Obsolete: WZ2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C51 | O01 | sing | 1.43Å | 1.46Å | |
| C51 | C41 | sing | 1.53Å | 1.54Å | |
| C51 | C61 | sing | 1.53Å | 1.55Å | |
| O01 | C11 | sing | 1.43Å | 1.42Å | |
| C11 | O11 | sing | 1.43Å | 1.43Å | |
| C11 | C21 | sing | 1.53Å | 1.52Å | |
| O11 | C62 | sing | 1.43Å | 1.44Å | |
| C21 | O21 | sing | 1.43Å | 1.50Å | |
| C21 | C31 | sing | 1.53Å | 1.54Å | |
| C31 | O31 | sing | 1.43Å | 1.46Å | |
| C31 | C41 | sing | 1.53Å | 1.52Å | |
| C41 | O41 | sing | 1.43Å | 1.45Å | |
| C61 | O61 | sing | 1.43Å | 1.44Å | |
| C52 | O02 | sing | 1.43Å | 1.43Å | |
| C52 | C42 | sing | 1.53Å | 1.53Å | |
| C52 | C62 | sing | 1.53Å | 1.51Å | |
| O02 | C12 | sing | 1.43Å | 1.44Å | |
| C12 | O12 | sing | 1.43Å | 1.44Å | |
| C12 | C01 | sing | 1.53Å | 1.51Å | |
| O12 | C22 | sing | 1.43Å | 1.47Å | |
| C01 | O22 | sing | 1.43Å | 1.45Å | |
| C01 | C32 | sing | 1.53Å | 1.53Å | |
| C32 | C42 | sing | 1.53Å | 1.52Å | |
| C32 | S13 | sing | 1.81Å | 1.85Å | |
| C42 | O42 | sing | 1.43Å | 1.44Å | |
| C53 | O03 | sing | 1.43Å | 1.45Å | |
| C53 | C43 | sing | 1.53Å | 1.55Å | |
| C53 | C63 | sing | 1.53Å | 1.51Å | |
| O03 | C13 | sing | 1.43Å | 1.45Å | |
| C13 | S13 | sing | 1.81Å | 1.79Å | |
| C13 | C23 | sing | 1.53Å | 1.51Å | |
| C23 | O23 | sing | 1.43Å | 1.43Å | |
| C23 | C33 | sing | 1.53Å | 1.52Å | |
| C33 | O33 | sing | 1.43Å | 1.43Å | |
| C33 | C43 | sing | 1.53Å | 1.53Å | |
| C43 | O43 | sing | 1.43Å | 1.41Å | |
| C63 | O63 | sing | 1.43Å | 1.32Å | |
| C51 | H51 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| O21 | HO21 | sing | 0.97Å | 0.95Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| O31 | HO31 | sing | 0.97Å | 0.95Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| O41 | HO41 | sing | 0.97Å | 0.95Å | |
| C61 | H61 | sing | 1.09Å | 1.10Å | |
| C61 | H61A | sing | 1.09Å | 1.10Å | |
| O61 | HO61 | sing | 0.97Å | 0.95Å | |
| C52 | H52 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C22 | H22B | sing | 1.09Å | 1.10Å | |
| C01 | H01 | sing | 1.09Å | 1.10Å | |
| O22 | HO22 | sing | 0.97Å | 0.95Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C42 | H42 | sing | 1.09Å | 1.10Å | |
| O42 | HO42 | sing | 0.97Å | 0.95Å | |
| C62 | H62 | sing | 1.09Å | 1.10Å | |
| C62 | H62A | sing | 1.09Å | 1.10Å | |
| C53 | H53 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| O23 | HO23 | sing | 0.97Å | 0.95Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| O33 | HO33 | sing | 0.97Å | 0.95Å | |
