UY5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C24 | sing | 1.53Å | 1.50Å | |
| C23 | N22 | sing | 1.47Å | 1.32Å | |
| C21 | N22 | sing | 1.47Å | 1.34Å | |
| C21 | C20 | sing | 1.51Å | 1.52Å | |
| C24 | C25 | sing | 1.53Å | 1.51Å | |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| N22 | C29 | sing | 1.47Å | 1.33Å | |
| C20 | C19 | doub | 1.38Å | 1.40Å | Aromatic |
| C20 | C30 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C01 | C02 | sing | 1.53Å | 1.52Å | |
| C29 | C28 | sing | 1.53Å | 1.56Å | |
| C30 | C31 | doub | 1.38Å | 1.38Å | Aromatic |
| C25 | C28 | sing | 1.53Å | 1.53Å | |
| C25 | C27 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | doub | 1.39Å | 1.38Å | Aromatic |
| C31 | C17 | sing | 1.39Å | 1.39Å | Aromatic |
| C02 | C03 | sing | 1.53Å | 1.53Å | |
| C02 | N04 | sing | 1.47Å | 1.46Å | |
| C17 | N15 | sing | 1.40Å | 1.44Å | |
| N15 | C16 | sing | 1.47Å | 1.48Å | |
| N15 | C14 | sing | 1.47Å | 1.50Å | |
| C16 | C33 | sing | 1.50Å | 1.50Å | |
| N04 | C05 | sing | 1.39Å | 1.46Å | |
| C10 | C09 | sing | 1.53Å | 1.54Å | |
| C10 | C13 | sing | 1.53Å | 1.54Å | |
| C09 | N08 | sing | 1.47Å | 1.45Å | |
| C06 | C05 | doub | 1.39Å | 1.37Å | Aromatic |
| C06 | C07 | sing | 1.39Å | 1.37Å | Aromatic |
| C33 | O34 | doub | 1.21Å | 1.19Å | |
| C33 | N32 | sing | 1.34Å | 1.41Å | |
| C14 | C13 | sing | 1.53Å | 1.54Å | |
| C05 | N37 | sing | 1.33Å | 1.33Å | Aromatic |
| C13 | N32 | sing | 1.46Å | 1.42Å | |
| C13 | C12 | sing | 1.53Å | 1.52Å | |
| N08 | C07 | sing | 1.39Å | 1.47Å | |
| N08 | C11 | sing | 1.47Å | 1.45Å | |
| C07 | N35 | doub | 1.33Å | 1.32Å | Aromatic |
| N37 | C36 | doub | 1.32Å | 1.35Å | Aromatic |
| C12 | C11 | sing | 1.53Å | 1.53Å | |
| N35 | C36 | sing | 1.32Å | 1.36Å | Aromatic |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C21 | H3 | sing | 1.09Å | 1.10Å | |
| C21 | H4 | sing | 1.09Å | 1.10Å | |
| C24 | H5 | sing | 1.09Å | 1.10Å | |
| C24 | H6 | sing | 1.09Å | 1.10Å | |
| C26 | H7 | sing | 1.09Å | 1.10Å | |
| C26 | H8 | sing | 1.09Å | 1.10Å | |
| C26 | H9 | sing | 1.09Å | 1.10Å | |
| C28 | H10 | sing | 1.09Å | 1.10Å | |
| C28 | H11 | sing | 1.09Å | 1.10Å | |
| C01 | H12 | sing | 1.09Å | 1.10Å | |
| C01 | H13 | sing | 1.09Å | 1.10Å | |
| C01 | H14 | sing | 1.09Å | 1.10Å | |
| C02 | H15 | sing | 1.09Å | 1.10Å | |
| C03 | H16 | sing | 1.09Å | 1.10Å | |
| C03 | H17 | sing | 1.09Å | 1.10Å | |
| C03 | H18 | sing | 1.09Å | 1.10Å | |
| C06 | H19 | sing | 1.08Å | 1.08Å | |
| C09 | H20 | sing | 1.09Å | 1.10Å | |
| C09 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C11 | H23 | sing | 1.09Å | 1.10Å | |
| C12 | H24 | sing | 1.09Å | 1.10Å | |
| C12 | H25 | sing | 1.09Å | 1.10Å | |
| C14 | H26 | sing | 1.09Å | 1.10Å | |
| C14 | H27 | sing | 1.09Å | 1.10Å | |
| C16 | H28 | sing | 1.09Å | 1.10Å | |
| C16 | H29 | sing | 1.09Å | 1.10Å | |
| C18 | H30 | sing | 1.08Å | 1.08Å | |
| C19 | H31 | sing | 1.08Å | 1.08Å | |
