UJ1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | N2 | doub | 1.32Å | 1.34Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| N2 | C15 | sing | 1.32Å | 1.34Å | Aromatic |
| C17 | C18 | doub | 1.39Å | 1.38Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | C3 | sing | 1.51Å | 1.52Å | |
| C | C1 | sing | 1.53Å | 1.49Å | |
| O1 | C4 | doub | 1.21Å | 1.23Å | |
| O | C2 | doub | 1.21Å | 1.22Å | |
| C3 | C4 | sing | 1.51Å | 1.54Å | |
| C3 | N | sing | 1.47Å | 1.48Å | |
| C2 | C1 | sing | 1.51Å | 1.50Å | |
| C2 | N | sing | 1.35Å | 1.40Å | |
| C4 | N1 | sing | 1.35Å | 1.35Å | |
| N | C19 | sing | 1.40Å | 1.41Å | |
| C13 | C12 | sing | 1.51Å | 1.51Å | |
| C25 | C22 | sing | 1.53Å | 1.53Å | |
| C20 | C19 | sing | 1.40Å | 1.37Å | Aromatic |
| C20 | C21 | doub | 1.35Å | 1.41Å | Aromatic |
| C12 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C5 | sing | 1.39Å | 1.40Å | Aromatic |
| C19 | N4 | doub | 1.31Å | 1.34Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| N1 | C5 | sing | 1.40Å | 1.42Å | |
| C5 | C6 | doub | 1.39Å | 1.41Å | Aromatic |
| C21 | C22 | sing | 1.51Å | 1.52Å | |
| C21 | N3 | sing | 1.35Å | 1.33Å | Aromatic |
| C10 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C22 | C24 | sing | 1.53Å | 1.53Å | |
| C6 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.51Å | 1.51Å | |
| N4 | N3 | sing | 1.40Å | 1.36Å | Aromatic |
| C7 | C8 | sing | 1.53Å | 1.53Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N3 | H2 | sing | 0.97Å | 1.00Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.08Å | 1.08Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C15 | H12 | sing | 1.08Å | 1.08Å | |
| C17 | H13 | sing | 1.08Å | 1.08Å | |
| C20 | H14 | sing | 1.08Å | 1.08Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C3 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.08Å | 1.08Å | |
| C16 | H20 | sing | 1.08Å | 1.08Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C1 | H27 | sing | 1.09Å | 1.10Å | |
| C1 | H28 | sing | 1.09Å | 1.10Å | |
| C | H29 | sing | 1.09Å | 1.10Å | |
| C | H30 | sing | 1.09Å | 1.10Å | |
| C | H31 | sing | 1.09Å | 1.10Å | |
| C11 | H32 | sing | 1.08Å | 1.08Å | |
| C9 | H33 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C16 | C17 | 123.3° | 120.8° |
| C16 | N2 | C15 | 117.2° | 121.7° |
| N2 | C16 | H20 | 118.3° | 119.6° |
| C16 | C17 | C18 | 118.2° | 119.2° |
| C16 | C17 | H13 | 120.9° | 120.4° |
| C17 | C16 | H20 | 118.3° | 119.6° |
| N2 | C15 | C14 | 124.3° | 120.8° |
| N2 | C15 | H12 | 117.8° | 119.5° |
| C17 | C18 | C14 | 120.1° | 118.4° |
| C18 | C17 | H13 | 120.9° | 120.4° |
| C17 | C18 | H19 | 120.0° | 120.8° |
