WU1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | sing | 1.51Å | 1.53Å | |
| C02 | O34 | sing | 1.34Å | 1.31Å | Aromatic |
| C02 | C03 | doub | 1.37Å | 1.38Å | Aromatic |
| O34 | N33 | sing | 1.21Å | 1.37Å | Aromatic |
| C10 | C09 | sing | 1.53Å | 1.52Å | |
| C10 | C11 | sing | 1.51Å | 1.52Å | |
| N07 | C06 | doub | 1.33Å | 1.38Å | Aromatic |
| N07 | C08 | sing | 1.34Å | 1.32Å | Aromatic |
| C05 | C06 | sing | 1.41Å | 1.42Å | Aromatic |
| C05 | C04 | doub | 1.38Å | 1.39Å | Aromatic |
| C09 | C08 | sing | 1.51Å | 1.53Å | |
| C06 | N28 | sing | 1.38Å | 1.34Å | Aromatic |
| C08 | C20 | doub | 1.36Å | 1.37Å | Aromatic |
| C03 | C04 | sing | 1.48Å | 1.54Å | |
| C03 | C31 | sing | 1.42Å | 1.41Å | Aromatic |
| C11 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| N33 | C31 | doub | 1.30Å | 1.34Å | Aromatic |
| C04 | C30 | sing | 1.42Å | 1.39Å | Aromatic |
| C31 | C32 | sing | 1.51Å | 1.53Å | |
| N28 | C20 | sing | 1.37Å | 1.36Å | Aromatic |
| N28 | C29 | sing | 1.37Å | 1.38Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | N21 | sing | 1.40Å | 1.45Å | |
| C13 | CL14 | sing | 1.74Å | 1.79Å | |
| C13 | C15 | doub | 1.39Å | 1.38Å | Aromatic |
| C30 | C29 | doub | 1.34Å | 1.39Å | Aromatic |
| C18 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | O16 | sing | 1.36Å | 1.41Å | |
| N21 | C22 | sing | 1.47Å | 1.45Å | |
| O16 | C17 | sing | 1.43Å | 1.40Å | |
| C27 | C22 | sing | 1.53Å | 1.52Å | |
| C27 | C26 | sing | 1.53Å | 1.53Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C23 | C24 | sing | 1.53Å | 1.53Å | |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C22 | H6 | sing | 1.09Å | 1.10Å | |
| C24 | H7 | sing | 1.09Å | 1.10Å | |
| C24 | H8 | sing | 1.09Å | 1.10Å | |
| C26 | H9 | sing | 1.09Å | 1.10Å | |
| C26 | H10 | sing | 1.09Å | 1.10Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C01 | H12 | sing | 1.09Å | 1.10Å | |
| C01 | H13 | sing | 1.09Å | 1.10Å | |
| C05 | H14 | sing | 1.08Å | 1.08Å | |
| C09 | H15 | sing | 1.09Å | 1.10Å | |
| C09 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.08Å | 1.08Å | |
| C30 | H27 | sing | 1.08Å | 1.08Å | |
| C32 | H28 | sing | 1.09Å | 1.10Å | |
| C32 | H29 | sing | 1.09Å | 1.10Å | |
| C32 | H30 | sing | 1.09Å | 1.10Å | |
| N21 | H31 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | O34 | 125.0° | 126.9° |
| C01 | C02 | C03 | 127.9° | 126.9° |
| C02 | C01 | H11 | 109.5° | 109.4° |
| C02 | C01 | H12 | 109.4° | 109.5° |
| C02 | C01 | H13 | 109.5° | 109.5° |