| C23 | H32 | sing | 1.09Å | 1.10Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å | |
| C27 | H34 | sing | 1.09Å | 1.10Å | |
| C27 | H35 | sing | 1.09Å | 1.10Å | |
| C27 | H36 | sing | 1.09Å | 1.10Å | |
| C29 | H37 | sing | 1.09Å | 1.10Å | |
| C29 | H38 | sing | 1.09Å | 1.10Å | |
| C30 | H39 | sing | 1.08Å | 1.08Å | |
| C31 | H40 | sing | 1.08Å | 1.08Å | |
| C36 | H41 | sing | 1.08Å | 1.08Å | |
| N04 | H42 | sing | 0.97Å | 1.00Å | |
| N32 | H44 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C23 | N22 | 116.2° | 109.5° |
| C23 | C24 | C25 | 111.9° | 109.3° |
| C23 | C24 | H5 | 108.9° | 109.5° |
| C23 | C24 | H6 | 108.9° | 109.6° |
| C24 | C23 | H32 | 107.8° | 109.5° |
| C24 | C23 | H33 | 107.8° | 109.5° |
| C23 | N22 | C21 | 108.8° | 111.0° |
| C23 | N22 | C29 | 112.4° | 111.2° |
| N22 | C23 | H32 | 107.8° | 109.4° |
| N22 | C23 | H33 | 107.8° | 109.4° |
| N22 | C21 | C20 | 110.2° | 109.4° |
| C21 | N22 | C29 | 110.5° | 111.0° |
| N22 | C21 | H3 | 109.3° | 109.5° |
| N22 | C21 | H4 | 109.3° | 109.5° |
| C21 | C20 | C19 | 121.0° | 119.9° |
| C21 | C20 | C30 | 119.0° | 120.0° |
| C20 | C21 | H3 | 109.3° | 109.5° |
| C20 | C21 | H4 | 109.3° | 109.5° |
| C24 | C25 | C26 | 110.9° | 109.5° |
| C24 | C25 | C28 | 108.6° | 109.1° |
| C24 | C25 | C27 | 111.0° | 109.5° |
| C25 | C24 | H5 | 108.9° | 109.5° |
| C25 | C24 | H6 | 108.9° | 109.5° |
| C26 | C25 | C28 | 109.2° | 109.5° |
| C26 | C25 | C27 | 108.7° | 109.5° |
| C25 | C26 | H7 | 109.5° | 109.4° |
| C25 | C26 | H8 | 109.5° | 109.5° |
| C25 | C26 | H9 | 109.5° | 109.5° |
| N22 | C29 | C28 | 115.4° | 109.5° |
| N22 | C29 | H37 | 108.0° | 109.5° |
| N22 | C29 | H38 | 108.0° | 109.5° |
| C19 | C20 | C30 | 120.0° | 120.1° |
| C20 | C19 | C18 | 120.6° | 120.1° |
| C20 | C19 | H31 | 119.7° | 120.0° |
| C20 | C30 | C31 | 119.7° | 120.1° |
| C20 | C30 | H39 | 120.2° | 119.9° |
| C19 | C18 | C17 | 118.8° | 119.9° |
| C19 | C18 | H30 | 120.6° | 120.1° |
| C18 | C19 | H31 | 119.7° | 119.9° |
| C01 | C02 | C03 | 108.6° | 109.4° |
| C01 | C02 | N04 | 109.6° | 109.5° |
| C02 | C01 | H12 | 109.5° | 109.5° |
| C02 | C01 | H13 | 109.5° | 109.5° |
| C02 | C01 | H14 | 109.5° | 109.5° |
| C01 | C02 | H15 | 108.2° | 109.5° |
| C29 | C28 | C25 | 110.2° | 109.3° |
| C29 | C28 | H10 | 109.3° | 109.5° |
| C29 | C28 | H11 | 109.3° | 109.6° |
| C28 | C29 | H37 | 108.0° | 109.4° |
| C28 | C29 | H38 | 107.9° | 109.5° |
| C30 | C31 | C17 | 119.7° | 119.9° |
| C31 | C30 | H39 | 120.2° | 120.0° |
| C30 | C31 | H40 | 120.1° | 120.1° |
| C28 | C25 | C27 | 108.3° | 109.6° |
| C25 | C28 | H10 | 109.3° | 109.5° |
| C25 | C28 | H11 | 109.3° | 109.5° |
| C25 | C27 | H34 | 109.5° | 109.5° |
| C25 | C27 | H35 | 109.5° | 109.4° |
| C25 | C27 | H36 | 109.5° | 109.5° |
| C18 | C17 | C31 | 121.2° | 119.8° |
| C18 | C17 | N15 | 119.4° | 120.1° |
| C17 | C18 | H30 | 120.6° | 120.0° |
| C31 | C17 | N15 | 119.4° | 120.1° |
| C17 | C31 | H40 | 120.1° | 120.0° |
| C03 | C02 | N04 | 113.2° | 109.5° |