| C15 | C14 | C18 | 116.9° | 119.2° |
| C15 | C14 | C3 | 121.7° | 120.4° |
| C14 | C15 | H12 | 117.9° | 119.7° |
| C18 | C14 | C3 | 120.8° | 120.4° |
| C14 | C18 | H19 | 120.0° | 120.8° |
| C14 | C3 | C4 | 111.7° | 109.4° |
| C14 | C3 | N | 117.2° | 109.4° |
| C14 | C3 | H18 | 103.8° | 109.5° |
| C | C1 | C2 | 110.2° | 109.5° |
| C | C1 | H27 | 109.3° | 109.5° |
| C | C1 | H28 | 109.3° | 109.5° |
| C1 | C | H29 | 109.5° | 109.4° |
| C1 | C | H30 | 109.5° | 109.5° |
| C1 | C | H31 | 109.5° | 109.4° |
| O1 | C4 | C3 | 120.9° | 120.0° |
| O1 | C4 | N1 | 124.7° | 120.0° |
| O | C2 | C1 | 121.8° | 120.0° |
| O | C2 | N | 118.7° | 120.0° |
| C4 | C3 | N | 114.5° | 109.5° |
| C3 | C4 | N1 | 114.4° | 120.0° |
| C4 | C3 | H18 | 103.6° | 109.5° |
| C3 | N | C2 | 121.8° | 120.0° |
| C3 | N | C19 | 117.0° | 120.0° |
| N | C3 | H18 | 104.1° | 109.5° |
| C1 | C2 | N | 119.4° | 120.0° |
| C2 | C1 | H27 | 109.3° | 109.5° |
| C2 | C1 | H28 | 109.3° | 109.5° |
| C2 | N | C19 | 121.1° | 120.0° |
| C4 | N1 | C5 | 123.0° | 120.0° |
| C4 | N1 | H1 | 118.5° | 120.0° |
| N | C19 | C20 | 131.6° | 125.9° |
| N | C19 | N4 | 120.7° | 126.0° |
| C13 | C12 | C11 | 120.4° | 120.0° |
| C13 | C12 | C5 | 121.6° | 120.0° |
| C12 | C13 | H9 | 109.5° | 109.5° |
| C12 | C13 | H10 | 109.5° | 109.5° |
| C12 | C13 | H11 | 109.5° | 109.5° |
| C25 | C22 | C21 | 109.8° | 109.5° |
| C25 | C22 | C23 | 109.4° | 109.5° |
| C25 | C22 | C24 | 109.5° | 109.4° |
| C22 | C25 | H21 | 109.5° | 109.5° |
| C22 | C25 | H22 | 109.5° | 109.4° |
| C22 | C25 | H23 | 109.5° | 109.5° |
| C19 | C20 | C21 | 104.6° | 107.8° |
| C20 | C19 | N4 | 107.6° | 108.1° |
| C19 | C20 | H14 | 127.7° | 126.1° |
| C20 | C21 | C22 | 128.8° | 126.1° |
| C20 | C21 | N3 | 111.2° | 107.9° |
| C21 | C20 | H14 | 127.7° | 126.0° |
| C11 | C12 | C5 | 117.9° | 120.0° |
| C12 | C11 | C10 | 121.3° | 120.1° |
| C12 | C11 | H32 | 119.4° | 120.0° |
| C12 | C5 | N1 | 118.7° | 120.1° |
| C12 | C5 | C6 | 121.7° | 119.9° |
| C19 | N4 | N3 | 111.9° | 108.2° |
| C11 | C10 | C9 | 120.1° | 120.1° |
| C11 | C10 | H8 | 119.9° | 120.0° |
| C10 | C11 | H32 | 119.3° | 119.9° |
| N1 | C5 | C6 | 119.5° | 120.1° |
| C5 | N1 | H1 | 118.5° | 120.0° |
| C5 | C6 | C9 | 118.2° | 119.9° |
| C5 | C6 | C7 | 122.2° | 120.1° |
| C22 | C21 | N3 | 120.0° | 126.1° |
| C21 | C22 | C23 | 110.1° | 109.4° |
| C21 | C22 | C24 | 110.1° | 109.5° |
| C21 | N3 | N4 | 104.7° | 108.0° |
| C21 | N3 | H2 | 127.7° | 125.9° |
| C10 | C9 | C6 | 120.8° | 120.1° |
| C9 | C10 | H8 | 120.0° | 119.9° |
| C10 | C9 | H33 | 119.6° | 119.9° |
| C23 | C22 | C24 | 107.9° | 109.5° |