| O34 | C02 | C03 | 107.1° | 106.2° |
| C02 | O34 | N33 | 111.5° | 111.9° |
| C02 | C03 | C04 | 125.6° | 128.2° |
| C02 | C03 | C31 | 106.9° | 103.6° |
| O34 | N33 | C31 | 107.1° | 112.0° |
| C09 | C10 | C11 | 110.4° | 109.5° |
| C10 | C09 | C08 | 111.8° | 109.4° |
| C09 | C10 | H1 | 109.3° | 109.5° |
| C09 | C10 | H2 | 109.2° | 109.5° |
| C10 | C09 | H15 | 108.9° | 109.5° |
| C10 | C09 | H16 | 108.9° | 109.5° |
| C10 | C11 | C12 | 120.4° | 119.9° |
| C10 | C11 | C19 | 118.9° | 119.9° |
| C11 | C10 | H1 | 109.2° | 109.5° |
| C11 | C10 | H2 | 109.3° | 109.4° |
| C06 | N07 | C08 | 107.5° | 109.2° |
| N07 | C06 | C05 | 131.6° | 132.1° |
| N07 | C06 | N28 | 108.4° | 108.1° |
| N07 | C08 | C09 | 125.8° | 125.7° |
| N07 | C08 | C20 | 108.9° | 108.6° |
| C06 | C05 | C04 | 119.2° | 119.1° |
| C05 | C06 | N28 | 120.0° | 119.8° |
| C06 | C05 | H14 | 120.4° | 120.4° |
| C05 | C04 | C03 | 120.2° | 120.3° |
| C05 | C04 | C30 | 119.5° | 119.4° |
| C04 | C05 | H14 | 120.4° | 120.5° |
| C09 | C08 | C20 | 125.3° | 125.7° |
| C08 | C09 | H15 | 108.9° | 109.5° |
| C08 | C09 | H16 | 108.9° | 109.5° |
| C06 | N28 | C20 | 107.6° | 107.0° |
| C06 | N28 | C29 | 121.6° | 120.6° |
| C08 | C20 | N28 | 107.7° | 107.1° |
| C08 | C20 | N21 | 124.3° | 126.4° |
| C04 | C03 | C31 | 127.4° | 128.2° |
| C03 | C04 | C30 | 120.2° | 120.3° |
| C03 | C31 | N33 | 107.4° | 106.3° |
| C03 | C31 | C32 | 128.9° | 126.8° |
| C12 | C11 | C19 | 120.7° | 120.1° |
| C11 | C12 | C13 | 119.1° | 120.0° |
| C11 | C12 | H17 | 120.5° | 120.0° |
| C11 | C19 | C18 | 119.9° | 120.1° |
| C11 | C19 | H19 | 120.0° | 120.0° |
| C12 | C13 | CL14 | 119.7° | 120.1° |
| C12 | C13 | C15 | 120.6° | 119.9° |
| C13 | C12 | H17 | 120.5° | 119.9° |
| N33 | C31 | C32 | 123.7° | 126.9° |
| C04 | C30 | C29 | 120.4° | 120.2° |
| C04 | C30 | H27 | 119.8° | 119.9° |
| C31 | C32 | H28 | 109.5° | 109.5° |
| C31 | C32 | H29 | 109.5° | 109.4° |
| C31 | C32 | H30 | 109.5° | 109.5° |
| C20 | N28 | C29 | 130.8° | 132.4° |
| N28 | C20 | N21 | 128.0° | 126.4° |
| N28 | C29 | C30 | 119.3° | 120.9° |
| N28 | C29 | H26 | 120.4° | 119.6° |
| C19 | C18 | C15 | 120.3° | 119.9° |
| C19 | C18 | H18 | 119.9° | 120.1° |
| C18 | C19 | H19 | 120.1° | 119.9° |
| C20 | N21 | C22 | 121.3° | 111.0° |
| C20 | N21 | H31 | 106.5° | 111.0° |
| CL14 | C13 | C15 | 119.7° | 120.0° |
| C13 | C15 | C18 | 119.5° | 119.9° |
| C13 | C15 | O16 | 119.8° | 120.1° |
| C30 | C29 | H26 | 120.3° | 119.5° |
| C29 | C30 | H27 | 119.8° | 119.9° |