| C03 | C02 | H15 | 108.2° | 109.5° |
| C02 | C03 | H16 | 109.5° | 109.5° |
| C02 | C03 | H17 | 109.5° | 109.5° |
| C02 | C03 | H18 | 109.5° | 109.5° |
| C02 | N04 | C05 | 123.5° | 120.0° |
| N04 | C02 | H15 | 109.0° | 109.5° |
| C02 | N04 | H42 | 105.9° | 119.9° |
| C17 | N15 | C16 | 117.5° | 111.0° |
| C17 | N15 | C14 | 115.0° | 111.0° |
| C16 | N15 | C14 | 116.4° | 110.1° |
| N15 | C16 | C33 | 110.3° | 110.0° |
| N15 | C16 | H28 | 109.3° | 109.4° |
| N15 | C16 | H29 | 109.3° | 109.3° |
| N15 | C14 | C13 | 110.8° | 108.7° |
| N15 | C14 | H26 | 109.2° | 109.6° |
| N15 | C14 | H27 | 109.2° | 109.7° |
| C16 | C33 | O34 | 117.2° | 118.6° |
| C16 | C33 | N32 | 122.5° | 122.8° |
| C33 | C16 | H28 | 109.2° | 109.4° |
| C33 | C16 | H29 | 109.3° | 109.4° |
| N04 | C05 | C06 | 122.3° | 120.5° |
| N04 | C05 | N37 | 117.7° | 120.5° |
| C05 | N04 | H42 | 105.9° | 120.1° |
| C09 | C10 | C13 | 114.6° | 109.3° |
| C10 | C09 | N08 | 108.7° | 109.5° |
| C09 | C10 | H1 | 108.2° | 109.5° |
| C09 | C10 | H2 | 108.2° | 109.5° |
| C10 | C09 | H20 | 109.7° | 109.5° |
| C10 | C09 | H21 | 109.7° | 109.4° |
| C10 | C13 | C14 | 96.7° | 109.3° |
| C10 | C13 | N32 | 104.7° | 109.6° |
| C10 | C13 | C12 | 114.6° | 109.1° |
| C13 | C10 | H1 | 108.2° | 109.5° |
| C13 | C10 | H2 | 108.2° | 109.6° |
| C09 | N08 | C07 | 122.6° | 111.0° |
| C09 | N08 | C11 | 117.7° | 111.2° |
| N08 | C09 | H20 | 109.7° | 109.4° |
| N08 | C09 | H21 | 109.7° | 109.5° |
| C05 | C06 | C07 | 119.4° | 118.2° |
| C06 | C05 | N37 | 120.0° | 119.1° |
| C05 | C06 | H19 | 120.3° | 120.9° |
| C06 | C07 | N08 | 122.7° | 120.5° |
| C06 | C07 | N35 | 119.8° | 119.0° |
| C07 | C06 | H19 | 120.3° | 120.9° |
| O34 | C33 | N32 | 120.3° | 118.6° |
| C33 | N32 | C13 | 124.2° | 122.9° |
| C33 | N32 | H44 | 117.9° | 118.5° |
| C14 | C13 | N32 | 112.5° | 109.9° |
| C14 | C13 | C12 | 125.7° | 109.3° |
| C13 | C14 | H26 | 109.1° | 109.6° |
| C13 | C14 | H27 | 109.1° | 109.7° |
| C05 | N37 | C36 | 120.2° | 120.9° |
| N32 | C13 | C12 | 101.3° | 109.6° |
| C13 | N32 | H44 | 117.9° | 118.5° |
| C13 | C12 | C11 | 113.1° | 109.3° |
| C13 | C12 | H24 | 108.6° | 109.6° |
| C13 | C12 | H25 | 108.5° | 109.5° |
| C07 | N08 | C11 | 118.1° | 111.0° |
| N08 | C07 | N35 | 117.5° | 120.5° |
| N08 | C11 | C12 | 111.8° | 109.6° |
| N08 | C11 | H22 | 108.9° | 109.5° |
| N08 | C11 | H23 | 108.9° | 109.5° |
| C07 | N35 | C36 | 120.7° | 120.9° |
| N37 | C36 | N35 | 119.8° | 121.9° |
| N37 | C36 | H41 | 120.1° | 119.0° |
| C12 | C11 | H22 | 108.9° | 109.4° |
| C12 | C11 | H23 | 108.9° | 109.5° |
| C11 | C12 | H24 | 108.5° | 109.5° |
| C11 | C12 | H25 | 108.6° | 109.5° |
| N35 | C36 | H41 | 120.1° | 119.1° |
| H1 | C10 | H2 | 109.5° | 109.5° |
| H3 | C21 | H4 | 109.5° | 109.5° |
| H5 | C24 | H6 | 109.5° | 109.5° |
| H7 | C26 | H8 | 109.5° | 109.5° |
| H7 | C26 | H9 | 109.4° | 109.5° |
| H8 | C26 | H9 | 109.5° | 109.5° |
| H10 | C28 | H11 | 109.5° | 109.5° |