| C22 | C23 | H24 | 109.5° | 109.5° |
| C22 | C23 | H25 | 109.5° | 109.5° |
| C22 | C23 | H26 | 109.4° | 109.5° |
| C22 | C24 | H15 | 109.5° | 109.5° |
| C22 | C24 | H16 | 109.4° | 109.5° |
| C22 | C24 | H17 | 109.5° | 109.5° |
| C9 | C6 | C7 | 119.6° | 120.0° |
| C6 | C9 | H33 | 119.6° | 120.0° |
| C6 | C7 | C8 | 115.9° | 109.5° |
| C6 | C7 | H3 | 107.9° | 109.5° |
| C6 | C7 | H4 | 107.9° | 109.5° |
| N4 | N3 | H2 | 127.7° | 126.0° |
| C8 | C7 | H3 | 107.8° | 109.4° |
| C8 | C7 | H4 | 107.8° | 109.5° |
| C7 | C8 | H5 | 109.5° | 109.5° |
| C7 | C8 | H6 | 109.5° | 109.5° |
| C7 | C8 | H7 | 109.5° | 109.4° |
| H3 | C7 | H4 | 109.5° | 109.4° |
| H5 | C8 | H6 | 109.4° | 109.5° |
| H5 | C8 | H7 | 109.5° | 109.5° |
| H6 | C8 | H7 | 109.5° | 109.5° |
| H9 | C13 | H10 | 109.5° | 109.5° |
| H9 | C13 | H11 | 109.5° | 109.4° |
| H10 | C13 | H11 | 109.5° | 109.4° |
| H15 | C24 | H16 | 109.5° | 109.5° |
| H15 | C24 | H17 | 109.5° | 109.4° |
| H16 | C24 | H17 | 109.5° | 109.4° |
| H21 | C25 | H22 | 109.5° | 109.5° |
| H21 | C25 | H23 | 109.4° | 109.5° |
| H22 | C25 | H23 | 109.5° | 109.4° |
| H24 | C23 | H25 | 109.4° | 109.5° |
| H24 | C23 | H26 | 109.5° | 109.5° |
| H25 | C23 | H26 | 109.5° | 109.4° |
| H27 | C1 | H28 | 109.5° | 109.4° |
| H29 | C | H30 | 109.5° | 109.5° |
| H29 | C | H31 | 109.5° | 109.5° |
| H30 | C | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C16 | C17 | H20 | 180.0° | 179.5° |
| N2 | C16 | C17 | C18 | 0.9° | 0.7° |
| C16 | N2 | C15 | C14 | 0.9° | 0.0° |
| C16 | N2 | C15 | H12 | 179.1° | 179.7° |
| N2 | C16 | C17 | H13 | 179.1° | 179.7° |
| C17 | C16 | N2 | C15 | 0.9° | 0.5° |
| C16 | C17 | C18 | H13 | 180.0° | 179.6° |
| C16 | C17 | C18 | C14 | 0.8° | 0.5° |
| C16 | C17 | C18 | H19 | 179.2° | 179.5° |
| N2 | C15 | C14 | H12 | 180.0° | 179.7° |
| N2 | C15 | C14 | C18 | 2.4° | 0.3° |
| N2 | C15 | C14 | C3 | 168.5° | 179.7° |
| C15 | N2 | C16 | H20 | 179.2° | 180.0° |
| C17 | C18 | C14 | C15 | 2.3° | 0.0° |
| C17 | C18 | C14 | H19 | 180.0° | 180.0° |
| C17 | C18 | C14 | C3 | 168.8° | 180.0° |
| C18 | C17 | C16 | H20 | 179.1° | 179.8° |
| C15 | C14 | C18 | C3 | 171.0° | 180.0° |
| C15 | C14 | C3 | C4 | 78.2° | 173.5° |
| C15 | C14 | C3 | N | 56.7° | 53.6° |
| C15 | C14 | C3 | H18 | 170.9° | 66.4° |
| C15 | C14 | C18 | H19 | 177.7° | 180.0° |
| C18 | C14 | C3 | C4 | 92.4° | 6.5° |
| C18 | C14 | C3 | N | 132.7° | 126.4° |
| C18 | C14 | C15 | H12 | 177.6° | 180.0° |
| C14 | C18 | C17 | H13 | 179.2° | 180.0° |
| C18 | C14 | C3 | H18 | 18.5° | 113.6° |
| C14 | C3 | C4 | O1 | 65.2° | 120.0° |
| C14 | C3 | C4 | N | 136.2° | 119.9° |
| C14 | C3 | C4 | H18 | 111.1° | 120.0° |
