 | N13 | 3.8° | 0.3° |
| C9 | C11 | C12 | H12 | 176.2° | 179.7° |
| N15 | C14 | N16 | C17 | 0.4° | 174.9° |
| N15 | C14 | N16 | N13 | 179.7° | 179.4° |
| N15 | C14 | N13 | C12 | 2.5° | 0.6° |
| N15 | C14 | N16 | H16 | 179.7° | 5.1° |
| O30 | C21 | C22 | C17 | 177.4° | 180.0° |
| O30 | C21 | C22 | H22 | 2.6° | 0.0° |
| C21 | O30 | C33 | H9A | 180.0° | 179.9° |
| C21 | O30 | C33 | H88 | 60.0° | 60.0° |
| C21 | O30 | C33 | H89 | 60.0° | 60.0° |
| O30 | C21 | C20 | H20 | 0.1° | 0.4° |
| C21 | C22 | C17 | H22 | 180.0° | 180.0° |
| C21 | C22 | C17 | N16 | 178.1° | 180.0° |
| C22 | C21 | O30 | C33 | 0.4° | 180.0° |
| C22 | C21 | C20 | H20 | 178.8° | 179.8° |
| C22 | C17 | N16 | C14 | 173.8° | 141.6° |
| C22 | C17 | C18 | H18 | 177.4° | 180.0° |
| C22 | C17 | N16 | H16 | 6.3° | 38.4° |
| C17 | N16 | C14 | H16 | 180.0° | 180.0° |
| C17 | N16 | C14 | N13 | 180.0° | 5.7° |
| N16 | C17 | C18 | H18 | 3.5° | 0.3° |
| N16 | C17 | C22 | H22 | 1.9° | 0.0° |
| O30 | C33 | H9A | H88 | 120.0° | 120.1° |
| O30 | C33 | H9A | H89 | 120.0° | 119.9° |
| O30 | C33 | H88 | H89 | 120.0° | 120.0° |
| C11 | C12 | N13 | C14 | 3.0° | 0.5° |
| C11 | C12 | N13 | H12 | 180.0° | 180.0° |
| N16 | C14 | N13 | C12 | 177.8° | 180.0° |
| C14 | N13 | C12 | H12 | 177.0° | 179.5° |
| N13 | C14 | N16 | H16 | 0.0° | 174.3° |
| N13 | C12 | C11 | H11 | 176.2° | 179.9° |
| H62 | C6 | C7 | H71 | 11.0° | 107.6° |
| H62 | C6 | C7 | H72 | 117.1° | 23.6° |
| H61 | C6 | C7 | H71 | 137.7° | 23.6° |
| H61 | C6 | C7 | H72 | 9.6° | 154.8° |
| H71 | C7 | C8 | H81 | 138.1° | 23.8° |
| H71 | C7 | C8 | H82 | 11.3° | 107.5° |
| H72 | C7 | C8 | H81 | 10.0° | 155.0° |
| H72 | C7 | C8 | H82 | 116.9° | 23.6° |
| H11 | C11 | C12 | H12 | 3.8° | 0.1° |
| H13 | N1 | C2 | H2 | 163.6° | 145.1° |
| H33 | C3 | H31 | H32 | 120.0° | 120.0° |
| H33 | C3 | C2 | H2 | 60.0° | 60.0° |
| H31 | C3 | C2 | H2 | 180.0° | 60.0° |
| H32 | C3 | C2 | H2 | 60.0° | 180.0° |
| H2 | C2 | C4 | H42 | 62.1° | 55.0° |
| H2 | C2 | C4 | H41 | 178.5° | 175.0° |
| H83 | C27 | H84 | H27 | 120.0° | 120.0° |
| H9A | C33 | H88 | H89 | 120.0° | 120.0° |
| H85 | C32 | H86 | H87 | 120.0° | 119.9° |