| H12 | C01 | H13 | 109.5° | 109.4° |
| H12 | C01 | H14 | 109.5° | 109.5° |
| H13 | C01 | H14 | 109.5° | 109.5° |
| H16 | C03 | H17 | 109.4° | 109.5° |
| H16 | C03 | H18 | 109.5° | 109.4° |
| H17 | C03 | H18 | 109.5° | 109.4° |
| H20 | C09 | H21 | 109.4° | 109.5° |
| H22 | C11 | H23 | 109.5° | 109.5° |
| H24 | C12 | H25 | 109.5° | 109.5° |
| H26 | C14 | H27 | 109.5° | 109.6° |
| H28 | C16 | H29 | 109.5° | 109.4° |
| H32 | C23 | H33 | 109.4° | 109.5° |
| H34 | C27 | H35 | 109.4° | 109.5° |
| H34 | C27 | H36 | 109.5° | 109.5° |
| H35 | C27 | H36 | 109.5° | 109.4° |
| H37 | C29 | H38 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C23 | N22 | H32 | 121.0° | 120.0° |
| C24 | C23 | N22 | H33 | 121.0° | 120.0° |
| C24 | C23 | N22 | C21 | 179.8° | 174.1° |
| C23 | C24 | C25 | H5 | 120.4° | 120.0° |
| C23 | C24 | C25 | H6 | 120.4° | 120.0° |
| C23 | C24 | C25 | C26 | 73.5° | 62.2° |
| C24 | C23 | N22 | C29 | 57.4° | 61.7° |
| C23 | C24 | C25 | C28 | 46.6° | 57.7° |
| C23 | C24 | C25 | C27 | 165.5° | 177.6° |
| C23 | C24 | H5 | H6 | 118.9° | 120.1° |
| C24 | C23 | H32 | H33 | 117.0° | 120.0° |
| C23 | N22 | C21 | C29 | 123.9° | 124.2° |
| C23 | N22 | C21 | C20 | 177.7° | 170.0° |
| N22 | C23 | C24 | C25 | 53.8° | 59.2° |
| C23 | N22 | C29 | C28 | 56.3° | 61.7° |
| C23 | N22 | C21 | H3 | 57.6° | 70.0° |
| C23 | N22 | C21 | H4 | 62.2° | 50.0° |
| N22 | C23 | C24 | H5 | 174.2° | 179.1° |
| N22 | C23 | C24 | H6 | 66.5° | 60.8° |
| N22 | C23 | H32 | H33 | 116.9° | 119.9° |
| C23 | N22 | C29 | H37 | 177.1° | 58.3° |
| C23 | N22 | C29 | H38 | 64.6° | 178.3° |
| N22 | C21 | C20 | H3 | 120.1° | 120.0° |
| N22 | C21 | C20 | H4 | 120.1° | 120.0° |
| N22 | C21 | C20 | C19 | 102.3° | 90.0° |
| N22 | C21 | C20 | C30 | 77.7° | 89.7° |
| C21 | N22 | C29 | C28 | 178.1° | 174.2° |
| N22 | C21 | H3 | H4 | 119.6° | 120.0° |
| C21 | N22 | C23 | H32 | 58.8° | 54.1° |
| C21 | N22 | C23 | H33 | 59.2° | 65.8° |
| C21 | N22 | C29 | H37 | 61.1° | 65.8° |
| C21 | N22 | C29 | H38 | 57.2° | 54.2° |
| C20 | C21 | N22 | C29 | 58.4° | 65.8° |
| C21 | C20 | C19 | C30 | 180.0° | 179.8° |
| C21 | C20 | C19 | C18 | 178.9° | 180.0° |
| C21 | C20 | C30 | C31 | 179.1° | 180.0° |
| C20 | C21 | H3 | H4 | 119.7° | 120.0° |
| C21 | C20 | C19 | H31 | 1.1° | 0.1° |
| C21 | C20 | C30 | H39 | 0.9° | 0.3° |
| C24 | C25 | C26 | C28 | 119.7° | 119.7° |
| C24 | C25 | C26 | C27 | 122.3° | 120.2° |
| C24 | C25 | C28 | C29 | 45.2° | 57.6° |
| C24 | C25 | C28 | C27 | 120.6° | 120.0° |
| C25 | C24 | H5 | H6 | 118.9° | 120.0° |
| C24 | C25 | C26 | H7 | 180.0° | 60.0° |
| C24 | C25 | C26 | H8 | 60.0° | 180.0° |
| C24 | C25 | C26 | H9 | 60.0° | 59.9° |
| C24 | C25 | C28 | H10 | 74.9° | 177.6° |
| C24 | C25 | C28 | H11 | 165.3° | 62.4° |
| C25 | C24 | C23 | H32 | 174.8° | 179.2° |
| C25 | C24 | C23 | H33 | 67.1° | 60.8° |
| C24 | C25 | C27 | H34 | 180.0° | 60.0° |
| C24 | C25 | C27 | H35 | 60.0° | 180.0° |
| C24 | C25 | C27 | H36 | 60.0° | 60.0° |