| C18 | C15 | O16 | 120.7° | 120.0° |
| C15 | C18 | H18 | 119.9° | 120.0° |
| C15 | O16 | C17 | 115.4° | 117.0° |
| N21 | C22 | C27 | 108.9° | 109.5° |
| N21 | C22 | C23 | 109.2° | 109.4° |
| N21 | C22 | H6 | 109.4° | 109.5° |
| C22 | N21 | H31 | 106.4° | 111.0° |
| O16 | C17 | H3 | 109.5° | 109.5° |
| O16 | C17 | H4 | 109.5° | 109.5° |
| O16 | C17 | H5 | 109.5° | 109.5° |
| C22 | C27 | C26 | 111.4° | 109.5° |
| C27 | C22 | C23 | 112.4° | 109.5° |
| C27 | C22 | H6 | 108.5° | 109.5° |
| C22 | C27 | H24 | 109.0° | 109.5° |
| C22 | C27 | H25 | 109.0° | 109.5° |
| C27 | C26 | C25 | 110.5° | 109.4° |
| C27 | C26 | H9 | 109.2° | 109.5° |
| C27 | C26 | H10 | 109.2° | 109.5° |
| C26 | C27 | H24 | 109.0° | 109.4° |
| C26 | C27 | H25 | 109.0° | 109.5° |
| C22 | C23 | C24 | 112.5° | 109.4° |
| C23 | C22 | H6 | 108.4° | 109.5° |
| C22 | C23 | H20 | 108.7° | 109.5° |
| C22 | C23 | H21 | 108.7° | 109.5° |
| C23 | C24 | C25 | 114.1° | 109.5° |
| C23 | C24 | H7 | 108.3° | 109.4° |
| C23 | C24 | H8 | 108.3° | 109.5° |
| C24 | C23 | H20 | 108.7° | 109.5° |
| C24 | C23 | H21 | 108.7° | 109.4° |
| C26 | C25 | C24 | 112.3° | 109.5° |
| C25 | C26 | H9 | 109.2° | 109.5° |
| C25 | C26 | H10 | 109.2° | 109.5° |
| C26 | C25 | H22 | 108.8° | 109.5° |
| C26 | C25 | H23 | 108.7° | 109.4° |
| C25 | C24 | H7 | 108.3° | 109.5° |
| C25 | C24 | H8 | 108.3° | 109.5° |
| C24 | C25 | H22 | 108.8° | 109.5° |
| C24 | C25 | H23 | 108.8° | 109.5° |
| H1 | C10 | H2 | 109.5° | 109.5° |
| H3 | C17 | H4 | 109.4° | 109.5° |
| H3 | C17 | H5 | 109.4° | 109.5° |
| H4 | C17 | H5 | 109.5° | 109.4° |
| H7 | C24 | H8 | 109.5° | 109.5° |
| H9 | C26 | H10 | 109.5° | 109.5° |
| H11 | C01 | H12 | 109.4° | 109.4° |
| H11 | C01 | H13 | 109.5° | 109.5° |
| H12 | C01 | H13 | 109.5° | 109.5° |
| H15 | C09 | H16 | 109.4° | 109.6° |
| H20 | C23 | H21 | 109.5° | 109.5° |
| H22 | C25 | H23 | 109.5° | 109.5° |
| H24 | C27 | H25 | 109.5° | 109.5° |
| H28 | C32 | H29 | 109.4° | 109.5° |
| H28 | C32 | H30 | 109.5° | 109.5° |
| H29 | C32 | H30 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | O34 | C03 | 179.1° | 179.8° |
| C01 | C02 | O34 | N33 | 179.7° | 179.8° |
| C01 | C02 | C03 | C04 | 1.3° | 0.1° |
| C01 | C02 | C03 | C31 | 179.5° | 180.0° |
| C02 | C01 | H11 | H12 | 120.0° | 120.0° |
| C02 | C01 | H11 | H13 | 120.0° | 120.0° |
| C02 | C01 | H12 | H13 | 120.0° | 120.1° |
| O34 | C02 | C03 | C04 | 179.6° | 179.7° |
| O34 | C02 | C03 | C31 | 0.4° | 0.2° |
