EKV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C31 | SI1 | sing | 1.86Å | 1.87Å | |
| C30 | C25 | sing | 1.51Å | 1.51Å | |
| SI1 | C24 | sing | 1.87Å | 1.91Å | |
| SI1 | C22 | sing | 1.86Å | 1.93Å | |
| SI1 | C32 | sing | 1.86Å | 1.86Å | |
| C25 | C24 | doub | 1.38Å | 1.41Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| O21 | C19 | sing | 1.36Å | 1.37Å | |
| O21 | C22 | sing | 1.43Å | 1.46Å | |
| C02 | C01 | sing | 1.51Å | 1.51Å | |
| C02 | N03 | sing | 1.47Å | 1.46Å | |
| C20 | C19 | doub | 1.39Å | 1.39Å | Aromatic |
| C20 | C01 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | C29 | sing | 1.38Å | 1.40Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C19 | C18 | sing | 1.39Å | 1.38Å | Aromatic |
| C01 | C16 | doub | 1.38Å | 1.35Å | Aromatic |
| C14 | N03 | sing | 1.47Å | 1.48Å | |
| C14 | C15 | sing | 1.53Å | 1.47Å | |
| C18 | C17 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.37Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.37Å | Aromatic |
| N03 | C04 | sing | 1.47Å | 1.46Å | |
| C04 | C05 | sing | 1.47Å | 1.47Å | |
| C05 | C06 | trip | 1.17Å | 1.19Å | |
| C06 | C07 | sing | 1.38Å | 1.37Å | |
| C07 | C08 | trip | 1.17Å | 1.19Å | |
| C10 | C09 | sing | 1.53Å | 1.51Å | |
| C11 | C09 | sing | 1.53Å | 1.54Å | |
| C08 | C09 | sing | 1.47Å | 1.48Å | |
| C09 | O12 | sing | 1.43Å | 1.42Å | |
| O12 | C13 | sing | 1.43Å | 1.43Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.08Å | 1.08Å | |
| C20 | H11 | sing | 1.08Å | 1.08Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C26 | H14 | sing | 1.08Å | 1.08Å | |
| C28 | H15 | sing | 1.08Å | 1.08Å | |
| C02 | H16 | sing | 1.09Å | 1.10Å | |
| C02 | H17 | sing | 1.09Å | 1.10Å | |
| C04 | H19 | sing | 1.09Å | 1.10Å | |
| C04 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C11 | H23 | sing | 1.09Å | 1.10Å | |
| C14 | H24 | sing | 1.09Å | 1.10Å | |
| C14 | H25 | sing | 1.09Å | 1.10Å | |
| C16 | H26 | sing | 1.08Å | 1.08Å | |
| C18 | H27 | sing | 1.08Å | 1.08Å | |
| C27 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H31 | sing | 1.09Å | 1.10Å | |
| C30 | H32 | sing | 1.09Å | 1.10Å | |
| C31 | H33 | sing | 1.09Å | 1.10Å | |
| C31 | H34 | sing | 1.09Å | 1.10Å | |
| C31 | H35 | sing | 1.09Å | 1.10Å | |
| C32 | H36 | sing | 1.09Å | 1.10Å | |
| C32 | H37 | sing | 1.09Å | 1.10Å | |
| C32 | H38 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C31 | SI1 | C24 | 115.5° | 109.5° |