| C26 | C25 | C28 | C29 | 75.9° | 62.3° |
| C26 | C25 | C28 | C27 | 118.2° | 120.2° |
| C26 | C25 | C24 | H5 | 46.8° | 57.7° |
| C26 | C25 | C24 | H6 | 166.1° | 177.7° |
| C25 | C26 | H7 | H8 | 120.0° | 120.0° |
| C25 | C26 | H7 | H9 | 120.0° | 120.0° |
| C25 | C26 | H8 | H9 | 120.0° | 120.0° |
| C26 | C25 | C28 | H10 | 163.9° | 57.7° |
| C26 | C25 | C28 | H11 | 44.2° | 177.7° |
| C26 | C25 | C27 | H34 | 57.7° | 179.9° |
| C26 | C25 | C27 | H35 | 62.3° | 59.8° |
| C26 | C25 | C27 | H36 | 177.8° | 60.1° |
| N22 | C29 | C28 | H37 | 120.9° | 120.0° |
| N22 | C29 | C28 | H38 | 120.8° | 120.0° |
| N22 | C29 | C28 | C25 | 51.7° | 59.2° |
| C29 | N22 | C21 | H3 | 178.6° | 54.2° |
| C29 | N22 | C21 | H4 | 61.7° | 174.2° |
| N22 | C29 | C28 | H10 | 68.4° | 179.2° |
| N22 | C29 | C28 | H11 | 171.8° | 60.8° |
| C29 | N22 | C23 | H32 | 178.4° | 178.2° |
| C29 | N22 | C23 | H33 | 63.6° | 58.3° |
| N22 | C29 | H37 | H38 | 117.3° | 120.0° |
| C20 | C19 | C18 | H31 | 180.0° | 179.9° |
| C19 | C20 | C30 | C31 | 0.9° | 0.3° |
| C20 | C19 | C18 | C17 | 0.9° | 0.0° |
| C19 | C20 | C21 | H3 | 137.6° | 150.0° |
| C19 | C20 | C21 | H4 | 17.8° | 30.0° |
| C20 | C19 | C18 | H30 | 179.1° | 180.0° |
| C19 | C20 | C30 | H39 | 179.1° | 179.9° |
| C30 | C20 | C19 | C18 | 1.1° | 0.2° |
| C20 | C30 | C31 | H39 | 180.0° | 179.7° |
| C20 | C30 | C31 | C17 | 0.5° | 0.0° |
| C30 | C20 | C21 | H3 | 42.4° | 30.2° |
| C30 | C20 | C21 | H4 | 162.2° | 150.3° |
| C30 | C20 | C19 | H31 | 178.9° | 179.7° |
| C20 | C30 | C31 | H40 | 179.5° | 179.9° |
| C19 | C18 | C17 | H30 | 180.0° | 179.9° |
| C19 | C18 | C17 | C31 | 0.5° | 0.3° |
| C19 | C18 | C17 | N15 | 179.9° | 180.0° |
| C01 | C02 | C03 | N04 | 121.9° | 120.0° |
| C01 | C02 | C03 | H15 | 117.2° | 120.0° |
| C01 | C02 | N04 | H15 | 118.2° | 120.0° |
| C01 | C02 | N04 | C05 | 170.6° | 155.0° |
| C02 | C01 | H12 | H13 | 120.0° | 119.9° |
| C02 | C01 | H12 | H14 | 120.0° | 120.0° |
| C02 | C01 | H13 | H14 | 120.0° | 120.0° |
| C01 | C02 | C03 | H16 | 180.0° | 180.0° |
| C01 | C02 | C03 | H17 | 60.0° | 60.0° |
| C01 | C02 | C03 | H18 | 60.0° | 60.0° |
| C01 | C02 | N04 | H42 | 48.7° | 25.0° |
| C29 | C28 | C25 | H10 | 120.1° | 119.9° |
| C29 | C28 | C25 | H11 | 120.1° | 120.0° |
| C29 | C28 | C25 | C27 | 165.8° | 177.6° |
| C29 | C28 | H10 | H11 | 119.7° | 120.1° |
| C28 | C29 | H37 | H38 | 117.3° | 119.9° |
| C30 | C31 | C17 | C18 | 0.3° | 0.2° |
| C30 | C31 | C17 | H40 | 180.0° | 179.9° |
| C30 | C31 | C17 | N15 | 179.7° | 179.9° |
| C28 | C25 | C24 | H5 | 166.9° | 177.6° |
| C28 | C25 | C24 | H6 | 73.8° | 62.4° |
| C28 | C25 | C26 | H7 | 60.3° | 179.7° |
| C28 | C25 | C26 | H8 | 59.7° | 60.3° |
| C28 | C25 | C26 | H9 | 179.7° | 59.7° |
| C25 | C28 | H10 | H11 | 119.7° | 120.1° |
| C28 | C25 | C27 | H34 | 60.9° | 59.7° |
| C28 | C25 | C27 | H35 | 179.2° | 60.3° |
| C28 | C25 | C27 | H36 | 59.2° | 179.8° |
| C25 | C28 | C29 | H37 | 172.5° | 60.9° |