| C43 | H43 | sing | 1.09Å | 1.10Å | |
| O43 | HO43 | sing | 0.97Å | 0.95Å | |
| C63 | H63 | sing | 1.09Å | 1.10Å | |
| C63 | H63A | sing | 1.09Å | 1.10Å | |
| O63 | HO63 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C51 | C41 | 105.7° | 109.4° |
| O01 | C51 | C61 | 105.9° | 109.5° |
| C51 | O01 | C11 | 110.7° | 114.1° |
| O01 | C51 | H51 | 114.9° | 109.5° |
| C41 | C51 | C61 | 111.8° | 109.5° |
| C51 | C41 | C31 | 108.5° | 109.2° |
| C51 | C41 | O41 | 106.2° | 109.5° |
| C41 | C51 | H51 | 109.3° | 109.5° |
| C51 | C41 | H41 | 112.1° | 109.5° |
| C51 | C61 | O61 | 108.1° | 109.5° |
| C61 | C51 | H51 | 109.2° | 109.5° |
| C51 | C61 | H61 | 109.9° | 109.5° |
| C51 | C61 | H61A | 110.3° | 109.5° |
| O01 | C11 | O11 | 111.1° | 109.5° |
| O01 | C11 | C21 | 111.6° | 109.4° |
| O01 | C11 | H11 | 107.2° | 109.4° |
| O11 | C11 | C21 | 110.5° | 109.5° |
| C11 | O11 | C62 | 109.6° | 114.0° |
| O11 | C11 | H11 | 108.4° | 109.5° |
| C11 | C21 | O21 | 105.7° | 109.6° |
| C11 | C21 | C31 | 114.6° | 109.2° |
| C21 | C11 | H11 | 107.8° | 109.5° |
| C11 | C21 | H21 | 107.8° | 109.5° |
| O11 | C62 | C52 | 107.5° | 109.5° |
| O11 | C62 | H62 | 110.1° | 109.5° |
| O11 | C62 | H62A | 110.6° | 109.5° |
| O21 | C21 | C31 | 106.8° | 109.5° |
| O21 | C21 | H21 | 115.5° | 109.5° |
| C21 | O21 | HO21 | 109.5° | 114.0° |
| C21 | C31 | O31 | 106.5° | 109.6° |
| C21 | C31 | C41 | 112.6° | 109.0° |
| C31 | C21 | H21 | 106.8° | 109.5° |
| C21 | C31 | H31 | 109.1° | 109.5° |
| O31 | C31 | C41 | 108.5° | 109.5° |
| O31 | C31 | H31 | 113.2° | 109.6° |
| C31 | O31 | HO31 | 109.5° | 114.0° |
| C31 | C41 | O41 | 109.1° | 109.5° |
| C41 | C31 | H31 | 107.1° | 109.6° |
| C31 | C41 | H41 | 109.4° | 109.5° |
| O41 | C41 | H41 | 111.5° | 109.6° |
| C41 | O41 | HO41 | 109.5° | 114.0° |
| O61 | C61 | H61 | 109.9° | 109.4° |
| O61 | C61 | H61A | 110.3° | 109.5° |
| C61 | O61 | HO61 | 109.5° | 114.0° |
| O02 | C52 | C42 | 109.5° | 109.4° |
| O02 | C52 | C62 | 103.7° | 109.5° |
| C52 | O02 | C12 | 116.8° | 114.1° |
| O02 | C52 | H52 | 113.7° | 109.4° |
| C42 | C52 | C62 | 111.0° | 109.5° |
| C52 | C42 | C32 | 115.1° | 109.2° |
| C52 | C42 | O42 | 109.8° | 109.5° |
| C42 | C52 | H52 | 106.7° | 109.5° |
| C52 | C42 | H42 | 104.3° | 109.5° |
| C62 | C52 | H52 | 112.3° | 109.5° |
| C52 | C62 | H62 | 110.1° | 109.4° |
| C52 | C62 | H62A | 110.6° | 109.4° |
| O02 | C12 | O12 | 110.6° | 109.5° |
| O02 | C12 | C01 | 108.2° | 109.4° |
