9UA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | C13 | sing | 1.54Å | 1.54Å | |
| C14 | O15 | sing | 1.44Å | 1.45Å | |
| C13 | C12 | sing | 1.55Å | 1.54Å | |
| O15 | C16 | sing | 1.44Å | 1.44Å | |
| C12 | C16 | sing | 1.55Å | 1.54Å | |
| C12 | N11 | sing | 1.46Å | 1.47Å | |
| C6 | C5 | sing | 1.53Å | 1.51Å | |
| C6 | C7 | sing | 1.51Å | 1.50Å | |
| N11 | C7 | sing | 1.34Å | 1.34Å | Aromatic |
| N11 | N10 | sing | 1.40Å | 1.40Å | Aromatic |
| C5 | N4 | sing | 1.47Å | 1.46Å | |
| C7 | C8 | doub | 1.36Å | 1.37Å | Aromatic |
| N10 | C9 | doub | 1.31Å | 1.33Å | Aromatic |
| O3 | C2 | doub | 1.21Å | 1.23Å | |
| F34 | C33 | sing | 1.40Å | 1.39Å | |
| C8 | C9 | sing | 1.40Å | 1.41Å | Aromatic |
| C8 | C36 | sing | 1.51Å | 1.54Å | |
| N4 | C2 | sing | 1.35Å | 1.35Å | |
| N4 | C36 | sing | 1.47Å | 1.48Å | |
| C9 | N17 | sing | 1.40Å | 1.40Å | |
| C2 | C1 | sing | 1.51Å | 1.52Å | |
| C33 | F35 | sing | 1.40Å | 1.40Å | |
| C33 | C24 | sing | 1.51Å | 1.52Å | |
| C23 | C24 | doub | 1.38Å | 1.37Å | Aromatic |
| C23 | C22 | sing | 1.39Å | 1.39Å | Aromatic |
| N17 | C22 | sing | 1.40Å | 1.40Å | |
| N17 | C18 | sing | 1.47Å | 1.48Å | |
| C24 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| C22 | C21 | doub | 1.39Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| C25 | C27 | sing | 1.49Å | 1.49Å | |
| C25 | C26 | doub | 1.39Å | 1.40Å | Aromatic |
| C21 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C21 | C20 | sing | 1.51Å | 1.51Å | |
| C27 | C28 | sing | 1.41Å | 1.42Å | Aromatic |
| C27 | C31 | doub | 1.36Å | 1.37Å | Aromatic |
| C28 | N29 | doub | 1.31Å | 1.31Å | Aromatic |
| C31 | N30 | sing | 1.35Å | 1.36Å | Aromatic |
| N29 | N30 | sing | 1.40Å | 1.39Å | Aromatic |
| N30 | C32 | sing | 1.47Å | 1.46Å | |
| C14 | H1 | sing | 1.09Å | 1.10Å | |
| C14 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C1 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.08Å | 1.08Å | |
| C26 | H22 | sing | 1.08Å | 1.08Å | |
| C28 | H23 | sing | 1.08Å | 1.08Å | |
| C31 | H24 | sing | 1.08Å | 1.08Å | |
| C32 | H25 | sing | 1.09Å | 1.10Å | |
| C32 | H26 | sing | 1.09Å | 1.10Å | |
| C32 | H27 | sing | 1.09Å | 1.10Å | |
| C33 | H28 | sing | 1.09Å | 1.10Å | |
| C36 | H29 | sing | 1.09Å | 1.10Å | |