| C25 | C28 | C29 | H38 | 69.2° | 179.2° |
| C27 | C25 | C24 | H5 | 74.1° | 62.4° |
| C27 | C25 | C24 | H6 | 45.2° | 57.6° |
| C27 | C25 | C26 | H7 | 57.7° | 60.1° |
| C27 | C25 | C26 | H8 | 177.7° | 59.9° |
| C27 | C25 | C26 | H9 | 62.3° | 179.9° |
| C27 | C25 | C28 | H10 | 45.7° | 62.5° |
| C27 | C25 | C28 | H11 | 74.1° | 57.6° |
| C25 | C27 | H34 | H35 | 120.0° | 120.0° |
| C25 | C27 | H34 | H36 | 120.0° | 120.0° |
| C25 | C27 | H35 | H36 | 120.0° | 119.9° |
| C18 | C17 | C31 | N15 | 179.4° | 179.7° |
| C18 | C17 | N15 | C16 | 7.2° | 56.1° |
| C18 | C17 | N15 | C14 | 149.9° | 178.9° |
| C17 | C18 | C19 | H31 | 179.1° | 180.0° |
| C18 | C17 | C31 | H40 | 179.7° | 179.7° |
| C31 | C17 | N15 | C16 | 172.2° | 124.2° |
| C31 | C17 | N15 | C14 | 29.5° | 1.4° |
| C31 | C17 | C18 | H30 | 179.5° | 179.8° |
| C17 | C31 | C30 | H39 | 179.5° | 179.7° |
| C03 | C02 | N04 | H15 | 120.4° | 120.0° |
| C03 | C02 | N04 | C05 | 68.0° | 85.0° |
| C03 | C02 | C01 | H12 | 180.0° | 60.0° |
| C03 | C02 | C01 | H13 | 60.0° | 180.0° |
| C03 | C02 | C01 | H14 | 60.0° | 60.0° |
| C02 | C03 | H16 | H17 | 120.0° | 120.1° |
| C02 | C03 | H16 | H18 | 120.0° | 120.0° |
| C02 | C03 | H17 | H18 | 120.0° | 120.0° |
| C03 | C02 | N04 | H42 | 170.1° | 95.0° |
| C02 | N04 | C05 | H42 | 122.0° | 180.0° |
| C02 | N04 | C05 | C06 | 19.2° | 0.2° |
| C02 | N04 | C05 | N37 | 161.1° | 180.0° |
| N04 | C02 | C01 | H12 | 55.9° | 180.0° |
| N04 | C02 | C01 | H13 | 175.9° | 60.0° |
| N04 | C02 | C01 | H14 | 64.1° | 60.0° |
| N04 | C02 | C03 | H16 | 58.1° | 60.0° |
| N04 | C02 | C03 | H17 | 61.9° | 180.0° |
| N04 | C02 | C03 | H18 | 178.1° | 60.0° |
| C17 | N15 | C16 | C14 | 142.2° | 123.3° |
| C17 | N15 | C16 | C33 | 176.6° | 173.5° |
| C17 | N15 | C14 | C13 | 159.2° | 167.5° |
| C17 | N15 | C14 | H26 | 80.7° | 47.8° |
| C17 | N15 | C14 | H27 | 39.0° | 72.5° |
| C17 | N15 | C16 | H28 | 56.4° | 53.3° |
| C17 | N15 | C16 | H29 | 63.3° | 66.4° |
| N15 | C17 | C18 | H30 | 0.1° | 0.1° |
| N15 | C17 | C31 | H40 | 0.3° | 0.0° |
| N15 | C16 | C33 | H28 | 120.1° | 120.2° |
| N15 | C16 | C33 | H29 | 120.1° | 120.0° |
| N15 | C16 | C33 | O34 | 167.9° | 162.9° |
| N15 | C16 | C33 | N32 | 12.0° | 17.1° |
| C16 | N15 | C14 | C13 | 57.8° | 69.1° |
| C16 | N15 | C14 | H26 | 62.4° | 171.1° |
| C16 | N15 | C14 | H27 | 178.0° | 50.8° |
| N15 | C16 | H28 | H29 | 119.6° | 119.7° |
| C14 | N15 | C16 | C33 | 41.3° | 50.2° |
| N15 | C14 | C13 | C10 | 67.4° | 69.7° |
| N15 | C14 | C13 | H26 | 120.2° | 119.7° |
| N15 | C14 | C13 | H27 | 120.2° | 119.9° |
| N15 | C14 | C13 | N32 | 41.7° | 50.6° |
| N15 | C14 | C13 | C12 | 165.7° | 170.9° |
| N15 | C14 | H26 | H27 | 119.4° | 120.4° |
| C14 | N15 | C16 | H28 | 161.4° | 70.0° |
| C14 | N15 | C16 | H29 | 78.9° | 170.3° |
| C16 | C33 | O34 | N32 | 179.9° | 180.0° |
| C16 | C33 | N32 | C13 | 0.1° | 1.8° |
| C33 | C16 | H28 | H29 | 119.6° | 119.8° |
| C16 | C33 | N32 | H44 | 180.0° | 178.2° |