| C02 | O34 | N33 | C31 | 0.5° | 0.4° |
| O34 | C02 | C01 | H11 | 0.0° | 0.1° |
| O34 | C02 | C01 | H12 | 120.0° | 120.0° |
| O34 | C02 | C01 | H13 | 120.0° | 120.0° |
| C03 | C02 | O34 | N33 | 0.6° | 0.4° |
| C02 | C03 | C04 | C05 | 45.7° | 90.4° |
| C02 | C03 | C04 | C31 | 179.1° | 179.9° |
| C02 | C03 | C31 | N33 | 0.1° | 0.0° |
| C02 | C03 | C04 | C30 | 134.4° | 90.1° |
| C02 | C03 | C31 | C32 | 179.8° | 179.9° |
| C03 | C02 | C01 | H11 | 178.9° | 179.7° |
| C03 | C02 | C01 | H12 | 61.1° | 59.8° |
| C03 | C02 | C01 | H13 | 58.9° | 60.2° |
| O34 | N33 | C31 | C03 | 0.2° | 0.3° |
| O34 | N33 | C31 | C32 | 179.9° | 179.7° |
| C09 | C10 | C11 | H1 | 120.1° | 120.0° |
| C09 | C10 | C11 | H2 | 120.1° | 120.0° |
| C10 | C09 | C08 | N07 | 46.9° | 90.0° |
| C10 | C09 | C08 | H15 | 120.4° | 119.9° |
| C10 | C09 | C08 | H16 | 120.4° | 120.0° |
| C10 | C09 | C08 | C20 | 132.9° | 90.0° |
| C09 | C10 | C11 | C12 | 96.0° | 90.0° |
| C09 | C10 | C11 | C19 | 83.8° | 90.0° |
| C09 | C10 | H1 | H2 | 119.6° | 120.0° |
| C10 | C09 | H15 | H16 | 118.9° | 120.0° |
| C11 | C10 | C09 | C08 | 63.9° | 180.0° |
| C10 | C11 | C12 | C19 | 179.8° | 180.0° |
| C10 | C11 | C12 | C13 | 179.6° | 180.0° |
| C10 | C11 | C19 | C18 | 179.6° | 179.7° |
| C11 | C10 | H1 | H2 | 119.6° | 120.0° |
| C11 | C10 | C09 | H15 | 56.5° | 60.1° |
| C11 | C10 | C09 | H16 | 175.8° | 60.0° |
| C10 | C11 | C12 | H17 | 0.4° | 0.0° |
| C10 | C11 | C19 | H19 | 0.4° | 0.0° |
| N07 | C06 | C05 | N28 | 178.9° | 179.5° |
| N07 | C06 | C05 | C04 | 179.8° | 179.7° |
| C06 | N07 | C08 | C09 | 180.0° | 180.0° |
| C06 | N07 | C08 | C20 | 0.3° | 0.0° |
| N07 | C06 | N28 | C20 | 0.0° | 0.4° |
| N07 | C06 | N28 | C29 | 179.4° | 180.0° |
| N07 | C06 | C05 | H14 | 0.2° | 0.5° |
| C08 | N07 | C06 | C05 | 179.2° | 179.8° |
| N07 | C08 | C09 | C20 | 179.7° | 180.0° |
| C08 | N07 | C06 | N28 | 0.2° | 0.2° |
| N07 | C08 | C20 | N28 | 0.3° | 0.2° |
| N07 | C08 | C20 | N21 | 179.0° | 180.0° |
| N07 | C08 | C09 | H15 | 167.2° | 150.1° |
| N07 | C08 | C09 | H16 | 73.5° | 30.0° |
| C06 | C05 | C04 | H14 | 180.0° | 179.3° |
| C06 | C05 | C04 | C03 | 179.2° | 179.7° |
| C06 | C05 | C04 | C30 | 0.9° | 0.8° |
| C05 | C06 | N28 | C20 | 179.1° | 180.0° |
| C05 | C06 | N28 | C29 | 1.5° | 0.4° |
| C04 | C05 | C06 | N28 | 1.3° | 0.8° |
| C05 | C04 | C03 | C30 | 179.9° | 179.5° |
| C05 | C04 | C03 | C31 | 135.3° | 89.5° |
| C05 | C04 | C30 | C29 | 0.6° | 0.4° |
| C05 | C04 | C30 | H27 | 179.3° | 180.0° |
