A1H2W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C25 | sing | 1.53Å | 1.47Å | |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| O15 | C14 | doub | 1.22Å | 1.26Å | |
| C25 | C30 | sing | 1.53Å | 1.57Å | |
| C25 | N16 | sing | 1.46Å | 1.55Å | |
| C27 | C28 | sing | 1.53Å | 1.62Å | |
| C14 | N16 | sing | 1.35Å | 1.33Å | |
| C14 | C6 | sing | 1.47Å | 1.43Å | |
| C30 | N31 | sing | 1.47Å | 1.46Å | |
| C30 | C29 | sing | 1.53Å | 1.67Å | |
| C28 | C29 | sing | 1.53Å | 1.53Å | |
| C9 | N7 | sing | 1.47Å | 1.48Å | |
| C6 | N7 | sing | 1.37Å | 1.37Å | Aromatic |
| C6 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| N7 | N3 | sing | 1.28Å | 1.36Å | Aromatic |
| C24 | C21 | sing | 1.51Å | 1.41Å | |
| C5 | C4 | sing | 1.41Å | 1.38Å | Aromatic |
| N3 | C4 | doub | 1.32Å | 1.32Å | Aromatic |
| C4 | C2 | sing | 1.48Å | 1.40Å | |
| C21 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C21 | C20 | sing | 1.38Å | 1.37Å | Aromatic |
| C22 | C17 | sing | 1.39Å | 1.42Å | Aromatic |
| C20 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | N8 | doub | 1.33Å | 1.33Å | Aromatic |
| C2 | C1 | sing | 1.40Å | 1.39Å | Aromatic |
| N8 | C12 | sing | 1.32Å | 1.35Å | Aromatic |
| C1 | C10 | doub | 1.38Å | 1.37Å | Aromatic |
| C17 | C18 | doub | 1.39Å | 1.43Å | Aromatic |
| C17 | N13 | sing | 1.40Å | 1.35Å | |
| C19 | C18 | sing | 1.38Å | 1.36Å | Aromatic |
| C19 | C23 | sing | 1.51Å | 1.42Å | |
| C12 | N13 | sing | 1.39Å | 1.34Å | |
| C12 | N11 | doub | 1.32Å | 1.35Å | Aromatic |
| C10 | N11 | sing | 1.32Å | 1.37Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C9 | H92 | sing | 1.09Å | 1.10Å | |
| C9 | H93 | sing | 1.09Å | 1.10Å | |
| C9 | H91 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H94 | sing | 1.09Å | 1.10Å | |
| C23 | H95 | sing | 1.09Å | 1.10Å | |
| C24 | H96 | sing | 1.09Å | 1.10Å | |
| C24 | H97 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| N13 | H13 | sing | 0.97Å | 1.00Å | |
| N16 | H16 | sing | 0.97Å | 1.00Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H98 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H99 | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | HA1 | sing | 1.09Å | 1.10Å | |
| C29 | HB1 | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| N31 | H31 | sing | 1.01Å | 1.00Å | |
| N31 | HC1 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C26 | C27 | 107.6° | 109.5° |
| C26 | C25 | C30 | 107.2° | 109.5° |
| C26 | C25 | N16 | 113.0° | 109.5° |
| C26 | C25 | H25 | 108.3° | 109.5° |
| C25 | C26 | H98 | 109.9° | 109.5° |
| C25 | C26 | H26 | 110.0° | 109.5° |
| C26 | C27 | C28 | 117.5° | 109.5° |