| C14 | C3 | N | H18 | 113.9° | 120.0° |
| C14 | C3 | N | C2 | 42.9° | 54.4° |
| C14 | C3 | C4 | N1 | 111.5° | 60.1° |
| C14 | C3 | N | C19 | 141.6° | 125.6° |
| C3 | C14 | C15 | H12 | 11.5° | 0.0° |
| C3 | C14 | C18 | H19 | 11.3° | 0.0° |
| C | C1 | C2 | O | 51.6° | 0.0° |
| C | C1 | C2 | H27 | 120.1° | 120.0° |
| C | C1 | C2 | H28 | 120.1° | 120.0° |
| C | C1 | C2 | N | 126.0° | 180.0° |
| C | C1 | H27 | H28 | 119.6° | 120.0° |
| C1 | C | H29 | H30 | 120.0° | 120.0° |
| C1 | C | H29 | H31 | 120.0° | 120.0° |
| C1 | C | H30 | H31 | 120.0° | 120.0° |
| O1 | C4 | C3 | N1 | 176.7° | 179.9° |
| O1 | C4 | C3 | N | 71.0° | 0.1° |
| O1 | C4 | N1 | C5 | 11.0° | 4.5° |
| O1 | C4 | N1 | H1 | 169.0° | 175.8° |
| O1 | C4 | C3 | H18 | 176.3° | 120.0° |
| O | C2 | N | C3 | 13.5° | 4.8° |
| O | C2 | C1 | N | 177.6° | 180.0° |
| O | C2 | N | C19 | 161.8° | 175.2° |
| O | C2 | C1 | H27 | 68.5° | 120.0° |
| O | C2 | C1 | H28 | 171.7° | 120.0° |
| C4 | C3 | N | H18 | 112.4° | 120.1° |
| C4 | C3 | N | C2 | 176.6° | 65.5° |
| C4 | C3 | N | C19 | 7.9° | 114.5° |
| C3 | C4 | N1 | C5 | 165.5° | 175.6° |
| C3 | C4 | N1 | H1 | 14.4° | 4.1° |
| C3 | N | C2 | C1 | 164.1° | 175.1° |
| C3 | N | C2 | C19 | 175.3° | 180.0° |
| N | C3 | C4 | N1 | 112.3° | 180.0° |
| C3 | N | C19 | C20 | 91.0° | 5.0° |
| C3 | N | C19 | N4 | 85.0° | 175.0° |
| C1 | C2 | N | C19 | 20.6° | 4.9° |
| C2 | C1 | H27 | H28 | 119.7° | 120.0° |
| C2 | C1 | C | H29 | 180.0° | 60.0° |
| C2 | C1 | C | H30 | 60.0° | 180.0° |
| C2 | C1 | C | H31 | 60.0° | 60.0° |
| C2 | N | C19 | C20 | 93.5° | 175.0° |
| C2 | N | C19 | N4 | 90.5° | 5.0° |
| C2 | N | C3 | H18 | 71.0° | 174.4° |
| N | C2 | C1 | H27 | 113.9° | 60.0° |
| N | C2 | C1 | H28 | 5.9° | 60.0° |
| C4 | N1 | C5 | C12 | 100.4° | 47.6° |
| C4 | N1 | C5 | H1 | 180.0° | 179.7° |
| C4 | N1 | C5 | C6 | 78.1° | 132.2° |
| N1 | C4 | C3 | H18 | 0.4° | 59.9° |
| N | C19 | C20 | N4 | 176.4° | 180.0° |
| N | C19 | C20 | C21 | 175.9° | 180.0° |
| N | C19 | N4 | N3 | 176.1° | 179.8° |
| N | C19 | C20 | H14 | 4.1° | 0.0° |
| C19 | N | C3 | H18 | 104.5° | 5.6° |
| C13 | C12 | C11 | C5 | 177.3° | 180.0° |
| C13 | C12 | C11 | C10 | 175.4° | 180.0° |
| C13 | C12 | C5 | N1 | 5.7° | 0.0° |
| C13 | C12 | C5 | C6 | 175.9° | 179.8° |
| C12 | C13 | H9 | H10 | 120.0° | 120.1° |
| C12 | C13 | H9 | H11 | 120.0° | 120.0° |
| C12 | C13 | H10 | H11 | 120.0° | 120.0° |
| C13 | C12 | C11 | H32 | 4.6° | 0.1° |
| C25 | C22 | C21 | C20 | 3.5° | 60.0° |
| C25 | C22 | C21 | C23 | 120.5° | 120.0° |
| C25 | C22 | C21 | C24 | 120.6° | 120.0° |
| C25 | C22 | C21 | N3 | 176.0° | 120.0° |