| C09 | C08 | C20 | N28 | 180.0° | 179.8° |
| C09 | C08 | C20 | N21 | 1.3° | 0.0° |
| C08 | C09 | C10 | H1 | 56.3° | 60.0° |
| C08 | C09 | C10 | H2 | 176.0° | 60.0° |
| C08 | C09 | H15 | H16 | 118.9° | 120.0° |
| C06 | N28 | C20 | C08 | 0.1° | 0.3° |
| C06 | N28 | C20 | C29 | 179.3° | 179.6° |
| C06 | N28 | C20 | N21 | 178.8° | 179.9° |
| C06 | N28 | C29 | C30 | 1.2° | 0.0° |
| N28 | C06 | C05 | H14 | 178.7° | 180.0° |
| C06 | N28 | C29 | H26 | 178.7° | 180.0° |
| C08 | C20 | N28 | N21 | 178.7° | 179.8° |
| C08 | C20 | N28 | C29 | 179.2° | 179.9° |
| C08 | C20 | N21 | C22 | 117.6° | 172.2° |
| C20 | C08 | C09 | H15 | 12.5° | 29.9° |
| C20 | C08 | C09 | H16 | 106.8° | 150.0° |
| C08 | C20 | N21 | H31 | 4.0° | 63.9° |
| C04 | C03 | C31 | N33 | 179.3° | 179.9° |
| C04 | C03 | C31 | C32 | 0.6° | 0.0° |
| C03 | C04 | C30 | C29 | 179.4° | 179.9° |
| C03 | C04 | C05 | H14 | 0.8° | 0.4° |
| C03 | C04 | C30 | H27 | 0.6° | 0.5° |
| C03 | C31 | N33 | C32 | 179.9° | 180.0° |
| C31 | C03 | C04 | C30 | 44.7° | 90.0° |
| C03 | C31 | C32 | H28 | 179.9° | 90.0° |
| C03 | C31 | C32 | H29 | 60.1° | 150.0° |
| C03 | C31 | C32 | H30 | 59.9° | 30.1° |
| C11 | C12 | C13 | H17 | 180.0° | 180.0° |
| C12 | C11 | C19 | C18 | 0.2° | 0.3° |
| C11 | C12 | C13 | CL14 | 179.6° | 180.0° |
| C11 | C12 | C13 | C15 | 1.3° | 0.3° |
| C12 | C11 | C10 | H1 | 24.2° | 30.0° |
| C12 | C11 | C10 | H2 | 143.9° | 150.0° |
| C12 | C11 | C19 | H19 | 179.8° | 180.0° |
| C19 | C11 | C12 | C13 | 0.6° | 0.0° |
| C11 | C19 | C18 | H19 | 180.0° | 179.7° |
| C11 | C19 | C18 | C15 | 0.3° | 0.2° |
| C19 | C11 | C10 | H1 | 156.0° | 150.0° |
| C19 | C11 | C10 | H2 | 36.3° | 30.0° |
| C19 | C11 | C12 | H17 | 179.4° | 180.0° |
| C11 | C19 | C18 | H18 | 179.6° | 179.7° |
| C12 | C13 | CL14 | C15 | 179.1° | 179.7° |
| C12 | C13 | C15 | C18 | 1.2° | 0.3° |
| C12 | C13 | C15 | O16 | 179.6° | 179.7° |
| N33 | C31 | C32 | H28 | 0.0° | 89.9° |
| N33 | C31 | C32 | H29 | 120.0° | 30.1° |
| N33 | C31 | C32 | H30 | 120.0° | 150.0° |
| C04 | C30 | C29 | N28 | 0.8° | 0.0° |
| C04 | C30 | C29 | H27 | 180.0° | 179.6° |
| C30 | C04 | C05 | H14 | 179.1° | 180.0° |
| C04 | C30 | C29 | H26 | 179.2° | 180.0° |
| C31 | C32 | H28 | H29 | 120.0° | 120.0° |
| C31 | C32 | H28 | H30 | 120.1° | 120.1° |
| C31 | C32 | H29 | H30 | 120.0° | 119.9° |
| C20 | N28 | C29 | C30 | 179.5° | 179.5° |
| N28 | C20 | N21 | C22 | 63.9° | 7.5° |
| C20 | N28 | C29 | H26 | 0.5° | 0.4° |
| N28 | C20 | N21 | H31 | 174.5° | 116.4° |