| C27 | C26 | H98 | 109.9° | 109.5° |
| C27 | C26 | H26 | 109.9° | 109.4° |
| C26 | C27 | H27 | 107.4° | 109.5° |
| C26 | C27 | H99 | 107.4° | 109.5° |
| O15 | C14 | N16 | 124.5° | 120.0° |
| O15 | C14 | C6 | 119.9° | 120.0° |
| C30 | C25 | N16 | 113.5° | 109.5° |
| C25 | C30 | N31 | 112.9° | 109.5° |
| C25 | C30 | C29 | 119.8° | 109.5° |
| C30 | C25 | H25 | 107.1° | 109.4° |
| C25 | C30 | H30 | 105.0° | 109.5° |
| C25 | N16 | C14 | 128.7° | 120.0° |
| C25 | N16 | H16 | 115.6° | 120.0° |
| N16 | C25 | H25 | 107.4° | 109.5° |
| C27 | C28 | C29 | 114.3° | 109.5° |
| C28 | C27 | H27 | 107.4° | 109.5° |
| C28 | C27 | H99 | 107.4° | 109.4° |
| C27 | C28 | H28 | 108.2° | 109.4° |
| C27 | C28 | HA1 | 108.3° | 109.5° |
| N16 | C14 | C6 | 115.5° | 120.0° |
| C14 | N16 | H16 | 115.7° | 120.0° |
| C14 | C6 | N7 | 124.7° | 126.8° |
| C14 | C6 | C5 | 129.5° | 126.8° |
| N31 | C30 | C29 | 107.8° | 109.4° |
| N31 | C30 | H30 | 106.1° | 109.5° |
| C30 | N31 | H31 | 109.5° | 111.0° |
| C30 | N31 | HC1 | 109.4° | 111.0° |
| C30 | C29 | C28 | 109.8° | 109.5° |
| C30 | C29 | HB1 | 109.4° | 109.5° |
| C30 | C29 | H29 | 109.4° | 109.5° |
| C29 | C30 | H30 | 104.0° | 109.4° |
| C29 | C28 | H28 | 108.3° | 109.5° |
| C29 | C28 | HA1 | 108.3° | 109.5° |
| C28 | C29 | HB1 | 109.4° | 109.4° |
| C28 | C29 | H29 | 109.4° | 109.4° |
| C9 | N7 | C6 | 127.8° | 125.0° |
| C9 | N7 | N3 | 122.5° | 125.1° |
| N7 | C9 | H92 | 109.5° | 109.5° |
| N7 | C9 | H93 | 109.5° | 109.4° |
| N7 | C9 | H91 | 109.5° | 109.5° |
| N7 | C6 | C5 | 105.7° | 106.5° |
| C6 | N7 | N3 | 109.7° | 109.9° |
| C6 | C5 | C4 | 107.4° | 105.3° |
| C6 | C5 | H5 | 126.3° | 127.4° |
| N7 | N3 | C4 | 108.0° | 110.8° |
| C24 | C21 | C22 | 122.7° | 120.0° |
| C24 | C21 | C20 | 113.8° | 119.9° |
| C21 | C24 | H96 | 109.5° | 109.4° |
| C21 | C24 | H97 | 109.4° | 109.5° |
| C21 | C24 | H24 | 109.5° | 109.5° |
| C5 | C4 | N3 | 109.2° | 107.6° |
| C5 | C4 | C2 | 126.7° | 126.2° |
| C4 | C5 | H5 | 126.3° | 127.4° |
| N3 | C4 | C2 | 124.1° | 126.2° |
| C4 | C2 | N8 | 119.6° | 120.5° |
| C4 | C2 | C1 | 122.4° | 120.5° |
| C22 | C21 | C20 | 123.4° | 120.1° |
| C21 | C22 | C17 | 117.7° | 119.9° |
| C21 | C22 | H22 | 121.1° | 120.0° |
| C21 | C20 | C19 | 119.4° | 120.2° |
| C21 | C20 | H20 | 120.3° | 119.9° |
| C22 | C17 | C18 | 117.2° | 119.9° |
| C22 | C17 | N13 | 126.7° | 120.1° |
| C17 | C22 | H22 | 121.1° | 120.1° |
| C20 | C19 | C18 | 118.8° | 120.1° |
| C20 | C19 | C23 | 120.3° | 120.0° |
| C19 | C20 | H20 | 120.3° | 119.9° |
| N8 | C2 | C1 | 118.0° | 118.9° |
| C2 | N8 | C12 | 121.5° | 120.6° |