| N04 | C05 | C06 | N37 | 179.8° | 179.8° |
| N04 | C05 | C06 | C07 | 179.9° | 179.8° |
| N04 | C05 | N37 | C36 | 179.2° | 179.7° |
| C05 | N04 | C02 | H15 | 52.4° | 35.0° |
| N04 | C05 | C06 | H19 | 0.1° | 0.2° |
| C09 | C10 | C13 | H1 | 120.7° | 119.9° |
| C09 | C10 | C13 | H2 | 120.8° | 119.9° |
| C10 | C09 | N08 | H20 | 119.9° | 120.0° |
| C10 | C09 | N08 | H21 | 119.9° | 120.0° |
| C09 | C10 | C13 | C14 | 177.3° | 177.3° |
| C09 | C10 | C13 | N32 | 67.2° | 62.2° |
| C09 | C10 | C13 | C12 | 42.9° | 57.8° |
| C10 | C09 | N08 | C07 | 137.9° | 174.2° |
| C10 | C09 | N08 | C11 | 56.4° | 61.7° |
| C09 | C10 | H1 | H2 | 117.7° | 120.1° |
| C10 | C09 | H20 | H21 | 120.3° | 120.0° |
| C13 | C10 | C09 | N08 | 47.6° | 59.2° |
| C10 | C13 | N32 | C33 | 88.7° | 101.7° |
| C10 | C13 | C14 | N32 | 109.1° | 120.3° |
| C10 | C13 | C14 | C12 | 126.9° | 119.4° |
| C10 | C13 | N32 | C12 | 119.4° | 119.7° |
| C10 | C13 | C12 | C11 | 40.9° | 57.7° |
| C13 | C10 | H1 | H2 | 117.7° | 120.2° |
| C13 | C10 | C09 | H20 | 167.5° | 179.2° |
| C13 | C10 | C09 | H21 | 72.3° | 60.8° |
| C10 | C13 | C12 | H24 | 161.5° | 177.7° |
| C10 | C13 | C12 | H25 | 79.6° | 62.2° |
| C10 | C13 | C14 | H26 | 172.4° | 50.0° |
| C10 | C13 | C14 | H27 | 52.8° | 170.3° |
| C10 | C13 | N32 | H44 | 91.4° | 78.3° |
| C09 | N08 | C07 | C06 | 11.8° | 180.0° |
| C09 | N08 | C07 | C11 | 165.7° | 124.2° |
| C09 | N08 | C07 | N35 | 169.4° | 0.0° |
| C09 | N08 | C11 | C12 | 56.6° | 61.7° |
| N08 | C09 | C10 | H1 | 168.3° | 60.7° |
| N08 | C09 | C10 | H2 | 73.2° | 179.2° |
| N08 | C09 | H20 | H21 | 120.4° | 120.0° |
| C09 | N08 | C11 | H22 | 176.9° | 58.3° |
| C09 | N08 | C11 | H23 | 63.8° | 178.3° |
| C05 | C06 | C07 | H19 | 180.0° | 180.0° |
| C05 | C06 | C07 | N08 | 179.5° | 180.0° |
| C05 | C06 | C07 | N35 | 0.7° | 0.0° |
| C06 | C05 | N37 | C36 | 1.1° | 0.1° |
| C06 | C05 | N04 | H42 | 102.8° | 179.8° |
| C07 | C06 | C05 | N37 | 0.3° | 0.1° |
| C06 | C07 | N08 | N35 | 178.8° | 180.0° |
| C06 | C07 | N08 | C11 | 153.9° | 55.8° |
| C06 | C07 | N35 | C36 | 0.9° | 0.0° |
| O34 | C33 | N32 | C13 | 179.9° | 178.3° |
| O34 | C33 | C16 | H28 | 47.8° | 76.9° |
| O34 | C33 | C16 | H29 | 72.0° | 42.9° |
| O34 | C33 | N32 | H44 | 0.1° | 1.8° |
| C33 | N32 | C13 | C14 | 15.2° | 18.4° |
| C33 | N32 | C13 | H44 | 180.0° | 180.0° |
| C33 | N32 | C13 | C12 | 151.9° | 138.6° |
| N32 | C33 | C16 | H28 | 132.1° | 103.1° |
| N32 | C33 | C16 | H29 | 108.2° | 137.1° |
| C14 | C13 | N32 | C12 | 136.7° | 120.1° |
| C14 | C13 | C12 | C11 | 160.1° | 177.2° |
| C14 | C13 | C10 | H1 | 61.9° | 57.4° |
| C14 | C13 | C10 | H2 | 56.6° | 62.8° |
| C14 | C13 | C12 | H24 | 79.3° | 62.8° |
| C14 | C13 | C12 | H25 | 39.6° | 57.3° |
| C13 | C14 | H26 | H27 | 119.4° | 120.4° |
| C14 | C13 | N32 | H44 | 164.7° | 161.5° |
| C05 | N37 | C36 | N35 | 0.9° | 0.1° |
| N37 | C05 | C06 | H19 | 179.7° | 180.0° |
| C05 | N37 | C36 | H41 | 179.1° | 180.0° |