| C29 | N28 | C20 | N21 | 0.5° | 0.3° |
| N28 | C29 | C30 | H26 | 180.0° | 179.9° |
| N28 | C29 | C30 | H27 | 179.2° | 179.6° |
| C19 | C18 | C15 | C13 | 0.4° | 0.0° |
| C19 | C18 | C15 | H18 | 180.0° | 180.0° |
| C19 | C18 | C15 | O16 | 179.6° | 180.0° |
| C20 | N21 | C22 | H31 | 121.7° | 124.0° |
| C20 | N21 | C22 | C27 | 57.5° | 84.6° |
| C20 | N21 | C22 | C23 | 179.4° | 155.5° |
| C20 | N21 | C22 | H6 | 60.9° | 35.4° |
| CL14 | C13 | C15 | C18 | 179.7° | 180.0° |
| CL14 | C13 | C15 | O16 | 0.5° | 0.0° |
| CL14 | C13 | C12 | H17 | 0.4° | 0.0° |
| C13 | C15 | C18 | O16 | 179.2° | 180.0° |
| C13 | C15 | O16 | C17 | 168.2° | 180.0° |
| C15 | C13 | C12 | H17 | 178.6° | 179.7° |
| C13 | C15 | C18 | H18 | 179.6° | 180.0° |
| C18 | C15 | O16 | C17 | 12.6° | 0.1° |
| C15 | C18 | C19 | H19 | 179.7° | 180.0° |
| C15 | O16 | C17 | H3 | 180.0° | 60.0° |
| C15 | O16 | C17 | H4 | 60.0° | 60.0° |
| C15 | O16 | C17 | H5 | 60.0° | 180.0° |
| O16 | C15 | C18 | H18 | 0.5° | 0.0° |
| N21 | C22 | C27 | C23 | 121.2° | 120.0° |
| N21 | C22 | C27 | H6 | 119.0° | 120.0° |
| N21 | C22 | C27 | C26 | 176.6° | 180.0° |
| N21 | C22 | C23 | H6 | 119.1° | 120.0° |
| N21 | C22 | C23 | C24 | 170.6° | 180.0° |
| N21 | C22 | C23 | H20 | 50.1° | 60.0° |
| N21 | C22 | C23 | H21 | 69.0° | 60.1° |
| N21 | C22 | C27 | H24 | 63.1° | 60.0° |
| N21 | C22 | C27 | H25 | 56.3° | 60.0° |
| O16 | C17 | H3 | H4 | 120.0° | 120.0° |
| O16 | C17 | H3 | H5 | 120.0° | 120.1° |
| O16 | C17 | H4 | H5 | 120.0° | 120.0° |
| C22 | C27 | C26 | H24 | 120.3° | 120.0° |
| C22 | C27 | C26 | H25 | 120.3° | 120.0° |
| C27 | C22 | C23 | H6 | 119.9° | 120.0° |
| C27 | C22 | C23 | C24 | 49.6° | 60.0° |
| C22 | C27 | C26 | C25 | 57.7° | 60.0° |
| C22 | C27 | C26 | H9 | 62.4° | 180.0° |
| C22 | C27 | C26 | H10 | 177.8° | 60.0° |
| C27 | C22 | C23 | H20 | 70.9° | 59.9° |
| C27 | C22 | C23 | H21 | 170.0° | 180.0° |
| C22 | C27 | H24 | H25 | 119.1° | 120.0° |
| C27 | C22 | N21 | H31 | 64.1° | 39.4° |
| C26 | C27 | C22 | C23 | 55.5° | 60.0° |
| C27 | C26 | C25 | H9 | 120.2° | 120.0° |
| C27 | C26 | C25 | H10 | 120.1° | 120.0° |
| C27 | C26 | C25 | C24 | 54.6° | 60.0° |
| C26 | C27 | C22 | H6 | 64.3° | 60.0° |
| C27 | C26 | H9 | H10 | 119.5° | 120.0° |
| C27 | C26 | C25 | H22 | 175.0° | 60.0° |
| C27 | C26 | C25 | H23 | 65.8° | 180.0° |
| C26 | C27 | H24 | H25 | 119.1° | 120.0° |
| C22 | C23 | C24 | H20 | 120.5° | 120.0° |
| C22 | C23 | C24 | H21 | 120.4° | 119.9° |
| C22 | C23 | C24 | C25 | 46.9° | 60.0° |