| C2 | C1 | C10 | 122.0° | 118.5° |
| C2 | C1 | H1 | 119.0° | 120.7° |
| N8 | C12 | N13 | 123.3° | 119.2° |
| N8 | C12 | N11 | 120.4° | 121.7° |
| C1 | C10 | N11 | 117.4° | 119.2° |
| C10 | C1 | H1 | 119.0° | 120.7° |
| C1 | C10 | H10 | 121.3° | 120.4° |
| C18 | C17 | N13 | 116.0° | 120.0° |
| C17 | C18 | C19 | 123.4° | 119.9° |
| C17 | C18 | H18 | 118.3° | 120.1° |
| C17 | N13 | C12 | 127.3° | 120.0° |
| C17 | N13 | H13 | 116.3° | 120.0° |
| C18 | C19 | C23 | 120.9° | 120.0° |
| C19 | C18 | H18 | 118.3° | 120.0° |
| C19 | C23 | H23 | 109.5° | 109.5° |
| C19 | C23 | H94 | 109.5° | 109.5° |
| C19 | C23 | H95 | 109.5° | 109.5° |
| N13 | C12 | N11 | 115.9° | 119.1° |
| C12 | N13 | H13 | 116.4° | 120.0° |
| C12 | N11 | C10 | 120.4° | 121.0° |
| N11 | C10 | H10 | 121.3° | 120.4° |
| H92 | C9 | H93 | 109.5° | 109.5° |
| H92 | C9 | H91 | 109.4° | 109.5° |
| H93 | C9 | H91 | 109.5° | 109.5° |
| H23 | C23 | H94 | 109.5° | 109.4° |
| H23 | C23 | H95 | 109.4° | 109.5° |
| H94 | C23 | H95 | 109.5° | 109.4° |
| H96 | C24 | H97 | 109.5° | 109.5° |
| H96 | C24 | H24 | 109.4° | 109.5° |
| H97 | C24 | H24 | 109.5° | 109.5° |
| H98 | C26 | H26 | 109.5° | 109.4° |
| H27 | C27 | H99 | 109.5° | 109.5° |
| H28 | C28 | HA1 | 109.4° | 109.5° |
| HB1 | C29 | H29 | 109.5° | 109.5° |
| H31 | N31 | HC1 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C26 | C27 | H98 | 119.7° | 120.1° |
| C25 | C26 | C27 | H26 | 119.7° | 120.1° |
| C26 | C25 | C30 | N16 | 125.6° | 120.0° |
| C26 | C25 | C30 | H25 | 116.1° | 120.0° |
| C26 | C25 | N16 | H25 | 119.4° | 120.0° |
| C25 | C26 | C27 | C28 | 62.3° | 60.0° |
| C26 | C25 | N16 | C14 | 102.1° | 85.0° |
| C26 | C25 | C30 | N31 | 175.9° | 180.0° |
| C26 | C25 | C30 | C29 | 55.4° | 60.0° |
| C26 | C25 | N16 | H16 | 77.9° | 95.0° |
| C25 | C26 | H98 | H26 | 120.9° | 120.0° |
| C25 | C26 | C27 | H27 | 176.5° | 180.0° |
| C25 | C26 | C27 | H99 | 58.9° | 59.9° |
| C26 | C25 | C30 | H30 | 60.8° | 60.0° |
| C27 | C26 | C25 | C30 | 63.3° | 60.0° |
| C27 | C26 | C25 | N16 | 62.5° | 60.0° |
| C26 | C27 | C28 | H27 | 121.1° | 120.1° |
| C26 | C27 | C28 | H99 | 121.2° | 120.0° |
| C26 | C27 | C28 | C29 | 43.7° | 59.9° |
| C27 | C26 | C25 | H25 | 178.7° | 180.0° |
| C27 | C26 | H98 | H26 | 120.8° | 119.9° |
| C26 | C27 | H27 | H99 | 116.3° | 120.1° |
| C26 | C27 | C28 | H28 | 77.0° | 60.0° |
| C26 | C27 | C28 | HA1 | 164.4° | 180.0° |
| O15 | C14 | N16 | C25 | 5.5° | 4.9° |
| O15 | C14 | N16 | C6 | 177.7° | 179.9° |
| O15 | C14 | C6 | N7 | 35.9° | 6.0° |
| O15 | C14 | C6 | C5 | 140.9° | 174.4° |
| O15 | C14 | N16 | H16 | 174.5° | 175.2° |