| C36 | H30 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C14 | O15 | 104.6° | 107.3° |
| C14 | C13 | C12 | 102.7° | 104.2° |
| C13 | C14 | H1 | 110.7° | 109.8° |
| C13 | C14 | H2 | 110.7° | 109.9° |
| C14 | C13 | H8 | 111.2° | 110.5° |
| C14 | C13 | H9 | 111.2° | 110.5° |
| C14 | O15 | C16 | 103.8° | 107.0° |
| O15 | C14 | H1 | 110.7° | 109.9° |
| O15 | C14 | H2 | 110.7° | 109.9° |
| C13 | C12 | C16 | 104.7° | 102.1° |
| C13 | C12 | N11 | 108.9° | 110.9° |
| C13 | C12 | H7 | 110.7° | 110.9° |
| C12 | C13 | H8 | 111.2° | 110.4° |
| C12 | C13 | H9 | 111.1° | 110.5° |
| O15 | C16 | C12 | 105.4° | 103.5° |
| O15 | C16 | H13 | 110.5° | 110.6° |
| O15 | C16 | H14 | 110.5° | 110.8° |
| C16 | C12 | N11 | 109.9° | 110.9° |
| C16 | C12 | H7 | 110.7° | 110.9° |
| C12 | C16 | H13 | 110.5° | 110.6° |
| C12 | C16 | H14 | 110.5° | 110.6° |
| C12 | N11 | C7 | 127.1° | 126.0° |
| C12 | N11 | N10 | 124.0° | 126.0° |
| N11 | C12 | H7 | 111.7° | 110.8° |
| C5 | C6 | C7 | 109.4° | 108.8° |
| C6 | C5 | N4 | 111.3° | 109.2° |
| C6 | C5 | H3 | 109.0° | 109.5° |
| C6 | C5 | H4 | 109.0° | 109.6° |
| C5 | C6 | H5 | 109.5° | 109.6° |
| C5 | C6 | H6 | 109.5° | 109.6° |
| C6 | C7 | N11 | 126.2° | 127.7° |
| C6 | C7 | C8 | 124.7° | 124.5° |
| C7 | C6 | H5 | 109.5° | 109.6° |
| C7 | C6 | H6 | 109.5° | 109.5° |
| C7 | N11 | N10 | 108.8° | 108.0° |
| N11 | C7 | C8 | 109.1° | 107.8° |
| N11 | N10 | C9 | 106.6° | 108.2° |
| C5 | N4 | C2 | 117.9° | 120.8° |
| C5 | N4 | C36 | 119.4° | 118.4° |
| N4 | C5 | H3 | 109.0° | 109.6° |
| N4 | C5 | H4 | 109.0° | 109.5° |
| C7 | C8 | C9 | 105.6° | 108.1° |
| C7 | C8 | C36 | 123.8° | 123.9° |
| N10 | C9 | C8 | 109.8° | 107.9° |
| N10 | C9 | N17 | 121.0° | 126.1° |
| O3 | C2 | N4 | 120.7° | 120.0° |
| O3 | C2 | C1 | 119.0° | 120.0° |
| F34 | C33 | F35 | 105.8° | 109.4° |
| F34 | C33 | C24 | 108.3° | 109.5° |
| F34 | C33 | H28 | 111.7° | 109.5° |
| C9 | C8 | C36 | 130.7° | 128.0° |
| C8 | C9 | N17 | 129.2° | 126.0° |
| C8 | C36 | N4 | 105.6° | 107.2° |
| C8 | C36 | H29 | 110.4° | 109.9° |
| C8 | C36 | H30 | 110.4° | 110.0° |
| C2 | N4 | C36 | 122.7° | 120.8° |
| N4 | C2 | C1 | 120.3° | 120.0° |
| N4 | C36 | H29 | 110.5° | 109.9° |
| N4 | C36 | H30 | 110.4° | 110.0° |
| C9 | N17 | C22 | 121.1° | 120.5° |
| C9 | N17 | C18 | 118.9° | 120.5° |
| C2 | C1 | H10 | 109.5° | 109.5° |