| C31 | SI1 | C22 | 113.1° | 109.5° |
| C31 | SI1 | C32 | 109.6° | 109.5° |
| SI1 | C31 | H33 | 109.5° | 109.4° |
| SI1 | C31 | H34 | 109.5° | 109.5° |
| SI1 | C31 | H35 | 109.4° | 109.4° |
| C30 | C25 | C24 | 121.4° | 120.0° |
| C30 | C25 | C26 | 119.9° | 120.0° |
| C25 | C30 | H30 | 109.5° | 109.5° |
| C25 | C30 | H31 | 109.5° | 109.5° |
| C25 | C30 | H32 | 109.4° | 109.5° |
| C24 | SI1 | C22 | 95.3° | 109.4° |
| C24 | SI1 | C32 | 108.7° | 109.5° |
| SI1 | C24 | C25 | 122.4° | 120.0° |
| SI1 | C24 | C29 | 118.8° | 120.0° |
| C22 | SI1 | C32 | 113.9° | 109.5° |
| SI1 | C22 | O21 | 95.8° | 109.4° |
| SI1 | C22 | H12 | 112.8° | 109.4° |
| SI1 | C22 | H13 | 112.8° | 109.5° |
| SI1 | C32 | H36 | 109.5° | 109.4° |
| SI1 | C32 | H37 | 109.5° | 109.5° |
| SI1 | C32 | H38 | 109.5° | 109.4° |
| C24 | C25 | C26 | 118.7° | 120.0° |
| C25 | C24 | C29 | 118.7° | 120.0° |
| C25 | C26 | C27 | 121.1° | 120.0° |
| C25 | C26 | H14 | 119.4° | 120.0° |
| C19 | O21 | C22 | 119.4° | 117.0° |
| O21 | C19 | C20 | 117.4° | 120.1° |
| O21 | C19 | C18 | 122.5° | 120.0° |
| O21 | C22 | H12 | 112.8° | 109.5° |
| O21 | C22 | H13 | 112.8° | 109.5° |
| C01 | C02 | N03 | 114.6° | 109.5° |
| C02 | C01 | C20 | 120.8° | 120.0° |
| C02 | C01 | C16 | 119.9° | 120.0° |
| C01 | C02 | H16 | 108.1° | 109.4° |
| C01 | C02 | H17 | 108.2° | 109.5° |
| C02 | N03 | C14 | 110.1° | 111.0° |
| C02 | N03 | C04 | 111.2° | 111.0° |
| N03 | C02 | H16 | 108.2° | 109.5° |
| N03 | C02 | H17 | 108.2° | 109.5° |
| C19 | C20 | C01 | 120.3° | 120.0° |
| C20 | C19 | C18 | 120.1° | 119.8° |
| C19 | C20 | H11 | 119.8° | 120.0° |
| C20 | C01 | C16 | 119.0° | 120.1° |
| C01 | C20 | H11 | 119.8° | 120.1° |
| C24 | C29 | C28 | 121.4° | 120.0° |
| C24 | C29 | H29 | 119.3° | 120.0° |
| C26 | C27 | C28 | 120.3° | 120.0° |
| C27 | C26 | H14 | 119.5° | 120.0° |
| C26 | C27 | H28 | 119.8° | 120.0° |
| C19 | C18 | C17 | 118.7° | 120.0° |
| C19 | C18 | H27 | 120.6° | 120.0° |
| C01 | C16 | C17 | 121.2° | 120.1° |
| C01 | C16 | H26 | 119.4° | 119.9° |
| N03 | C14 | C15 | 117.5° | 109.5° |
| C14 | N03 | C04 | 114.9° | 111.0° |
| N03 | C14 | H24 | 107.4° | 109.5° |
| N03 | C14 | H25 | 107.4° | 109.5° |
| C14 | C15 | H7 | 109.5° | 109.5° |
| C14 | C15 | H8 | 109.5° | 109.5° |
| C14 | C15 | H9 | 109.5° | 109.5° |
| C15 | C14 | H24 | 107.4° | 109.4° |