| C30 | C25 | N16 | H25 | 118.2° | 119.9° |
| C30 | C25 | N16 | C14 | 135.5° | 155.0° |
| C25 | C30 | N31 | C29 | 134.7° | 120.0° |
| C25 | C30 | N31 | H30 | 114.4° | 120.1° |
| C25 | C30 | C29 | H30 | 116.7° | 120.0° |
| C25 | C30 | C29 | C28 | 36.4° | 60.0° |
| C30 | C25 | N16 | H16 | 44.5° | 25.0° |
| C30 | C25 | C26 | H98 | 56.4° | 60.0° |
| C30 | C25 | C26 | H26 | 176.9° | 180.0° |
| C25 | C30 | C29 | HB1 | 83.7° | 180.0° |
| C25 | C30 | C29 | H29 | 156.4° | 60.0° |
| C25 | C30 | N31 | H31 | 180.0° | 180.0° |
| C25 | C30 | N31 | HC1 | 60.0° | 56.0° |
| C25 | N16 | C14 | H16 | 180.0° | 179.9° |
| C25 | N16 | C14 | C6 | 176.7° | 175.3° |
| N16 | C25 | C30 | N31 | 58.5° | 60.0° |
| N16 | C25 | C30 | C29 | 70.2° | 60.0° |
| N16 | C25 | C26 | H98 | 177.8° | 179.9° |
| N16 | C25 | C26 | H26 | 57.2° | 60.0° |
| N16 | C25 | C30 | H30 | 173.6° | 180.0° |
| C27 | C28 | C29 | C30 | 27.6° | 60.0° |
| C27 | C28 | C29 | H28 | 120.7° | 119.9° |
| C27 | C28 | C29 | HA1 | 120.7° | 120.0° |
| C28 | C27 | C26 | H98 | 57.4° | 60.1° |
| C28 | C27 | C26 | H26 | 177.9° | 180.0° |
| C28 | C27 | H27 | H99 | 116.4° | 119.9° |
| C27 | C28 | H28 | HA1 | 117.8° | 120.0° |
| C27 | C28 | C29 | HB1 | 92.5° | 180.0° |
| C27 | C28 | C29 | H29 | 147.6° | 60.1° |
| N16 | C14 | C6 | N7 | 146.2° | 174.1° |
| N16 | C14 | C6 | C5 | 37.0° | 5.5° |
| C14 | N16 | C25 | H25 | 17.3° | 35.1° |
| C14 | C6 | N7 | C9 | 1.1° | 0.3° |
| C14 | C6 | N7 | C5 | 177.5° | 179.7° |
| C14 | C6 | N7 | N3 | 179.0° | 180.0° |
| C14 | C6 | C5 | C4 | 177.7° | 179.7° |
| C14 | C6 | C5 | H5 | 2.3° | 0.3° |
| C6 | C14 | N16 | H16 | 3.2° | 4.7° |
| N31 | C30 | C29 | H30 | 112.3° | 120.0° |
| N31 | C30 | C29 | C28 | 167.3° | 180.0° |
| N31 | C30 | C25 | H25 | 59.9° | 60.0° |
| N31 | C30 | C29 | HB1 | 47.3° | 60.0° |
| N31 | C30 | C29 | H29 | 72.6° | 60.1° |
| C30 | N31 | H31 | HC1 | 120.0° | 124.0° |
| C30 | C29 | C28 | HB1 | 120.1° | 120.0° |
| C30 | C29 | C28 | H29 | 120.0° | 120.0° |
| C29 | C30 | C25 | H25 | 171.5° | 180.0° |
| C30 | C29 | C28 | H28 | 93.1° | 60.0° |
| C30 | C29 | C28 | HA1 | 148.3° | 180.0° |
| C30 | C29 | HB1 | H29 | 119.8° | 120.1° |
| C29 | C30 | N31 | H31 | 45.4° | 60.0° |
| C29 | C30 | N31 | HC1 | 74.7° | 64.0° |
| C29 | C28 | C27 | H27 | 164.9° | 180.0° |
| C29 | C28 | C27 | H99 | 77.4° | 60.0° |
| C29 | C28 | H28 | HA1 | 117.8° | 120.1° |
| C28 | C29 | HB1 | H29 | 119.8° | 119.9° |
| C28 | C29 | C30 | H30 | 80.3° | 60.0° |
| C9 | N7 | C6 | N3 | 179.9° | 179.7° |
| C9 | N7 | C6 | C5 | 178.5° | 180.0° |
| C9 | N7 | N3 | C4 | 177.9° | 179.8° |
| N7 | C9 | H92 | H93 | 120.0° | 119.9° |