| O02 | C12 | H12 | 110.0° | 109.5° |
| O12 | C12 | C01 | 110.8° | 109.5° |
| C12 | O12 | C22 | 105.3° | 114.0° |
| O12 | C12 | H12 | 107.4° | 109.5° |
| C12 | C01 | O22 | 108.3° | 109.6° |
| C12 | C01 | C32 | 107.8° | 109.1° |
| C01 | C12 | H12 | 109.8° | 109.5° |
| C12 | C01 | H01 | 111.5° | 109.5° |
| O12 | C22 | H22 | 109.5° | 109.5° |
| O12 | C22 | H22A | 109.5° | 109.5° |
| O12 | C22 | H22B | 109.4° | 109.4° |
| O22 | C01 | C32 | 110.2° | 109.5° |
| O22 | C01 | H01 | 109.2° | 109.6° |
| C01 | O22 | HO22 | 109.5° | 114.0° |
| C01 | C32 | C42 | 112.9° | 109.1° |
| C01 | C32 | S13 | 111.7° | 109.5° |
| C32 | C01 | H01 | 109.7° | 109.5° |
| C01 | C32 | H32 | 104.7° | 109.5° |
| C42 | C32 | S13 | 107.0° | 109.5° |
| C32 | C42 | O42 | 106.2° | 109.5° |
| C42 | C32 | H32 | 109.6° | 109.5° |
| C32 | C42 | H42 | 108.0° | 109.5° |
| C32 | S13 | C13 | 101.4° | 103.0° |
| S13 | C32 | H32 | 110.9° | 109.6° |
| O42 | C42 | H42 | 113.6° | 109.6° |
| C42 | O42 | HO42 | 109.5° | 114.0° |
| O03 | C53 | C43 | 109.4° | 109.4° |
| O03 | C53 | C63 | 110.5° | 109.5° |
| C53 | O03 | C13 | 114.2° | 114.1° |
| O03 | C53 | H53 | 109.8° | 109.4° |
| C43 | C53 | C63 | 112.1° | 109.5° |
| C53 | C43 | C33 | 111.6° | 109.2° |
| C53 | C43 | O43 | 106.6° | 109.6° |
| C43 | C53 | H53 | 108.1° | 109.5° |
| C53 | C43 | H43 | 111.2° | 109.5° |
| C53 | C63 | O63 | 117.0° | 109.5° |
| C63 | C53 | H53 | 106.9° | 109.5° |
| C53 | C63 | H63 | 107.0° | 109.5° |
| C53 | C63 | H63A | 105.3° | 109.5° |
| O03 | C13 | S13 | 112.3° | 109.5° |
| O03 | C13 | C23 | 109.3° | 109.5° |
| O03 | C13 | H13 | 107.2° | 109.5° |
| S13 | C13 | C23 | 108.1° | 109.4° |
| S13 | C13 | H13 | 108.4° | 109.5° |
| C13 | C23 | O23 | 111.9° | 109.6° |
| C13 | C23 | C33 | 110.7° | 109.1° |
| C23 | C13 | H13 | 111.5° | 109.5° |
| C13 | C23 | H23 | 107.7° | 109.5° |
| O23 | C23 | C33 | 111.8° | 109.5° |
| O23 | C23 | H23 | 106.6° | 109.6° |
| C23 | O23 | HO23 | 109.5° | 114.0° |
| C23 | C33 | O33 | 113.1° | 109.5° |
| C23 | C33 | C43 | 107.1° | 109.0° |
| C33 | C23 | H23 | 107.9° | 109.6° |
| C23 | C33 | H33 | 109.4° | 109.5° |
| O33 | C33 | C43 | 111.7° | 109.6° |
| O33 | C33 | H33 | 104.6° | 109.5° |
| C33 | O33 | HO33 | 109.5° | 114.0° |
| C33 | C43 | O43 | 112.8° | 109.5° |
| C43 | C33 | H33 | 110.9° | 109.6° |
| C33 | C43 | H43 | 104.8° | 109.5° |
| O43 | C43 | H43 | 110.0° | 109.6° |
| C43 | O43 | HO43 | 109.5° | 114.0° |
| O63 | C63 | H63 | 107.1° | 109.5° |
| O63 | C63 | H63A | 105.3° | 109.4° |