| C2 | C1 | H11 | 109.5° | 109.5° |
| C2 | C1 | H12 | 109.4° | 109.4° |
| F35 | C33 | C24 | 109.4° | 109.5° |
| F35 | C33 | H28 | 111.6° | 109.5° |
| C33 | C24 | C23 | 118.6° | 120.1° |
| C33 | C24 | C25 | 121.4° | 120.2° |
| C24 | C33 | H28 | 109.9° | 109.4° |
| C24 | C23 | C22 | 122.7° | 120.2° |
| C23 | C24 | C25 | 120.0° | 119.8° |
| C24 | C23 | H21 | 118.7° | 119.9° |
| C23 | C22 | N17 | 120.6° | 119.0° |
| C23 | C22 | C21 | 117.6° | 120.2° |
| C22 | C23 | H21 | 118.6° | 119.9° |
| C22 | N17 | C18 | 120.0° | 119.0° |
| N17 | C22 | C21 | 121.8° | 120.7° |
| N17 | C18 | C19 | 108.7° | 107.8° |
| N17 | C18 | H15 | 109.7° | 109.8° |
| N17 | C18 | H16 | 109.7° | 109.8° |
| C24 | C25 | C27 | 122.3° | 120.0° |
| C24 | C25 | C26 | 118.2° | 120.0° |
| C22 | C21 | C26 | 120.0° | 119.7° |
| C22 | C21 | C20 | 120.4° | 121.5° |
| C18 | C19 | C20 | 110.7° | 108.9° |
| C19 | C18 | H15 | 109.7° | 109.8° |
| C19 | C18 | H16 | 109.7° | 109.8° |
| C18 | C19 | H17 | 109.1° | 109.6° |
| C18 | C19 | H18 | 109.2° | 109.6° |
| C19 | C20 | C21 | 111.0° | 110.5° |
| C20 | C19 | H17 | 109.2° | 109.6° |
| C20 | C19 | H18 | 109.2° | 109.5° |
| C19 | C20 | H19 | 109.1° | 109.3° |
| C19 | C20 | H20 | 109.1° | 109.3° |
| C27 | C25 | C26 | 119.3° | 120.0° |
| C25 | C27 | C28 | 131.6° | 126.2° |
| C25 | C27 | C31 | 123.3° | 126.2° |
| C25 | C26 | C21 | 121.4° | 120.2° |
| C25 | C26 | H22 | 119.3° | 119.9° |
| C26 | C21 | C20 | 119.6° | 118.8° |
| C21 | C26 | H22 | 119.3° | 119.9° |
| C21 | C20 | H19 | 109.1° | 109.2° |
| C21 | C20 | H20 | 109.1° | 109.3° |
| C28 | C27 | C31 | 105.0° | 107.5° |
| C27 | C28 | N29 | 110.1° | 108.1° |
| C27 | C28 | H23 | 125.0° | 125.9° |
| C27 | C31 | N30 | 108.8° | 107.6° |
| C27 | C31 | H24 | 125.6° | 126.1° |
| C28 | N29 | N30 | 107.7° | 108.5° |
| N29 | C28 | H23 | 124.9° | 126.0° |
| C31 | N30 | N29 | 108.4° | 108.2° |
| C31 | N30 | C32 | 126.1° | 125.9° |
| N30 | C31 | H24 | 125.6° | 126.3° |
| N29 | N30 | C32 | 125.5° | 125.9° |
| N30 | C32 | H25 | 109.5° | 109.5° |
| N30 | C32 | H26 | 109.5° | 109.5° |
| N30 | C32 | H27 | 109.5° | 109.5° |
| H1 | C14 | H2 | 109.5° | 110.0° |
| H3 | C5 | H4 | 109.5° | 109.5° |
| H5 | C6 | H6 | 109.5° | 109.8° |
| H8 | C13 | H9 | 109.4° | 110.5° |
| H10 | C1 | H11 | 109.5° | 109.5° |