| C25 | C22 | C23 | C24 | 119.1° | 120.0° |
| C25 | C22 | C24 | H15 | 180.0° | 60.0° |
| C25 | C22 | C24 | H16 | 60.0° | 60.1° |
| C25 | C22 | C24 | H17 | 60.0° | 180.0° |
| C22 | C25 | H21 | H22 | 120.0° | 120.0° |
| C22 | C25 | H21 | H23 | 120.0° | 120.1° |
| C22 | C25 | H22 | H23 | 120.0° | 120.0° |
| C25 | C22 | C23 | H24 | 180.0° | 180.0° |
| C25 | C22 | C23 | H25 | 60.0° | 60.0° |
| C25 | C22 | C23 | H26 | 60.0° | 60.0° |
| C19 | C20 | C21 | H14 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 179.6° | 179.8° |
| C19 | C20 | C21 | N3 | 0.1° | 0.1° |
| C20 | C19 | N4 | N3 | 0.7° | 0.2° |
| C21 | C20 | C19 | N4 | 0.5° | 0.0° |
| C20 | C21 | C22 | N3 | 179.5° | 180.0° |
| C20 | C21 | C22 | C23 | 117.1° | 60.0° |
| C20 | C21 | C22 | C24 | 124.1° | 179.9° |
| C20 | C21 | N3 | N4 | 0.3° | 0.3° |
| C20 | C21 | N3 | H2 | 179.7° | 179.9° |
| C12 | C11 | C10 | H32 | 180.0° | 180.0° |
| C11 | C12 | C5 | N1 | 177.0° | 180.0° |
| C11 | C12 | C5 | C6 | 1.4° | 0.3° |
| C12 | C11 | C10 | C9 | 1.0° | 0.3° |
| C12 | C11 | C10 | H8 | 179.0° | 179.9° |
| C11 | C12 | C13 | H9 | 91.4° | 83.0° |
| C11 | C12 | C13 | H10 | 148.6° | 156.9° |
| C11 | C12 | C13 | H11 | 28.6° | 37.0° |
| C5 | C12 | C11 | C10 | 1.9° | 0.0° |
| C12 | C5 | N1 | C6 | 178.4° | 179.7° |
| C12 | C5 | C6 | C9 | 0.0° | 0.2° |
| C12 | C5 | C6 | C7 | 179.0° | 179.7° |
| C12 | C5 | N1 | H1 | 79.6° | 132.1° |
| C5 | C12 | C13 | H9 | 91.4° | 97.0° |
| C5 | C12 | C13 | H10 | 28.6° | 23.1° |
| C5 | C12 | C13 | H11 | 148.6° | 143.0° |
| C5 | C12 | C11 | H32 | 178.1° | 180.0° |
| C19 | N4 | N3 | C21 | 0.7° | 0.3° |
| C19 | N4 | N3 | H2 | 179.4° | 180.0° |
| N4 | C19 | C20 | H14 | 179.6° | 180.0° |
| C11 | C10 | C9 | H8 | 180.0° | 179.7° |
| C11 | C10 | C9 | C6 | 0.5° | 0.3° |
| C11 | C10 | C9 | H33 | 179.5° | 179.7° |
| N1 | C5 | C6 | C9 | 178.4° | 180.0° |
| N1 | C5 | C6 | C7 | 0.6° | 0.1° |
| C5 | C6 | C9 | C10 | 1.0° | 0.0° |
| C5 | C6 | C9 | C7 | 179.0° | 179.9° |
| C5 | C6 | C7 | C8 | 69.3° | 85.0° |
| C6 | C5 | N1 | H1 | 102.0° | 48.1° |
| C5 | C6 | C7 | H3 | 51.7° | 155.0° |
| C5 | C6 | C7 | H4 | 169.8° | 35.1° |
| C5 | C6 | C9 | H33 | 179.0° | 180.0° |
| C21 | C22 | C23 | C24 | 120.1° | 120.0° |
| C22 | C21 | N3 | N4 | 179.2° | 179.7° |
| C22 | C21 | N3 | H2 | 0.7° | 0.0° |
| C22 | C21 | C20 | H14 | 0.4° | 0.2° |
| C21 | C22 | C24 | H15 | 59.2° | 60.0° |
| C21 | C22 | C24 | H16 | 60.8° | 179.9° |
| C21 | C22 | C24 | H17 | 179.2° | 60.0° |
| C21 | C22 | C25 | H21 | 180.0° | 60.0° |
| C21 | C22 | C25 | H22 | 60.0° | 180.0° |
| C21 | C22 | C25 | H23 | 60.0° | 60.0° |
| C21 | C22 | C23 | H24 | 59.3° | 60.0° |