| C63 | O63 | HO63 | 109.5° | 114.0° |
| H61 | C61 | H61A | 108.4° | 109.5° |
| H22 | C22 | H22A | 109.5° | 109.5° |
| H22 | C22 | H22B | 109.5° | 109.5° |
| H22A | C22 | H22B | 109.5° | 109.5° |
| H62 | C62 | H62A | 107.9° | 109.5° |
| H63 | C63 | H63A | 115.6° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C51 | C41 | C61 | 114.8° | 120.0° |
| O01 | C51 | C41 | H51 | 124.2° | 120.0° |
| O01 | C51 | C61 | H51 | 124.2° | 120.0° |
| C51 | O01 | C11 | O11 | 62.8° | 58.8° |
| C51 | O01 | C11 | C21 | 61.1° | 61.2° |
| O01 | C51 | C41 | C31 | 64.6° | 57.6° |
| O01 | C51 | C41 | O41 | 178.2° | 177.5° |
| O01 | C51 | C61 | O61 | 67.6° | 65.0° |
| C51 | O01 | C11 | H11 | 178.9° | 178.9° |
| O01 | C51 | C41 | H41 | 56.3° | 62.3° |
| O01 | C51 | C61 | H61 | 172.4° | 175.0° |
| O01 | C51 | C61 | H61A | 52.9° | 55.0° |
| C41 | C51 | C61 | H51 | 121.1° | 120.0° |
| C41 | C51 | O01 | C11 | 72.4° | 61.2° |
| C51 | C41 | C31 | C21 | 49.2° | 57.0° |
| C51 | C41 | C31 | O31 | 166.8° | 176.9° |
| C51 | C41 | C31 | O41 | 115.3° | 119.9° |
| C51 | C41 | C31 | H41 | 122.5° | 119.9° |
| C51 | C41 | O41 | H41 | 122.4° | 120.1° |
| C41 | C51 | C61 | O61 | 177.7° | 175.0° |
| C51 | C41 | C31 | H31 | 70.7° | 62.9° |
| C51 | C41 | O41 | HO41 | 66.1° | 180.0° |
| C41 | C51 | C61 | H61 | 57.7° | 55.1° |
| C41 | C51 | C61 | H61A | 61.7° | 64.9° |
| C61 | C51 | O01 | C11 | 168.9° | 178.9° |
| C61 | C51 | C41 | C31 | 179.3° | 177.6° |
| C61 | C51 | C41 | O41 | 63.5° | 62.5° |
| C51 | C61 | O61 | H61 | 120.0° | 120.0° |
| C51 | C61 | O61 | H61A | 120.6° | 120.0° |
| C61 | C51 | C41 | H41 | 58.5° | 57.7° |
| C51 | C61 | H61 | H61A | 120.6° | 120.0° |
| C51 | C61 | O61 | HO61 | 7.5° | 180.0° |
| O01 | C11 | O11 | C21 | 124.5° | 119.9° |
| O01 | C11 | O11 | H11 | 117.6° | 120.0° |
| O01 | C11 | C21 | H11 | 117.5° | 119.9° |
| O01 | C11 | O11 | C62 | 52.8° | 70.0° |
| O01 | C11 | C21 | O21 | 74.0° | 62.3° |
| O01 | C11 | C21 | C31 | 43.2° | 57.7° |
| C11 | O01 | C51 | H51 | 48.3° | 58.8° |
| O01 | C11 | C21 | H21 | 161.9° | 177.6° |
| O11 | C11 | C21 | H11 | 118.3° | 120.1° |
| O11 | C11 | C21 | O21 | 161.8° | 177.7° |
| O11 | C11 | C21 | C31 | 81.0° | 62.3° |
| C11 | O11 | C62 | C52 | 161.0° | 180.0° |
| O11 | C11 | C21 | H21 | 37.8° | 57.6° |
| C11 | O11 | C62 | H62 | 79.0° | 60.0° |
| C11 | O11 | C62 | H62A | 40.2° | 60.0° |
| C21 | C11 | O11 | C62 | 177.3° | 170.1° |
| C11 | C21 | O21 | C31 | 122.4° | 119.7° |
| C11 | C21 | O21 | H21 | 119.1° | 120.1° |