| H10 | C1 | H12 | 109.5° | 109.5° |
| H11 | C1 | H12 | 109.5° | 109.4° |
| H13 | C16 | H14 | 109.5° | 110.6° |
| H15 | C18 | H16 | 109.5° | 109.8° |
| H17 | C19 | H18 | 109.5° | 109.6° |
| H19 | C20 | H20 | 109.5° | 109.3° |
| H25 | C32 | H26 | 109.4° | 109.5° |
| H25 | C32 | H27 | 109.4° | 109.5° |
| H26 | C32 | H27 | 109.5° | 109.4° |
| H29 | C36 | H30 | 109.5° | 109.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C14 | O15 | H1 | 119.2° | 119.4° |
| C13 | C14 | O15 | H2 | 119.2° | 119.5° |
| C14 | C13 | C12 | H8 | 118.9° | 118.7° |
| C14 | C13 | C12 | H9 | 118.9° | 118.7° |
| C13 | C14 | O15 | C16 | 43.8° | 26.5° |
| C14 | C13 | C12 | C16 | 4.9° | 20.8° |
| C14 | C13 | C12 | N11 | 122.4° | 139.1° |
| C13 | C14 | H1 | H2 | 122.3° | 121.1° |
| C14 | C13 | C12 | H7 | 114.4° | 97.3° |
| C14 | C13 | H8 | H9 | 123.2° | 122.7° |
| O15 | C14 | C13 | C12 | 29.2° | 2.1° |
| C14 | O15 | C16 | C12 | 40.4° | 40.1° |
| O15 | C14 | H1 | H2 | 122.3° | 121.1° |
| O15 | C14 | C13 | H8 | 89.7° | 120.7° |
| O15 | C14 | C13 | H9 | 148.1° | 116.6° |
| C14 | O15 | C16 | H13 | 78.9° | 78.4° |
| C14 | O15 | C16 | H14 | 159.8° | 158.6° |
| C13 | C12 | C16 | O15 | 21.2° | 37.0° |
| C13 | C12 | C16 | N11 | 116.8° | 118.2° |
| C13 | C12 | C16 | H7 | 119.3° | 118.2° |
| C13 | C12 | N11 | H7 | 122.6° | 123.7° |
| C13 | C12 | N11 | C7 | 109.8° | 125.9° |
| C13 | C12 | N11 | N10 | 68.4° | 54.2° |
| C12 | C13 | C14 | H1 | 90.0° | 121.5° |
| C12 | C13 | C14 | H2 | 148.4° | 117.4° |
| C12 | C13 | H8 | H9 | 123.1° | 122.6° |
| C13 | C12 | C16 | H13 | 98.2° | 81.5° |
| C13 | C12 | C16 | H14 | 140.5° | 155.7° |
| O15 | C16 | C12 | H13 | 119.3° | 118.5° |
| O15 | C16 | C12 | H14 | 119.3° | 118.7° |
| O15 | C16 | C12 | N11 | 95.7° | 155.2° |
| C16 | O15 | C14 | H1 | 75.4° | 145.9° |
| C16 | O15 | C14 | H2 | 163.0° | 92.9° |
| O15 | C16 | C12 | H7 | 140.5° | 81.2° |
| O15 | C16 | H13 | H14 | 121.9° | 123.0° |
| C16 | C12 | N11 | H7 | 123.3° | 123.6° |
| C16 | C12 | N11 | C7 | 136.0° | 121.4° |
| C16 | C12 | N11 | N10 | 45.7° | 58.6° |
| C16 | C12 | C13 | H8 | 114.0° | 97.8° |
| C16 | C12 | C13 | H9 | 123.8° | 139.6° |
| C12 | C16 | H13 | H14 | 121.9° | 122.9° |
| C12 | N11 | C7 | C6 | 2.1° | 0.3° |
| C12 | N11 | C7 | N10 | 178.5° | 180.0° |