| N7 | C9 | H92 | H91 | 120.0° | 120.0° |
| N7 | C9 | H93 | H91 | 120.0° | 120.0° |
| N7 | C6 | C5 | C4 | 0.4° | 0.0° |
| C6 | N7 | N3 | C4 | 2.2° | 0.4° |
| N7 | C6 | C5 | H5 | 179.6° | 180.0° |
| C6 | N7 | C9 | H92 | 179.8° | 90.9° |
| C6 | N7 | C9 | H93 | 60.1° | 149.1° |
| C6 | N7 | C9 | H91 | 59.9° | 29.2° |
| C5 | C6 | N7 | N3 | 1.6° | 0.2° |
| C6 | C5 | C4 | H5 | 180.0° | 179.9° |
| C6 | C5 | C4 | N3 | 0.9° | 0.3° |
| C6 | C5 | C4 | C2 | 179.3° | 180.0° |
| N7 | N3 | C4 | C5 | 1.9° | 0.5° |
| N7 | N3 | C4 | C2 | 178.3° | 179.9° |
| N3 | N7 | C9 | H92 | 0.0° | 88.8° |
| N3 | N7 | C9 | H93 | 120.0° | 31.2° |
| N3 | N7 | C9 | H91 | 120.0° | 151.1° |
| C24 | C21 | C22 | C20 | 178.8° | 179.4° |
| C24 | C21 | C22 | C17 | 178.3° | 180.0° |
| C24 | C21 | C20 | C19 | 178.9° | 179.7° |
| C24 | C21 | C20 | H20 | 1.2° | 0.3° |
| C24 | C21 | C22 | H22 | 1.7° | 0.6° |
| C21 | C24 | H96 | H97 | 120.0° | 120.0° |
| C21 | C24 | H96 | H24 | 120.0° | 120.0° |
| C21 | C24 | H97 | H24 | 120.0° | 120.0° |
| C5 | C4 | N3 | C2 | 179.7° | 179.7° |
| C5 | C4 | C2 | N8 | 1.9° | 0.0° |
| C5 | C4 | C2 | C1 | 179.8° | 180.0° |
| N3 | C4 | C2 | N8 | 178.4° | 179.6° |
| N3 | C4 | C2 | C1 | 0.1° | 0.4° |
| N3 | C4 | C5 | H5 | 179.1° | 179.8° |
| C4 | C2 | N8 | C1 | 178.4° | 179.9° |
| C4 | C2 | N8 | C12 | 176.1° | 179.9° |
| C4 | C2 | C1 | C10 | 178.5° | 180.0° |
| C4 | C2 | C1 | H1 | 1.6° | 0.2° |
| C2 | C4 | C5 | H5 | 0.7° | 0.1° |
| C21 | C22 | C17 | H22 | 180.0° | 179.4° |
| C22 | C21 | C20 | C19 | 0.0° | 0.3° |
| C21 | C22 | C17 | C18 | 1.6° | 0.6° |
| C21 | C22 | C17 | N13 | 177.8° | 179.7° |
| C22 | C21 | C20 | H20 | 180.0° | 179.7° |
| C22 | C21 | C24 | H96 | 89.3° | 90.0° |
| C22 | C21 | C24 | H97 | 150.7° | 150.0° |
| C22 | C21 | C24 | H24 | 30.7° | 30.0° |
| C20 | C21 | C22 | C17 | 0.5° | 0.6° |
| C21 | C20 | C19 | H20 | 180.0° | 180.0° |
| C21 | C20 | C19 | C18 | 0.7° | 0.0° |
| C21 | C20 | C19 | C23 | 179.6° | 180.0° |
| C20 | C21 | C22 | H22 | 179.5° | 180.0° |
| C20 | C21 | C24 | H96 | 89.6° | 90.6° |
| C20 | C21 | C24 | H97 | 30.5° | 29.4° |
| C20 | C21 | C24 | H24 | 150.4° | 149.4° |
| C22 | C17 | C18 | N13 | 176.6° | 179.7° |
| C22 | C17 | C18 | C19 | 2.4° | 0.3° |
| C22 | C17 | N13 | C12 | 0.6° | 38.5° |
| C22 | C17 | C18 | H18 | 177.6° | 179.8° |
| C22 | C17 | N13 | H13 | 179.4° | 141.5° |
| C20 | C19 | C18 | C17 | 1.9° | 0.0° |
| C20 | C19 | C18 | C23 | 179.0° | 180.0° |
| C20 | C19 | C18 | H18 | 178.1° | 179.9° |
| C20 | C19 | C23 | H23 | 90.5° | 90.0° |
| C20 | C19 | C23 | H94 | 149.4° | 30.0° |
| C20 | C19 | C23 | H95 | 29.5° | 149.9° |