| C11 | C21 | C31 | H21 | 119.3° | 119.9° |
| C11 | C21 | C31 | O31 | 157.4° | 176.9° |
| C11 | C21 | C31 | C41 | 38.7° | 57.0° |
| C11 | C21 | O21 | HO21 | 104.7° | 60.0° |
| C11 | C21 | C31 | H31 | 80.1° | 62.9° |
| O11 | C62 | C52 | O02 | 177.6° | 65.0° |
| O11 | C62 | C52 | C42 | 60.1° | 175.1° |
| O11 | C62 | C52 | H62 | 120.0° | 120.0° |
| O11 | C62 | C52 | H62A | 120.8° | 120.1° |
| C62 | O11 | C11 | H11 | 64.7° | 50.0° |
| O11 | C62 | C52 | H52 | 59.3° | 55.0° |
| O11 | C62 | H62 | H62A | 120.8° | 120.1° |
| O21 | C21 | C31 | H21 | 124.1° | 120.2° |
| O21 | C21 | C31 | O31 | 40.8° | 56.9° |
| O21 | C21 | C31 | C41 | 77.9° | 62.9° |
| O21 | C21 | C11 | H11 | 43.5° | 57.7° |
| O21 | C21 | C31 | H31 | 163.3° | 177.1° |
| C21 | C31 | O31 | C41 | 121.4° | 119.5° |
| C21 | C31 | O31 | H31 | 119.8° | 120.2° |
| C21 | C31 | C41 | H31 | 119.9° | 119.9° |
| C21 | C31 | C41 | O41 | 164.5° | 176.9° |
| C31 | C21 | C11 | H11 | 160.7° | 177.6° |
| C31 | C21 | O21 | HO21 | 17.7° | 179.7° |
| C21 | C31 | O31 | HO31 | 132.7° | 60.0° |
| C21 | C31 | C41 | H41 | 73.3° | 62.9° |
| O31 | C31 | C41 | H31 | 122.5° | 120.3° |
| O31 | C31 | C41 | O41 | 77.9° | 63.3° |
| O31 | C31 | C21 | H21 | 83.3° | 63.2° |
| O31 | C31 | C41 | H41 | 44.2° | 56.9° |
| C31 | C41 | O41 | H41 | 120.9° | 120.2° |
| C31 | C41 | C51 | H51 | 59.6° | 62.4° |
| C41 | C31 | C21 | H21 | 158.0° | 176.9° |
| C41 | C31 | O31 | HO31 | 11.2° | 179.5° |
| C31 | C41 | O41 | HO41 | 50.6° | 60.3° |
| O41 | C41 | C51 | H51 | 57.5° | 57.5° |
| O41 | C41 | C31 | H31 | 44.6° | 57.0° |
| O61 | C61 | C51 | H51 | 56.6° | 55.0° |
| O61 | C61 | H61 | H61A | 120.6° | 120.0° |
| O02 | C52 | C42 | C62 | 113.8° | 120.0° |
| O02 | C52 | C42 | H52 | 123.5° | 119.9° |
| O02 | C52 | C62 | H52 | 123.2° | 120.0° |
| C52 | O02 | C12 | O12 | 55.6° | 58.8° |
| C52 | O02 | C12 | C01 | 66.0° | 61.2° |
| O02 | C52 | C42 | C32 | 41.0° | 57.6° |
| O02 | C52 | C42 | O42 | 160.8° | 177.5° |
| C52 | O02 | C12 | H12 | 174.1° | 178.9° |
| O02 | C52 | C42 | H42 | 77.2° | 62.3° |
| O02 | C52 | C62 | H62 | 62.4° | 55.0° |
| O02 | C52 | C62 | H62A | 56.8° | 175.0° |
| C42 | C52 | C62 | H52 | 119.4° | 120.1° |
| C42 | C52 | O02 | C12 | 53.7° | 61.2° |
| C52 | C42 | C32 | C01 | 43.4° | 57.0° |
| C52 | C42 | C32 | O42 | 121.7° | 119.9° |
| C52 | C42 | C32 | H42 | 116.1° | 119.9° |
| C52 | C42 | C32 | S13 | 166.8° | 176.9° |
| C52 | C42 | O42 | H42 | 116.3° | 120.2° |