| C12 | N11 | C7 | C8 | 179.7° | 179.8° |
| C12 | N11 | N10 | C9 | 179.9° | 179.9° |
| N11 | C12 | C13 | H8 | 3.4° | 20.4° |
| N11 | C12 | C13 | H9 | 118.7° | 102.2° |
| N11 | C12 | C16 | H13 | 145.0° | 36.7° |
| N11 | C12 | C16 | H14 | 23.7° | 86.1° |
| C5 | C6 | C7 | H5 | 120.0° | 119.8° |
| C5 | C6 | C7 | H6 | 120.0° | 119.8° |
| C5 | C6 | C7 | N11 | 165.2° | 162.1° |
| C6 | C5 | N4 | H3 | 120.3° | 120.0° |
| C6 | C5 | N4 | H4 | 120.3° | 120.0° |
| C5 | C6 | C7 | C8 | 16.8° | 18.0° |
| C6 | C5 | N4 | C2 | 117.0° | 115.5° |
| C6 | C5 | N4 | C36 | 63.0° | 64.5° |
| C6 | C5 | H3 | H4 | 119.1° | 120.2° |
| C5 | C6 | H5 | H6 | 120.1° | 120.4° |
| C6 | C7 | N11 | C8 | 178.2° | 180.0° |
| C6 | C7 | N11 | N10 | 179.4° | 179.7° |
| C7 | C6 | C5 | N4 | 43.2° | 45.4° |
| C6 | C7 | C8 | C9 | 178.6° | 179.7° |
| C6 | C7 | C8 | C36 | 1.8° | 0.5° |
| C7 | C6 | C5 | H3 | 77.1° | 165.3° |
| C7 | C6 | C5 | H4 | 163.4° | 74.5° |
| C7 | C6 | H5 | H6 | 120.0° | 120.3° |
| C7 | N11 | N10 | C9 | 1.6° | 0.1° |
| N11 | C7 | C8 | C9 | 0.4° | 0.3° |
| N11 | C7 | C8 | C36 | 179.9° | 179.6° |
| N11 | C7 | C6 | H5 | 74.8° | 42.3° |
| N11 | C7 | C6 | H6 | 45.2° | 78.1° |
| C7 | N11 | C12 | H7 | 12.7° | 2.2° |
| N10 | N11 | C7 | C8 | 1.3° | 0.2° |
| N11 | N10 | C9 | C8 | 1.3° | 0.1° |
| N11 | N10 | C9 | N17 | 178.8° | 180.0° |
| N10 | N11 | C12 | H7 | 169.0° | 177.8° |
| C5 | N4 | C2 | O3 | 3.0° | 5.1° |
| C5 | N4 | C36 | C8 | 43.8° | 44.2° |
| C5 | N4 | C2 | C36 | 179.9° | 180.0° |
| C5 | N4 | C2 | C1 | 176.6° | 174.9° |
| N4 | C5 | H3 | H4 | 119.2° | 120.1° |
| N4 | C5 | C6 | H5 | 76.8° | 165.1° |
| N4 | C5 | C6 | H6 | 163.1° | 74.4° |
| C5 | N4 | C36 | H29 | 163.1° | 75.2° |
| C5 | N4 | C36 | H30 | 75.6° | 163.7° |
| C7 | C8 | C9 | N10 | 0.6° | 0.2° |
| C7 | C8 | C9 | C36 | 179.5° | 179.8° |
| C7 | C8 | C36 | N4 | 12.8° | 11.2° |
| C7 | C8 | C9 | N17 | 179.6° | 179.8° |
| C8 | C7 | C6 | H5 | 103.2° | 137.8° |
| C8 | C7 | C6 | H6 | 136.8° | 101.8° |
| C7 | C8 | C36 | H29 | 132.2° | 108.2° |
| C7 | C8 | C36 | H30 | 106.6° | 130.8° |
| N10 | C9 | C8 | N17 | 179.8° | 180.0° |
| N10 | C9 | C8 | C36 | 178.9° | 179.6° |
| N10 | C9 | N17 | C22 | 50.1° | 85.4° |
| N10 | C9 | N17 | C18 | 132.3° | 94.5° |
| O3 | C2 | N4 | C1 | 179.6° | 180.0° |
| O3 | C2 | N4 | C36 | 177.0° | 175.0° |