| C15 | C14 | H25 | 107.4° | 109.5° |
| C18 | C17 | C16 | 120.6° | 120.1° |
| C18 | C17 | H10 | 119.7° | 120.0° |
| C17 | C18 | H27 | 120.6° | 120.0° |
| C16 | C17 | H10 | 119.7° | 119.9° |
| C17 | C16 | H26 | 119.4° | 120.0° |
| C27 | C28 | C29 | 119.7° | 120.0° |
| C27 | C28 | H15 | 120.1° | 120.0° |
| C28 | C27 | H28 | 119.8° | 120.0° |
| C29 | C28 | H15 | 120.1° | 120.0° |
| C28 | C29 | H29 | 119.3° | 120.0° |
| N03 | C04 | C05 | 116.2° | 109.5° |
| N03 | C04 | H19 | 107.8° | 109.5° |
| N03 | C04 | H20 | 107.8° | 109.4° |
| C04 | C05 | C06 | 174.9° | 180.0° |
| C05 | C04 | H19 | 107.8° | 109.5° |
| C05 | C04 | H20 | 107.8° | 109.5° |
| C05 | C06 | C07 | 176.7° | 180.0° |
| C06 | C07 | C08 | 173.6° | 180.0° |
| C07 | C08 | C09 | 179.2° | 179.9° |
| C10 | C09 | C11 | 111.5° | 109.5° |
| C10 | C09 | C08 | 107.9° | 109.4° |
| C10 | C09 | O12 | 105.8° | 109.4° |
| C09 | C10 | H1 | 109.5° | 109.5° |
| C09 | C10 | H2 | 109.5° | 109.4° |
| C09 | C10 | H3 | 109.5° | 109.4° |
| C11 | C09 | C08 | 110.5° | 109.5° |
| C11 | C09 | O12 | 102.9° | 109.5° |
| C09 | C11 | H21 | 109.5° | 109.4° |
| C09 | C11 | H22 | 109.5° | 109.5° |
| C09 | C11 | H23 | 109.4° | 109.5° |
| C08 | C09 | O12 | 118.2° | 109.5° |
| C09 | O12 | C13 | 124.0° | 114.0° |
| O12 | C13 | H4 | 109.5° | 109.5° |
| O12 | C13 | H5 | 109.5° | 109.5° |
| O12 | C13 | H6 | 109.5° | 109.5° |
| H1 | C10 | H2 | 109.4° | 109.6° |
| H1 | C10 | H3 | 109.5° | 109.4° |
| H2 | C10 | H3 | 109.5° | 109.5° |
| H4 | C13 | H5 | 109.5° | 109.5° |
| H4 | C13 | H6 | 109.5° | 109.4° |
| H5 | C13 | H6 | 109.5° | 109.5° |
| H7 | C15 | H8 | 109.5° | 109.5° |
| H7 | C15 | H9 | 109.5° | 109.4° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H12 | C22 | H13 | 109.5° | 109.5° |
| H16 | C02 | H17 | 109.5° | 109.4° |
| H19 | C04 | H20 | 109.4° | 109.5° |
| H21 | C11 | H22 | 109.5° | 109.4° |
| H21 | C11 | H23 | 109.5° | 109.5° |
| H22 | C11 | H23 | 109.5° | 109.4° |
| H24 | C14 | H25 | 109.5° | 109.5° |
| H30 | C30 | H31 | 109.5° | 109.4° |
| H30 | C30 | H32 | 109.5° | 109.4° |
| H31 | C30 | H32 | 109.4° | 109.5° |
| H33 | C31 | H34 | 109.5° | 109.5° |
| H33 | C31 | H35 | 109.5° | 109.5° |
| H34 | C31 | H35 | 109.5° | 109.5° |
| H36 | C32 | H37 | 109.5° | 109.5° |
| H36 | C32 | H38 | 109.4° | 109.5° |
| H37 | C32 | H38 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C31 | SI1 | C24 | C22 | 118.8° | 120.0° |