| C52 | C42 | C32 | H32 | 72.9° | 62.9° |
| C52 | C42 | O42 | HO42 | 28.4° | 60.0° |
| C42 | C52 | C62 | H62 | 179.9° | 64.9° |
| C42 | C52 | C62 | H62A | 60.7° | 55.0° |
| C62 | C52 | O02 | C12 | 172.2° | 178.8° |
| C62 | C52 | C42 | C32 | 154.9° | 177.6° |
| C62 | C52 | C42 | O42 | 85.4° | 62.5° |
| C62 | C52 | C42 | H42 | 36.7° | 57.7° |
| C52 | C62 | H62 | H62A | 120.8° | 119.9° |
| O02 | C12 | O12 | C01 | 120.0° | 119.9° |
| O02 | C12 | O12 | H12 | 120.1° | 120.0° |
| O02 | C12 | C01 | H12 | 120.1° | 119.9° |
| O02 | C12 | O12 | C22 | 71.7° | 70.0° |
| O02 | C12 | C01 | O22 | 58.3° | 62.2° |
| O02 | C12 | C01 | C32 | 61.0° | 57.6° |
| C12 | O02 | C52 | H52 | 65.5° | 58.8° |
| O02 | C12 | C01 | H01 | 178.5° | 177.5° |
| O12 | C12 | C01 | H12 | 118.5° | 120.1° |
| O12 | C12 | C01 | O22 | 179.7° | 177.8° |
| O12 | C12 | C01 | C32 | 60.5° | 62.3° |
| C12 | O12 | C22 | H22 | 79.8° | 60.1° |
| C12 | O12 | C22 | H22A | 160.2° | 60.0° |
| C12 | O12 | C22 | H22B | 40.2° | 180.0° |
| O12 | C12 | C01 | H01 | 60.0° | 57.5° |
| C01 | C12 | O12 | C22 | 168.3° | 170.0° |
| C12 | C01 | O22 | C32 | 117.8° | 119.7° |
| C12 | C01 | O22 | H01 | 121.7° | 120.2° |
| C12 | C01 | C32 | H01 | 121.7° | 119.9° |
| C12 | C01 | C32 | C42 | 52.2° | 57.0° |
| C12 | C01 | C32 | S13 | 173.0° | 176.9° |
| C12 | C01 | O22 | HO22 | 30.7° | 60.1° |
| C12 | C01 | C32 | H32 | 67.0° | 62.9° |
| C22 | O12 | C12 | H12 | 48.4° | 50.0° |
| O12 | C22 | H22 | H22A | 120.0° | 120.0° |
| O12 | C22 | H22 | H22B | 120.0° | 119.9° |
| O12 | C22 | H22A | H22B | 120.0° | 120.0° |
| O22 | C01 | C32 | H01 | 120.3° | 120.2° |
| O22 | C01 | C32 | C42 | 65.9° | 62.9° |
| O22 | C01 | C32 | S13 | 54.9° | 57.0° |
| O22 | C01 | C12 | H12 | 61.8° | 57.7° |
| O22 | C01 | C32 | H32 | 175.0° | 177.2° |
| C01 | C32 | C42 | S13 | 123.4° | 119.9° |
| C01 | C32 | C42 | H32 | 116.3° | 119.9° |
| C01 | C32 | S13 | H32 | 116.4° | 120.2° |
| C01 | C32 | C42 | O42 | 165.1° | 176.9° |
| C01 | C32 | S13 | C13 | 91.8° | 65.0° |
| C32 | C01 | C12 | H12 | 178.9° | 177.6° |
| C32 | C01 | O22 | HO22 | 87.1° | 179.7° |
| C01 | C32 | C42 | H42 | 72.7° | 62.9° |
| C42 | C32 | S13 | H32 | 119.5° | 120.2° |
| C32 | C42 | O42 | H42 | 118.6° | 120.2° |
| C42 | C32 | S13 | C13 | 144.1° | 175.4° |
| C32 | C42 | C52 | H52 | 82.4° | 62.4° |
| C42 | C32 | C01 | H01 | 173.9° | 176.9° |
| C32 | C42 | O42 | HO42 | 153.5° | 179.7° |
| S13 | C32 | C42 | O42 | 71.5° | 63.3° |
| C32 | S13 | C13 | O03 | 84.2° | 70.0° |