| C21 | C22 | C23 | H25 | 179.2° | 180.0° |
| C21 | C22 | C23 | H26 | 60.8° | 60.0° |
| N3 | C21 | C22 | C23 | 63.5° | 120.0° |
| N3 | C21 | C22 | C24 | 55.4° | 0.0° |
| C21 | N3 | N4 | H2 | 180.0° | 179.7° |
| N3 | C21 | C20 | H14 | 180.0° | 179.9° |
| C10 | C9 | C6 | H33 | 180.0° | 180.0° |
| C10 | C9 | C6 | C7 | 178.1° | 180.0° |
| C9 | C10 | C11 | H32 | 179.0° | 179.7° |
| C23 | C22 | C24 | H15 | 60.9° | 180.0° |
| C23 | C22 | C24 | H16 | 179.1° | 60.0° |
| C23 | C22 | C24 | H17 | 59.1° | 60.0° |
| C23 | C22 | C25 | H21 | 59.1° | 60.0° |
| C23 | C22 | C25 | H22 | 179.1° | 60.0° |
| C23 | C22 | C25 | H23 | 60.9° | 180.0° |
| C22 | C23 | H24 | H25 | 120.0° | 120.0° |
| C22 | C23 | H24 | H26 | 120.0° | 120.1° |
| C22 | C23 | H25 | H26 | 120.0° | 120.0° |
| C22 | C24 | H15 | H16 | 120.0° | 120.1° |
| C22 | C24 | H15 | H17 | 120.0° | 120.0° |
| C22 | C24 | H16 | H17 | 120.0° | 120.0° |
| C24 | C22 | C25 | H21 | 59.0° | 180.0° |
| C24 | C22 | C25 | H22 | 61.0° | 60.0° |
| C24 | C22 | C25 | H23 | 179.0° | 59.9° |
| C24 | C22 | C23 | H24 | 60.9° | 60.0° |
| C24 | C22 | C23 | H25 | 59.1° | 60.0° |
| C24 | C22 | C23 | H26 | 179.1° | 180.0° |
| C9 | C6 | C7 | C8 | 111.8° | 95.0° |
| C9 | C6 | C7 | H3 | 127.3° | 25.0° |
| C9 | C6 | C7 | H4 | 9.2° | 145.0° |
| C6 | C9 | C10 | H8 | 179.5° | 180.0° |
| C6 | C7 | C8 | H3 | 120.9° | 120.1° |
| C6 | C7 | C8 | H4 | 120.9° | 120.0° |
| C6 | C7 | H3 | H4 | 117.1° | 120.0° |
| C6 | C7 | C8 | H5 | 180.0° | 60.0° |
| C6 | C7 | C8 | H6 | 60.0° | 180.0° |
| C6 | C7 | C8 | H7 | 60.0° | 60.0° |
| C7 | C6 | C9 | H33 | 2.0° | 0.0° |
| C8 | C7 | H3 | H4 | 117.1° | 119.9° |
| C7 | C8 | H5 | H6 | 120.0° | 120.0° |
| C7 | C8 | H5 | H7 | 120.0° | 120.0° |
| C7 | C8 | H6 | H7 | 120.0° | 120.0° |
| H3 | C7 | C8 | H5 | 59.1° | 60.0° |
| H3 | C7 | C8 | H6 | 179.0° | 60.0° |
| H3 | C7 | C8 | H7 | 60.9° | 179.9° |
| H4 | C7 | C8 | H5 | 59.0° | 180.0° |
| H4 | C7 | C8 | H6 | 60.9° | 60.0° |
| H4 | C7 | C8 | H7 | 179.0° | 60.0° |
| H5 | C8 | H6 | H7 | 120.0° | 120.1° |
| H8 | C10 | C11 | H32 | 1.0° | 0.0° |
| H8 | C10 | C9 | H33 | 0.5° | 0.1° |
| H9 | C13 | H10 | H11 | 120.0° | 120.0° |
| H13 | C17 | C18 | H19 | 0.8° | 0.0° |
| H13 | C17 | C16 | H20 | 0.8° | 0.2° |
| H15 | C24 | H16 | H17 | 120.0° | 120.0° |
| H21 | C25 | H22 | H23 | 119.9° | 120.0° |
| H24 | C23 | H25 | H26 | 120.0° | 120.0° |
| H27 | C1 | C | H29 | 59.9° | 60.0° |
| H27 | C1 | C | H30 | 60.1° | 60.0° |
| H27 | C1 | C | H31 | 179.9° | 180.0° |
| H28 | C1 | C | H29 | 59.9° | 180.0° |
| H28 | C1 | C | H30 | 179.9° | 60.0° |
| H28 | C1 | C | H31 | 60.1° | 60.0° |
| H29 | C | H30 | H31 | 120.0° | 120.1° |