| C31 | SI1 | C24 | C32 | 123.7° | 120.0° |
| C31 | SI1 | C22 | C32 | 126.1° | 120.0° |
| C31 | SI1 | C24 | C25 | 61.4° | 36.1° |
| C31 | SI1 | C22 | O21 | 52.1° | 55.8° |
| C31 | SI1 | C24 | C29 | 121.0° | 143.5° |
| C31 | SI1 | C22 | H12 | 65.6° | 175.8° |
| C31 | SI1 | C22 | H13 | 169.8° | 64.2° |
| SI1 | C31 | H33 | H34 | 120.0° | 120.0° |
| SI1 | C31 | H33 | H35 | 120.0° | 119.9° |
| SI1 | C31 | H34 | H35 | 120.0° | 120.0° |
| C31 | SI1 | C32 | H36 | 180.0° | 58.1° |
| C31 | SI1 | C32 | H37 | 60.0° | 62.0° |
| C31 | SI1 | C32 | H38 | 60.0° | 178.0° |
| C30 | C25 | C24 | SI1 | 0.2° | 0.4° |
| C30 | C25 | C24 | C26 | 179.2° | 179.9° |
| C30 | C25 | C24 | C29 | 177.7° | 180.0° |
| C30 | C25 | C26 | C27 | 179.3° | 180.0° |
| C30 | C25 | C26 | H14 | 0.7° | 0.4° |
| C25 | C30 | H30 | H31 | 120.0° | 120.0° |
| C25 | C30 | H30 | H32 | 120.0° | 120.0° |
| C25 | C30 | H31 | H32 | 119.9° | 120.1° |
| C24 | SI1 | C22 | C32 | 113.2° | 120.0° |
| SI1 | C24 | C25 | C29 | 177.5° | 179.7° |
| SI1 | C24 | C25 | C26 | 179.0° | 179.7° |
| C24 | SI1 | C22 | O21 | 172.8° | 175.8° |
| SI1 | C24 | C29 | C28 | 179.5° | 180.0° |
| C24 | SI1 | C22 | H12 | 55.1° | 64.2° |
| C24 | SI1 | C22 | H13 | 69.6° | 55.8° |
| SI1 | C24 | C29 | H29 | 0.6° | 0.0° |
| C24 | SI1 | C31 | H33 | 180.0° | 68.1° |
| C24 | SI1 | C31 | H34 | 60.0° | 171.8° |
| C24 | SI1 | C31 | H35 | 60.0° | 51.8° |
| C24 | SI1 | C32 | H36 | 52.9° | 62.0° |
| C24 | SI1 | C32 | H37 | 67.2° | 178.0° |
| C24 | SI1 | C32 | H38 | 172.8° | 58.0° |
| C22 | SI1 | C24 | C25 | 179.8° | 83.9° |
| SI1 | C22 | O21 | C19 | 177.0° | 77.7° |
| SI1 | C22 | O21 | H12 | 117.7° | 120.0° |
| SI1 | C22 | O21 | H13 | 117.7° | 120.0° |
| C22 | SI1 | C24 | C29 | 2.2° | 96.5° |
| SI1 | C22 | H12 | H13 | 126.4° | 120.0° |
| C22 | SI1 | C31 | H33 | 71.6° | 51.8° |
| C22 | SI1 | C31 | H34 | 168.4° | 68.2° |
| C22 | SI1 | C31 | H35 | 48.4° | 171.8° |
| C22 | SI1 | C32 | H36 | 52.1° | 178.1° |
| C22 | SI1 | C32 | H37 | 172.1° | 58.0° |
| C22 | SI1 | C32 | H38 | 67.9° | 62.0° |
| C32 | SI1 | C24 | C25 | 62.3° | 156.1° |
| C32 | SI1 | C22 | O21 | 74.0° | 64.2° |
| C32 | SI1 | C24 | C29 | 115.3° | 23.5° |
| C32 | SI1 | C22 | H12 | 168.3° | 55.8° |
| C32 | SI1 | C22 | H13 | 43.7° | 175.8° |
| C32 | SI1 | C31 | H33 | 56.8° | 171.8° |
| C32 | SI1 | C31 | H34 | 63.3° | 51.8° |
| C32 | SI1 | C31 | H35 | 176.8° | 68.2° |