| C22 | C23 | C24 | H7 | 167.6° | 180.0° |
| C22 | C23 | C24 | H8 | 73.8° | 60.0° |
| C22 | C23 | H20 | H21 | 118.6° | 120.0° |
| C23 | C22 | C27 | H24 | 175.7° | 180.0° |
| C23 | C22 | C27 | H25 | 64.8° | 60.0° |
| C23 | C22 | N21 | H31 | 59.0° | 80.6° |
| C23 | C24 | C25 | C26 | 50.0° | 60.0° |
| C23 | C24 | C25 | H7 | 120.7° | 120.0° |
| C23 | C24 | C25 | H8 | 120.7° | 120.0° |
| C24 | C23 | C22 | H6 | 70.3° | 60.0° |
| C23 | C24 | H7 | H8 | 117.9° | 120.0° |
| C24 | C23 | H20 | H21 | 118.6° | 120.0° |
| C23 | C24 | C25 | H22 | 170.5° | 60.0° |
| C23 | C24 | C25 | H23 | 70.4° | 180.0° |
| C26 | C25 | C24 | H22 | 120.4° | 120.0° |
| C26 | C25 | C24 | H23 | 120.4° | 120.0° |
| C26 | C25 | C24 | H7 | 170.7° | 180.0° |
| C26 | C25 | C24 | H8 | 70.7° | 60.0° |
| C25 | C26 | H9 | H10 | 119.5° | 120.0° |
| C26 | C25 | H22 | H23 | 118.7° | 119.9° |
| C25 | C26 | C27 | H24 | 178.0° | 180.0° |
| C25 | C26 | C27 | H25 | 62.6° | 60.0° |
| C25 | C24 | H7 | H8 | 117.9° | 120.0° |
| C24 | C25 | C26 | H9 | 65.6° | 180.0° |
| C24 | C25 | C26 | H10 | 174.7° | 60.0° |
| C25 | C24 | C23 | H20 | 73.5° | 60.0° |
| C25 | C24 | C23 | H21 | 167.4° | 180.0° |
| C24 | C25 | H22 | H23 | 118.7° | 120.0° |
| H1 | C10 | C09 | H15 | 176.6° | 60.0° |
| H1 | C10 | C09 | H16 | 64.1° | 179.9° |
| H2 | C10 | C09 | H15 | 63.6° | 180.0° |
| H2 | C10 | C09 | H16 | 55.6° | 59.9° |
| H3 | C17 | H4 | H5 | 119.9° | 120.0° |
| H6 | C22 | C23 | H20 | 169.2° | 180.0° |
| H6 | C22 | C23 | H21 | 50.1° | 59.9° |
| H6 | C22 | C27 | H24 | 55.9° | 60.0° |
| H6 | C22 | C27 | H25 | 175.4° | 180.0° |
| H6 | C22 | N21 | H31 | 177.4° | 159.4° |
| H7 | C24 | C23 | H20 | 47.2° | 60.0° |
| H7 | C24 | C23 | H21 | 71.9° | 60.0° |
| H7 | C24 | C25 | H22 | 68.9° | 60.0° |
| H7 | C24 | C25 | H23 | 50.3° | 60.0° |
| H8 | C24 | C23 | H20 | 165.8° | 180.0° |
| H8 | C24 | C23 | H21 | 46.7° | 60.0° |
| H8 | C24 | C25 | H22 | 49.8° | 180.0° |
| H8 | C24 | C25 | H23 | 169.0° | 60.0° |
| H9 | C26 | C25 | H22 | 54.9° | 60.0° |
| H9 | C26 | C25 | H23 | 174.0° | 60.0° |
| H9 | C26 | C27 | H24 | 57.8° | 60.0° |
| H9 | C26 | C27 | H25 | 177.3° | 60.0° |
| H10 | C26 | C25 | H22 | 64.8° | 180.0° |
| H10 | C26 | C25 | H23 | 54.3° | 60.0° |
| H10 | C26 | C27 | H24 | 61.9° | 60.0° |
| H10 | C26 | C27 | H25 | 57.6° | 180.0° |
| H11 | C01 | H12 | H13 | 120.0° | 120.0° |
| H18 | C18 | C19 | H19 | 0.4° | 0.0° |
| H26 | C29 | C30 | H27 | 0.8° | 0.4° |
| H28 | C32 | H29 | H30 | 120.0° | 120.0° |