| C32 | S13 | C13 | C23 | 155.1° | 170.0° |
| S13 | C32 | C01 | H01 | 65.4° | 63.2° |
| S13 | C32 | C42 | H42 | 50.7° | 57.0° |
| C32 | S13 | C13 | H13 | 34.1° | 50.1° |
| O42 | C42 | C52 | H52 | 37.3° | 57.5° |
| O42 | C42 | C32 | H32 | 48.8° | 57.0° |
| O03 | C53 | C43 | C63 | 122.9° | 120.0° |
| O03 | C53 | C43 | H53 | 119.5° | 119.9° |
| O03 | C53 | C63 | H53 | 119.5° | 119.9° |
| C53 | O03 | C13 | S13 | 60.2° | 178.9° |
| C53 | O03 | C13 | C23 | 59.8° | 61.2° |
| O03 | C53 | C43 | C33 | 54.3° | 57.7° |
| O03 | C53 | C43 | O43 | 177.9° | 62.3° |
| O03 | C53 | C63 | O63 | 64.1° | 66.6° |
| C53 | O03 | C13 | H13 | 179.2° | 58.8° |
| O03 | C53 | C43 | H43 | 62.3° | 177.5° |
| O03 | C53 | C63 | H63 | 55.9° | 173.4° |
| O03 | C53 | C63 | H63A | 179.4° | 53.4° |
| C43 | C53 | C63 | H53 | 118.2° | 120.1° |
| C43 | C53 | O03 | C13 | 56.2° | 61.2° |
| C53 | C43 | C33 | C23 | 55.8° | 57.0° |
| C53 | C43 | C33 | O33 | 179.8° | 62.8° |
| C53 | C43 | C33 | O43 | 120.0° | 120.0° |
| C53 | C43 | C33 | H43 | 120.4° | 119.8° |
| C53 | C43 | O43 | H43 | 120.6° | 120.1° |
| C43 | C53 | C63 | O63 | 58.2° | 173.5° |
| C53 | C43 | C33 | H33 | 63.5° | 176.9° |
| C53 | C43 | O43 | HO43 | 65.7° | 179.9° |
| C43 | C53 | C63 | H63 | 178.2° | 53.5° |
| C43 | C53 | C63 | H63A | 58.3° | 66.5° |
| C63 | C53 | O03 | C13 | 179.9° | 58.9° |
| C63 | C53 | C43 | C33 | 177.2° | 62.3° |
| C63 | C53 | C43 | O43 | 59.2° | 177.7° |
| C53 | C63 | O63 | H63 | 120.0° | 120.0° |
| C53 | C63 | O63 | H63A | 116.5° | 120.0° |
| C63 | C53 | C43 | H43 | 60.6° | 57.5° |
| C53 | C63 | H63 | H63A | 116.9° | 120.0° |
| C53 | C63 | O63 | HO63 | 107.3° | 180.0° |
| O03 | C13 | S13 | C23 | 120.7° | 120.0° |
| O03 | C13 | S13 | H13 | 118.3° | 120.0° |
| O03 | C13 | C23 | H13 | 118.3° | 120.0° |
| O03 | C13 | C23 | O23 | 64.8° | 177.5° |
| O03 | C13 | C23 | C33 | 60.6° | 57.6° |
| C13 | O03 | C53 | H53 | 62.2° | 178.9° |
| O03 | C13 | C23 | H23 | 178.4° | 62.3° |
| S13 | C13 | C23 | H13 | 119.1° | 120.0° |
| S13 | C13 | C23 | O23 | 172.6° | 62.5° |
| S13 | C13 | C23 | C33 | 61.9° | 177.6° |
| C13 | S13 | C32 | H32 | 24.6° | 55.2° |
| S13 | C13 | C23 | H23 | 55.8° | 57.7° |
| C13 | C23 | O23 | C33 | 124.9° | 119.7° |
| C13 | C23 | O23 | H23 | 117.5° | 120.2° |
| C13 | C23 | C33 | H23 | 117.6° | 119.9° |
| C13 | C23 | C33 | O33 | 177.5° | 62.9° |
| C13 | C23 | C33 | C43 | 59.0° | 57.0° |
| C13 | C23 | O23 | HO23 | 129.4° | 60.0° |
| C13 | C23 | C33 | H33 | 61.3° | 176.9° |