| SI1 | C32 | H36 | H37 | 120.0° | 120.0° |
| SI1 | C32 | H36 | H38 | 120.0° | 120.0° |
| SI1 | C32 | H37 | H38 | 120.0° | 120.0° |
| C24 | C25 | C26 | C27 | 0.1° | 0.1° |
| C25 | C24 | C29 | C28 | 1.8° | 0.3° |
| C24 | C25 | C26 | H14 | 179.9° | 179.7° |
| C25 | C24 | C29 | H29 | 178.2° | 179.7° |
| C24 | C25 | C30 | H30 | 89.6° | 83.8° |
| C24 | C25 | C30 | H31 | 150.4° | 156.3° |
| C24 | C25 | C30 | H32 | 30.4° | 36.2° |
| C26 | C25 | C24 | C29 | 1.5° | 0.0° |
| C25 | C26 | C27 | H14 | 180.0° | 179.6° |
| C25 | C26 | C27 | C28 | 1.4° | 0.3° |
| C25 | C26 | C27 | H28 | 178.6° | 179.7° |
| C26 | C25 | C30 | H30 | 89.6° | 96.3° |
| C26 | C25 | C30 | H31 | 30.4° | 23.7° |
| C26 | C25 | C30 | H32 | 150.3° | 143.8° |
| O21 | C19 | C20 | C18 | 179.1° | 179.8° |
| O21 | C19 | C20 | C01 | 179.4° | 180.0° |
| O21 | C19 | C18 | C17 | 179.0° | 179.7° |
| O21 | C19 | C20 | H11 | 0.6° | 0.2° |
| C19 | O21 | C22 | H12 | 59.3° | 42.3° |
| C19 | O21 | C22 | H13 | 65.3° | 162.3° |
| O21 | C19 | C18 | H27 | 1.0° | 0.2° |
| C22 | O21 | C19 | C20 | 164.4° | 174.7° |
| C22 | O21 | C19 | C18 | 16.5° | 5.5° |
| O21 | C22 | H12 | H13 | 126.4° | 120.1° |
| C01 | C02 | N03 | H16 | 120.7° | 120.0° |
| C01 | C02 | N03 | H17 | 120.8° | 120.0° |
| C02 | C01 | C20 | C19 | 176.2° | 180.0° |
| C02 | C01 | C20 | C16 | 174.1° | 179.7° |
| C01 | C02 | N03 | C14 | 175.2° | 66.0° |
| C02 | C01 | C16 | C17 | 175.4° | 179.7° |
| C01 | C02 | N03 | C04 | 56.3° | 170.0° |
| C02 | C01 | C20 | H11 | 3.8° | 0.3° |
| C01 | C02 | H16 | H17 | 117.6° | 120.0° |
| C02 | C01 | C16 | H26 | 4.6° | 0.3° |
| N03 | C02 | C01 | C20 | 62.2° | 90.0° |
| N03 | C02 | C01 | C16 | 123.8° | 89.7° |
| C02 | N03 | C14 | C04 | 126.5° | 124.0° |
| C02 | N03 | C14 | C15 | 177.5° | 62.5° |
| C02 | N03 | C04 | C05 | 69.4° | 173.1° |
| N03 | C02 | H16 | H17 | 117.7° | 120.0° |
| C02 | N03 | C04 | H19 | 51.6° | 66.9° |
| C02 | N03 | C04 | H20 | 169.6° | 53.1° |
| C02 | N03 | C14 | H24 | 61.4° | 57.4° |
| C02 | N03 | C14 | H25 | 56.3° | 177.4° |
| C19 | C20 | C01 | H11 | 180.0° | 179.7° |
| C19 | C20 | C01 | C16 | 2.2° | 0.3° |
| C20 | C19 | C18 | C17 | 0.1° | 0.0° |
| C20 | C19 | C18 | H27 | 179.9° | 180.0° |
| C01 | C20 | C19 | C18 | 1.5° | 0.3° |
| C20 | C01 | C16 | C17 | 1.3° | 0.0° |
| C20 | C01 | C02 | H16 | 58.6° | 150.0° |
| C20 | C01 | C02 | H17 | 177.1° | 30.1° |
| C20 | C01 | C16 | H26 | 178.8° | 180.0° |