| O3 | C2 | C1 | H10 | 0.0° | 174.7° |
| O3 | C2 | C1 | H11 | 120.0° | 54.6° |
| O3 | C2 | C1 | H12 | 120.0° | 65.3° |
| F34 | C33 | F35 | C24 | 116.5° | 120.0° |
| F34 | C33 | F35 | H28 | 121.7° | 120.0° |
| F34 | C33 | C24 | H28 | 122.2° | 120.0° |
| F34 | C33 | C24 | C23 | 13.4° | 140.6° |
| F34 | C33 | C24 | C25 | 167.4° | 39.3° |
| C9 | C8 | C36 | N4 | 167.8° | 169.0° |
| C8 | C9 | N17 | C22 | 130.1° | 94.6° |
| C8 | C9 | N17 | C18 | 47.5° | 85.5° |
| C9 | C8 | C36 | H29 | 48.4° | 71.6° |
| C9 | C8 | C36 | H30 | 72.8° | 49.4° |
| C8 | C36 | N4 | C2 | 136.3° | 135.8° |
| C8 | C36 | N4 | H29 | 119.4° | 119.4° |
| C8 | C36 | N4 | H30 | 119.4° | 119.6° |
| C36 | C8 | C9 | N17 | 0.9° | 0.3° |
| C8 | C36 | H29 | H30 | 121.8° | 121.1° |
| C2 | N4 | C5 | H3 | 122.7° | 4.5° |
| C2 | N4 | C5 | H4 | 3.2° | 124.5° |
| N4 | C2 | C1 | H10 | 179.6° | 5.3° |
| N4 | C2 | C1 | H11 | 60.4° | 125.4° |
| N4 | C2 | C1 | H12 | 59.6° | 114.7° |
| C2 | N4 | C36 | H29 | 16.9° | 104.8° |
| C2 | N4 | C36 | H30 | 104.3° | 16.2° |
| C36 | N4 | C2 | C1 | 3.4° | 5.1° |
| C36 | N4 | C5 | H3 | 57.2° | 175.6° |
| C36 | N4 | C5 | H4 | 176.7° | 55.5° |
| N4 | C36 | H29 | H30 | 121.8° | 121.1° |
| C9 | N17 | C22 | C23 | 7.2° | 13.4° |
| C9 | N17 | C22 | C18 | 177.5° | 179.9° |
| C9 | N17 | C22 | C21 | 172.4° | 166.3° |
| C9 | N17 | C18 | C19 | 144.3° | 135.3° |
| C9 | N17 | C18 | H15 | 24.4° | 105.2° |
| C9 | N17 | C18 | H16 | 95.8° | 15.6° |
| C2 | C1 | H10 | H11 | 120.0° | 120.0° |
| C2 | C1 | H10 | H12 | 120.0° | 119.9° |
| C2 | C1 | H11 | H12 | 120.0° | 119.9° |
| F35 | C33 | C24 | H28 | 122.8° | 120.0° |
| F35 | C33 | C24 | C23 | 101.5° | 20.6° |
| F35 | C33 | C24 | C25 | 77.6° | 159.3° |
| C33 | C24 | C23 | C25 | 179.2° | 179.9° |
| C33 | C24 | C23 | C22 | 179.5° | 179.9° |
| C33 | C24 | C25 | C27 | 2.8° | 0.2° |
| C33 | C24 | C25 | C26 | 178.7° | 179.9° |
| C33 | C24 | C23 | H21 | 0.5° | 0.1° |
| C24 | C23 | C22 | H21 | 180.0° | 180.0° |
| C24 | C23 | C22 | N17 | 179.3° | 179.6° |
| C24 | C23 | C22 | C21 | 0.3° | 0.1° |
| C23 | C24 | C25 | C27 | 178.1° | 179.9° |
| C23 | C24 | C25 | C26 | 2.2° | 0.0° |
| C23 | C24 | C33 | H28 | 135.7° | 99.4° |
| C23 | C22 | N17 | C21 | 179.6° | 179.7° |
| C23 | C22 | N17 | C18 | 170.3° | 166.6° |