| O23 | C23 | C33 | H23 | 116.8° | 120.2° |
| O23 | C23 | C33 | O33 | 56.9° | 57.0° |
| O23 | C23 | C33 | C43 | 66.5° | 176.9° |
| O23 | C23 | C13 | H13 | 53.5° | 57.5° |
| O23 | C23 | C33 | H33 | 173.1° | 63.1° |
| C23 | C33 | O33 | C43 | 120.9° | 119.5° |
| C23 | C33 | O33 | H33 | 119.0° | 120.2° |
| C23 | C33 | C43 | H33 | 119.4° | 119.9° |
| C23 | C33 | C43 | O43 | 175.8° | 63.0° |
| C33 | C23 | C13 | H13 | 179.0° | 62.4° |
| C33 | C23 | O23 | HO23 | 4.6° | 179.7° |
| C23 | C33 | O33 | HO33 | 62.8° | 60.0° |
| C23 | C33 | C43 | H43 | 64.6° | 176.9° |
| O33 | C33 | C43 | H33 | 116.3° | 120.2° |
| O33 | C33 | C43 | O43 | 59.8° | 177.2° |
| O33 | C33 | C23 | H23 | 59.9° | 177.2° |
| O33 | C33 | C43 | H43 | 59.8° | 57.0° |
| C33 | C43 | O43 | H43 | 116.5° | 120.1° |
| C33 | C43 | C53 | H53 | 65.2° | 177.6° |
| C43 | C33 | C23 | H23 | 176.6° | 62.9° |
| C43 | C33 | O33 | HO33 | 176.3° | 179.5° |
| C33 | C43 | O43 | HO43 | 57.1° | 60.3° |
| O43 | C43 | C53 | H53 | 58.4° | 57.6° |
| O43 | C43 | C33 | H33 | 56.4° | 56.9° |
| O63 | C63 | C53 | H53 | 176.5° | 53.4° |
| O63 | C63 | H63 | H63A | 116.9° | 120.0° |
| H51 | C51 | C41 | H41 | 179.5° | 177.7° |
| H51 | C51 | C61 | H61 | 63.4° | 64.9° |
| H51 | C51 | C61 | H61A | 177.2° | 175.1° |
| H11 | C11 | C21 | H21 | 80.5° | 62.5° |
| H21 | C21 | O21 | HO21 | 136.2° | 60.1° |
| H21 | C21 | C31 | H31 | 39.2° | 57.0° |
| H31 | C31 | O31 | HO31 | 107.5° | 60.2° |
| H31 | C31 | C41 | H41 | 166.7° | 177.2° |
| H41 | C41 | O41 | HO41 | 171.5° | 59.9° |
| H61 | C61 | O61 | HO61 | 127.5° | 60.0° |
| H61A | C61 | O61 | HO61 | 113.0° | 60.0° |
| H52 | C52 | C42 | H42 | 159.4° | 177.8° |
| H52 | C52 | C62 | H62 | 60.7° | 175.0° |
| H52 | C52 | C62 | H62A | 179.9° | 65.1° |
| H12 | C12 | C01 | H01 | 58.4° | 62.5° |
| H22 | C22 | H22A | H22B | 120.0° | 120.0° |
| H01 | C01 | O22 | HO22 | 152.4° | 60.1° |
| H01 | C01 | C32 | H32 | 54.7° | 57.0° |
| H32 | C32 | C42 | H42 | 171.0° | 177.3° |
| H42 | C42 | O42 | HO42 | 87.9° | 60.1° |
| H53 | C53 | C43 | H43 | 178.2° | 62.6° |
| H53 | C53 | C63 | H63 | 63.5° | 66.6° |
| H53 | C53 | C63 | H63A | 60.0° | 173.3° |
| H13 | C13 | C23 | H23 | 63.3° | 177.7° |
| H23 | C23 | O23 | HO23 | 113.0° | 60.1° |
| H23 | C23 | C33 | H33 | 56.3° | 57.0° |
| H33 | C33 | O33 | HO33 | 56.2° | 60.2° |
| H33 | C33 | C43 | H43 | 176.0° | 63.2° |
| H43 | C43 | O43 | HO43 | 173.7° | 59.8° |
| H63 | C63 | O63 | HO63 | 132.8° | 60.0° |
| H63A | C63 | O63 | HO63 | 9.2° | 60.0° |