| C24 | C29 | C28 | C27 | 0.5° | 0.6° |
| C24 | C29 | C28 | H29 | 180.0° | 179.9° |
| C24 | C29 | C28 | H15 | 179.5° | 180.0° |
| C26 | C27 | C28 | H28 | 180.0° | 180.0° |
| C26 | C27 | C28 | C29 | 1.1° | 0.6° |
| C26 | C27 | C28 | H15 | 178.9° | 179.9° |
| C19 | C18 | C17 | H27 | 180.0° | 179.9° |
| C19 | C18 | C17 | C16 | 1.0° | 0.3° |
| C19 | C18 | C17 | H10 | 179.0° | 180.0° |
| C18 | C19 | C20 | H11 | 178.5° | 180.0° |
| C01 | C16 | C17 | C18 | 0.3° | 0.3° |
| C01 | C16 | C17 | H26 | 180.0° | 180.0° |
| C01 | C16 | C17 | H10 | 179.7° | 180.0° |
| C16 | C01 | C20 | H11 | 177.9° | 180.0° |
| C16 | C01 | C02 | H16 | 115.4° | 30.3° |
| C16 | C01 | C02 | H17 | 3.0° | 150.2° |
| N03 | C14 | C15 | H24 | 121.2° | 120.0° |
| N03 | C14 | C15 | H25 | 121.2° | 120.0° |
| C14 | N03 | C04 | C05 | 56.5° | 63.0° |
| N03 | C14 | C15 | H7 | 180.0° | 56.6° |
| N03 | C14 | C15 | H8 | 60.0° | 176.6° |
| N03 | C14 | C15 | H9 | 60.0° | 63.4° |
| C14 | N03 | C02 | H16 | 54.5° | 53.9° |
| C14 | N03 | C02 | H17 | 64.0° | 173.9° |
| C14 | N03 | C04 | H19 | 177.4° | 57.0° |
| C14 | N03 | C04 | H20 | 64.6° | 177.0° |
| N03 | C14 | H24 | H25 | 116.4° | 120.0° |
| C15 | C14 | N03 | C04 | 51.0° | 61.4° |
| C14 | C15 | H7 | H8 | 120.0° | 120.0° |
| C14 | C15 | H7 | H9 | 120.0° | 120.0° |
| C14 | C15 | H8 | H9 | 120.0° | 120.1° |
| C15 | C14 | H24 | H25 | 116.3° | 120.0° |
| C18 | C17 | C16 | H10 | 180.0° | 179.7° |
| C18 | C17 | C16 | H26 | 179.7° | 179.7° |
| C16 | C17 | C18 | H27 | 179.0° | 179.8° |
| C27 | C28 | C29 | H15 | 180.0° | 179.5° |
| C28 | C27 | C26 | H14 | 178.6° | 179.9° |
| C27 | C28 | C29 | H29 | 179.5° | 179.4° |
| C29 | C28 | C27 | H28 | 178.9° | 179.4° |
| N03 | C04 | C05 | H19 | 121.0° | 120.0° |
| N03 | C04 | C05 | H20 | 121.0° | 120.0° |
| N03 | C04 | C05 | C06 | 50.8° | 163.3° |
| C04 | N03 | C02 | H16 | 177.0° | 70.0° |
| C04 | N03 | C02 | H17 | 64.5° | 50.0° |
| N03 | C04 | H19 | H20 | 116.9° | 120.0° |
| C04 | N03 | C14 | H24 | 172.2° | 178.6° |
| C04 | N03 | C14 | H25 | 70.1° | 58.6° |
| C04 | C05 | C06 | C07 | 18.0° | 140.5° |
| C05 | C04 | H19 | H20 | 117.0° | 120.0° |
| C05 | C06 | C07 | C08 | 26.1° | NaN° |
| C06 | C05 | C04 | H19 | 171.8° | 76.7° |
| C06 | C05 | C04 | H20 | 70.2° | 43.4° |
| C06 | C07 | C08 | C09 | 25.5° | 121.3° |
| C07 | C08 | C09 | C10 | 33.4° | 144.2° |
| C07 | C08 | C09 | C11 | 88.7° | 24.2° |