| C22 | C23 | C24 | C25 | 1.4° | 0.0° |
| C23 | C22 | C21 | C26 | 0.1° | 0.1° |
| C23 | C22 | C21 | C20 | 178.6° | 179.6° |
| C22 | N17 | C18 | C19 | 38.1° | 44.8° |
| N17 | C22 | C21 | C26 | 179.5° | 179.5° |
| N17 | C22 | C21 | C20 | 1.8° | 0.7° |
| C22 | N17 | C18 | H15 | 158.0° | 74.8° |
| C22 | N17 | C18 | H16 | 81.8° | 164.4° |
| N17 | C22 | C23 | H21 | 0.7° | 0.4° |
| C18 | N17 | C22 | C21 | 10.1° | 13.7° |
| N17 | C18 | C19 | H15 | 119.9° | 119.5° |
| N17 | C18 | C19 | H16 | 119.9° | 119.6° |
| N17 | C18 | C19 | C20 | 58.6° | 63.2° |
| N17 | C18 | H15 | H16 | 120.4° | 120.8° |
| N17 | C18 | C19 | H17 | 61.6° | 56.6° |
| N17 | C18 | C19 | H18 | 178.8° | 177.0° |
| C24 | C25 | C27 | C26 | 175.8° | 180.0° |
| C24 | C25 | C26 | C21 | 2.1° | 0.0° |
| C24 | C25 | C27 | C28 | 40.5° | 55.4° |
| C24 | C25 | C27 | C31 | 135.0° | 125.0° |
| C25 | C24 | C23 | H21 | 178.6° | 180.0° |
| C24 | C25 | C26 | H22 | 178.0° | 180.0° |
| C25 | C24 | C33 | H28 | 45.2° | 80.7° |
| C22 | C21 | C20 | C19 | 23.2° | 20.8° |
| C22 | C21 | C26 | C25 | 1.0° | 0.1° |
| C22 | C21 | C26 | C20 | 178.7° | 179.8° |
| C22 | C21 | C20 | H19 | 143.4° | 141.0° |
| C22 | C21 | C20 | H20 | 97.0° | 99.5° |
| C21 | C22 | C23 | H21 | 179.7° | 179.9° |
| C22 | C21 | C26 | H22 | 179.0° | 179.9° |
| C18 | C19 | C20 | H17 | 120.2° | 119.8° |
| C18 | C19 | C20 | H18 | 120.2° | 119.9° |
| C18 | C19 | C20 | C21 | 51.5° | 51.4° |
| C19 | C18 | H15 | H16 | 120.4° | 120.9° |
| C18 | C19 | H17 | H18 | 119.4° | 120.4° |
| C18 | C19 | C20 | H19 | 171.8° | 171.6° |
| C18 | C19 | C20 | H20 | 68.7° | 68.9° |
| C19 | C20 | C21 | C26 | 158.1° | 159.5° |
| C19 | C20 | C21 | H19 | 120.2° | 120.2° |
| C19 | C20 | C21 | H20 | 120.2° | 120.3° |
| C20 | C19 | C18 | H15 | 178.4° | 56.3° |
| C20 | C19 | C18 | H16 | 61.3° | 177.1° |
| C20 | C19 | H17 | H18 | 119.4° | 120.3° |
| C19 | C20 | H19 | H20 | 119.3° | 119.5° |
| C27 | C25 | C26 | C21 | 178.1° | 179.9° |
| C25 | C27 | C28 | C31 | 176.1° | 179.7° |
| C25 | C27 | C28 | N29 | 177.0° | 180.0° |
| C25 | C27 | C31 | N30 | 178.2° | 179.9° |
| C27 | C25 | C26 | H22 | 2.0° | 0.0° |
| C25 | C27 | C28 | H23 | 3.0° | 0.1° |
| C25 | C27 | C31 | H24 | 1.8° | 0.0° |
| C25 | C26 | C21 | H22 | 180.0° | 180.0° |
| C25 | C26 | C21 | C20 | 177.7° | 179.7° |