| N37 | C05 | N04 | H42 | 77.0° | 0.0° |
| N32 | C13 | C12 | C11 | 71.2° | 62.2° |
| N32 | C13 | C10 | H1 | 53.5° | 177.9° |
| N32 | C13 | C10 | H2 | 172.1° | 57.7° |
| N32 | C13 | C12 | H24 | 49.3° | 57.7° |
| N32 | C13 | C12 | H25 | 168.3° | 177.8° |
| N32 | C13 | C14 | H26 | 78.6° | 170.3° |
| N32 | C13 | C14 | H27 | 161.9° | 69.4° |
| C13 | C12 | C11 | N08 | 45.8° | 59.2° |
| C13 | C12 | C11 | H24 | 120.5° | 120.0° |
| C13 | C12 | C11 | H25 | 120.5° | 119.9° |
| C12 | C13 | C10 | H1 | 163.6° | 62.1° |
| C12 | C13 | C10 | H2 | 77.9° | 177.7° |
| C13 | C12 | C11 | H22 | 166.2° | 60.8° |
| C13 | C12 | C11 | H23 | 74.5° | 179.2° |
| C13 | C12 | H24 | H25 | 118.3° | 120.1° |
| C12 | C13 | C14 | H26 | 45.5° | 69.4° |
| C12 | C13 | C14 | H27 | 74.1° | 50.9° |
| C12 | C13 | N32 | H44 | 28.0° | 41.4° |
| C07 | N08 | C11 | C12 | 137.0° | 174.2° |
| N08 | C07 | N35 | C36 | 179.7° | 180.0° |
| N08 | C07 | C06 | H19 | 0.5° | 0.0° |
| C07 | N08 | C09 | H20 | 18.0° | 54.2° |
| C07 | N08 | C09 | H21 | 102.2° | 65.8° |
| C07 | N08 | C11 | H22 | 16.7° | 65.8° |
| C07 | N08 | C11 | H23 | 102.6° | 54.2° |
| C11 | N08 | C07 | N35 | 24.9° | 124.2° |
| N08 | C11 | C12 | H22 | 120.4° | 120.0° |
| N08 | C11 | C12 | H23 | 120.3° | 120.0° |
| C11 | N08 | C09 | H20 | 176.3° | 178.3° |
| C11 | N08 | C09 | H21 | 63.5° | 58.3° |
| N08 | C11 | H22 | H23 | 118.9° | 120.0° |
| N08 | C11 | C12 | H24 | 166.4° | 179.2° |
| N08 | C11 | C12 | H25 | 74.7° | 60.7° |
| C07 | N35 | C36 | N37 | 0.1° | 0.1° |
| N35 | C07 | C06 | H19 | 179.3° | 180.0° |
| C07 | N35 | C36 | H41 | 179.9° | 179.9° |
| N37 | C36 | N35 | H41 | 180.0° | 179.9° |
| C12 | C11 | H22 | H23 | 119.0° | 120.0° |
| C11 | C12 | H24 | H25 | 118.3° | 120.1° |
| H1 | C10 | C09 | H20 | 71.8° | 59.3° |
| H1 | C10 | C09 | H21 | 48.4° | 179.3° |
| H2 | C10 | C09 | H20 | 46.7° | 60.8° |
| H2 | C10 | C09 | H21 | 166.9° | 59.2° |
| H5 | C24 | C23 | H32 | 64.8° | 60.9° |
| H5 | C24 | C23 | H33 | 53.2° | 59.1° |
| H6 | C24 | C23 | H32 | 54.5° | 59.2° |
| H6 | C24 | C23 | H33 | 172.5° | 179.2° |
| H7 | C26 | H8 | H9 | 120.0° | 120.0° |
| H10 | C28 | C29 | H37 | 52.4° | 59.1° |
| H10 | C28 | C29 | H38 | 170.7° | 60.8° |
| H11 | C28 | C29 | H37 | 67.3° | 179.2° |
| H11 | C28 | C29 | H38 | 51.0° | 59.2° |
| H12 | C01 | H13 | H14 | 120.0° | 120.0° |
| H12 | C01 | C02 | H15 | 62.9° | 59.9° |
| H13 | C01 | C02 | H15 | 57.2° | 60.0° |
| H14 | C01 | C02 | H15 | 177.1° | 180.0° |
| H15 | C02 | C03 | H16 | 62.9° | 60.0° |
| H15 | C02 | C03 | H17 | 177.2° | 60.0° |
| H15 | C02 | C03 | H18 | 57.2° | 180.0° |
| H15 | C02 | N04 | H42 | 69.5° | 145.0° |
| H16 | C03 | H17 | H18 | 120.0° | 119.9° |
| H22 | C11 | C12 | H24 | 73.3° | 59.2° |
| H22 | C11 | C12 | H25 | 45.7° | 179.2° |
| H23 | C11 | C12 | H24 | 46.0° | 60.8° |
| H23 | C11 | C12 | H25 | 165.0° | 59.3° |
| H30 | C18 | C19 | H31 | 0.9° | 0.1° |
| H34 | C27 | H35 | H36 | 120.0° | 120.0° |
| H39 | C30 | C31 | H40 | 0.5° | 0.4° |