| C07 | C08 | C09 | O12 | 153.3° | 95.8° |
| C10 | C09 | C11 | C08 | 120.0° | 120.0° |
| C10 | C09 | C11 | O12 | 113.0° | 120.0° |
| C10 | C09 | C08 | O12 | 119.9° | 119.9° |
| C10 | C09 | O12 | C13 | 108.7° | 60.0° |
| C09 | C10 | H1 | H2 | 120.0° | 120.0° |
| C09 | C10 | H1 | H3 | 120.0° | 119.9° |
| C09 | C10 | H2 | H3 | 120.0° | 119.9° |
| C10 | C09 | C11 | H21 | 180.0° | 60.0° |
| C10 | C09 | C11 | H22 | 60.0° | 180.0° |
| C10 | C09 | C11 | H23 | 60.0° | 60.0° |
| C11 | C09 | C08 | O12 | 118.0° | 120.1° |
| C11 | C09 | O12 | C13 | 134.1° | 60.0° |
| C11 | C09 | C10 | H1 | 180.0° | 179.9° |
| C11 | C09 | C10 | H2 | 60.0° | 60.0° |
| C11 | C09 | C10 | H3 | 60.0° | 60.0° |
| C09 | C11 | H21 | H22 | 120.0° | 120.0° |
| C09 | C11 | H21 | H23 | 120.0° | 120.0° |
| C09 | C11 | H22 | H23 | 119.9° | 120.0° |
| C08 | C09 | O12 | C13 | 12.2° | 180.0° |
| C08 | C09 | C10 | H1 | 58.5° | 59.9° |
| C08 | C09 | C10 | H2 | 61.5° | 180.0° |
| C08 | C09 | C10 | H3 | 178.5° | 60.0° |
| C08 | C09 | C11 | H21 | 60.0° | 180.0° |
| C08 | C09 | C11 | H22 | 180.0° | 60.0° |
| C08 | C09 | C11 | H23 | 60.0° | 60.0° |
| O12 | C09 | C10 | H1 | 68.9° | 60.1° |
| O12 | C09 | C10 | H2 | 171.2° | 60.1° |
| O12 | C09 | C10 | H3 | 51.1° | 180.0° |
| C09 | O12 | C13 | H4 | 180.0° | 60.0° |
| C09 | O12 | C13 | H5 | 60.0° | 180.0° |
| C09 | O12 | C13 | H6 | 60.0° | 60.0° |
| O12 | C09 | C11 | H21 | 67.0° | 60.0° |
| O12 | C09 | C11 | H22 | 53.0° | 60.0° |
| O12 | C09 | C11 | H23 | 173.0° | 180.0° |
| O12 | C13 | H4 | H5 | 120.0° | 120.1° |
| O12 | C13 | H4 | H6 | 120.0° | 120.0° |
| O12 | C13 | H5 | H6 | 120.0° | 120.0° |
| H1 | C10 | H2 | H3 | 120.0° | 120.0° |
| H4 | C13 | H5 | H6 | 120.0° | 119.9° |
| H7 | C15 | H8 | H9 | 120.0° | 120.0° |
| H7 | C15 | C14 | H24 | 58.8° | 176.6° |
| H7 | C15 | C14 | H25 | 58.8° | 63.4° |
| H8 | C15 | C14 | H24 | 178.8° | 63.4° |
| H8 | C15 | C14 | H25 | 61.2° | 56.5° |
| H9 | C15 | C14 | H24 | 61.2° | 56.6° |
| H9 | C15 | C14 | H25 | 178.9° | 176.6° |
| H10 | C17 | C16 | H26 | 0.3° | 0.0° |
| H10 | C17 | C18 | H27 | 1.0° | 0.1° |
| H14 | C26 | C27 | H28 | 1.4° | 0.1° |
| H15 | C28 | C27 | H28 | 1.1° | 0.0° |
| H15 | C28 | C29 | H29 | 0.5° | 0.1° |
| H21 | C11 | H22 | H23 | 120.0° | 120.0° |
| H30 | C30 | H31 | H32 | 120.0° | 120.0° |
| H33 | C31 | H34 | H35 | 120.0° | 120.0° |
| H36 | C32 | H37 | H38 | 119.9° | 120.0° |