| C26 | C25 | C27 | C28 | 143.6° | 124.6° |
| C26 | C25 | C27 | C31 | 40.9° | 55.1° |
| C26 | C21 | C20 | H19 | 37.9° | 39.3° |
| C26 | C21 | C20 | H20 | 81.6° | 80.2° |
| C21 | C20 | C19 | H17 | 68.6° | 68.5° |
| C21 | C20 | C19 | H18 | 171.7° | 171.2° |
| C21 | C20 | H19 | H20 | 119.3° | 119.5° |
| C20 | C21 | C26 | H22 | 2.3° | 0.3° |
| C27 | C28 | N29 | H23 | 180.0° | 179.9° |
| C28 | C27 | C31 | N30 | 1.6° | 0.2° |
| C27 | C28 | N29 | N30 | 0.2° | 0.2° |
| C28 | C27 | C31 | H24 | 178.4° | 179.7° |
| C31 | C27 | C28 | N29 | 0.9° | 0.2° |
| C27 | C31 | N30 | H24 | 180.0° | 179.9° |
| C27 | C31 | N30 | N29 | 1.8° | 0.1° |
| C27 | C31 | N30 | C32 | 179.2° | 180.0° |
| C31 | C27 | C28 | H23 | 179.1° | 179.8° |
| C28 | N29 | N30 | C31 | 1.2° | 0.0° |
| C28 | N29 | N30 | C32 | 179.8° | 179.9° |
| C31 | N30 | N29 | C32 | 179.0° | 179.9° |
| C31 | N30 | C32 | H25 | 178.8° | 90.0° |
| C31 | N30 | C32 | H26 | 58.9° | 150.0° |
| C31 | N30 | C32 | H27 | 61.2° | 30.0° |
| N30 | N29 | C28 | H23 | 179.8° | 179.9° |
| N29 | N30 | C31 | H24 | 178.2° | 179.8° |
| N29 | N30 | C32 | H25 | 0.0° | 90.1° |
| N29 | N30 | C32 | H26 | 120.0° | 29.9° |
| N29 | N30 | C32 | H27 | 120.0° | 149.9° |
| C32 | N30 | C31 | H24 | 0.8° | 0.1° |
| N30 | C32 | H25 | H26 | 120.0° | 120.1° |
| N30 | C32 | H25 | H27 | 120.0° | 120.0° |
| N30 | C32 | H26 | H27 | 120.0° | 120.0° |
| H1 | C14 | C13 | H8 | 151.0° | 119.9° |
| H1 | C14 | C13 | H9 | 28.9° | 2.8° |
| H2 | C14 | C13 | H8 | 29.5° | 1.2° |
| H2 | C14 | C13 | H9 | 92.7° | 123.9° |
| H3 | C5 | C6 | H5 | 162.9° | 74.9° |
| H3 | C5 | C6 | H6 | 42.9° | 45.6° |
| H4 | C5 | C6 | H5 | 43.4° | 45.2° |
| H4 | C5 | C6 | H6 | 76.6° | 165.7° |
| H7 | C12 | C13 | H8 | 126.6° | 144.0° |
| H7 | C12 | C13 | H9 | 4.5° | 21.4° |
| H7 | C12 | C16 | H13 | 21.1° | 160.3° |
| H7 | C12 | C16 | H14 | 100.2° | 37.4° |
| H10 | C1 | H11 | H12 | 120.0° | 120.0° |
| H15 | C18 | C19 | H17 | 58.2° | 176.1° |
| H15 | C18 | C19 | H18 | 61.4° | 63.5° |
| H16 | C18 | C19 | H17 | 178.5° | 63.1° |
| H16 | C18 | C19 | H18 | 58.9° | 57.3° |
| H17 | C19 | C20 | H19 | 51.6° | 51.7° |
| H17 | C19 | C20 | H20 | 171.1° | 171.3° |
| H18 | C19 | C20 | H19 | 68.0° | 68.6° |
| H18 | C19 | C20 | H20 | 51.5° | 50.9° |
| H25 | C32 | H26 | H27 | 120.0° | 119.9° |