| N8 | C2 | C1 | C10 | 0.1° | 0.0° |
| C2 | N8 | C12 | N13 | 178.2° | 179.7° |
| C2 | N8 | C12 | N11 | 5.9° | 0.3° |
| N8 | C2 | C1 | H1 | 179.9° | 179.8° |
| C1 | C2 | N8 | C12 | 2.3° | 0.0° |
| C2 | C1 | C10 | H1 | 180.0° | 179.8° |
| C2 | C1 | C10 | N11 | 1.0° | 0.3° |
| C2 | C1 | C10 | H10 | 179.0° | 179.7° |
| N8 | C12 | N13 | C17 | 6.4° | 174.9° |
| N8 | C12 | N13 | N11 | 172.6° | 179.4° |
| N8 | C12 | N11 | C10 | 7.0° | 0.6° |
| N8 | C12 | N13 | H13 | 173.6° | 5.1° |
| C1 | C10 | N11 | C12 | 4.6° | 0.6° |
| C1 | C10 | N11 | H10 | 180.0° | 180.0° |
| C17 | C18 | C19 | H18 | 180.0° | 179.9° |
| C17 | C18 | C19 | C23 | 179.1° | 180.0° |
| C18 | C17 | N13 | C12 | 176.8° | 141.8° |
| C18 | C17 | C22 | H22 | 178.4° | 180.0° |
| C18 | C17 | N13 | H13 | 3.2° | 38.2° |
| N13 | C17 | C18 | C19 | 179.0° | 180.0° |
| C17 | N13 | C12 | H13 | 180.0° | 180.0° |
| C17 | N13 | C12 | N11 | 179.0° | 5.7° |
| N13 | C17 | C18 | H18 | 1.0° | 0.1° |
| N13 | C17 | C22 | H22 | 2.3° | 0.3° |
| C18 | C19 | C20 | H20 | 179.3° | 180.0° |
| C18 | C19 | C23 | H23 | 90.6° | 90.0° |
| C18 | C19 | C23 | H94 | 29.5° | 150.0° |
| C18 | C19 | C23 | H95 | 149.5° | 30.1° |
| C23 | C19 | C18 | H18 | 0.9° | 0.1° |
| C23 | C19 | C20 | H20 | 0.3° | 0.0° |
| C19 | C23 | H23 | H94 | 120.0° | 120.0° |
| C19 | C23 | H23 | H95 | 120.0° | 120.1° |
| C19 | C23 | H94 | H95 | 120.0° | 120.0° |
| N13 | C12 | N11 | C10 | 179.9° | 180.0° |
| C12 | N11 | C10 | H10 | 175.4° | 179.4° |
| N11 | C12 | N13 | H13 | 1.0° | 174.3° |
| N11 | C10 | C1 | H1 | 178.9° | 180.0° |
| H1 | C1 | C10 | H10 | 1.1° | 0.1° |
| H92 | C9 | H93 | H91 | 120.0° | 120.1° |
| H23 | C23 | H94 | H95 | 120.0° | 120.0° |
| H96 | C24 | H97 | H24 | 120.0° | 120.0° |
| H16 | N16 | C25 | H25 | 162.7° | 145.0° |
| H25 | C25 | C26 | H98 | 58.9° | 59.9° |
| H25 | C25 | C26 | H26 | 61.6° | 60.0° |
| H25 | C25 | C30 | H30 | 55.3° | 60.0° |
| H98 | C26 | C27 | H27 | 63.8° | 59.9° |
| H98 | C26 | C27 | H99 | 178.6° | 180.0° |
| H26 | C26 | C27 | H27 | 56.8° | 59.9° |
| H26 | C26 | C27 | H99 | 60.9° | 60.1° |
| H27 | C27 | C28 | H28 | 44.1° | 60.0° |
| H27 | C27 | C28 | HA1 | 74.4° | 59.9° |
| H99 | C27 | C28 | H28 | 161.8° | 180.0° |
| H99 | C27 | C28 | HA1 | 43.3° | 60.0° |
| H28 | C28 | C29 | HB1 | 146.8° | 60.0° |
| H28 | C28 | C29 | H29 | 26.9° | 180.0° |
| HA1 | C28 | C29 | HB1 | 28.2° | 60.0° |
| HA1 | C28 | C29 | H29 | 91.6° | 60.0° |
| HB1 | C29 | C30 | H30 | 159.6° | 60.0° |
| H29 | C29 | C30 | H30 | 39.7° | 180.0° |
| H30 | C30 | N31 | H31 | 65.5° | 59.9° |
| H30 | C30 | N31 | HC1 | 174.4° | 176.1° |
