KJC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N10 | sing | 1.40Å | 1.41Å | |
| C1 | C5 | doub | 1.36Å | 1.37Å | Aromatic |
| C1 | C2 | sing | 1.42Å | 1.40Å | Aromatic |
| C2 | C6 | sing | 1.48Å | 1.46Å | |
| C2 | N3 | doub | 1.32Å | 1.32Å | Aromatic |
| N3 | N4 | sing | 1.28Å | 1.28Å | Aromatic |
| N4 | C9 | sing | 1.46Å | 1.47Å | |
| N4 | C5 | sing | 1.36Å | 1.37Å | Aromatic |
| C6 | N8 | sing | 1.35Å | 1.34Å | |
| C6 | O7 | doub | 1.22Å | 1.22Å | |
| N8 | C29 | sing | 1.47Å | 1.48Å | |
| N10 | C18 | sing | 1.35Å | 1.36Å | |
| C11 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C16 | sing | 1.40Å | 1.40Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.40Å | Aromatic |
| C13 | C17 | sing | 1.51Å | 1.51Å | |
| C13 | N14 | doub | 1.31Å | 1.33Å | Aromatic |
| N14 | C15 | sing | 1.33Å | 1.33Å | Aromatic |
| C15 | C18 | sing | 1.48Å | 1.46Å | |
| C15 | C16 | doub | 1.40Å | 1.41Å | Aromatic |
| C16 | N20 | sing | 1.39Å | 1.40Å | |
| C17 | C27 | sing | 1.53Å | 1.54Å | |
| C17 | C28 | sing | 1.53Å | 1.54Å | |
| C18 | O19 | doub | 1.22Å | 1.23Å | |
| N20 | C21 | sing | 1.40Å | 1.40Å | |
| C21 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
| C21 | C26 | sing | 1.39Å | 1.40Å | Aromatic |
| C22 | N23 | sing | 1.32Å | 1.33Å | Aromatic |
| N23 | C24 | doub | 1.32Å | 1.30Å | Aromatic |
| C24 | N25 | sing | 1.32Å | 1.32Å | Aromatic |
| N25 | C26 | doub | 1.32Å | 1.32Å | Aromatic |
| C27 | C28 | sing | 1.53Å | 1.54Å | |
| C29 | C30 | sing | 1.53Å | 1.53Å | |
| C30 | O31 | sing | 1.43Å | 1.43Å | |
| C30 | C32 | sing | 1.53Å | 1.53Å | |
| C30 | C33 | sing | 1.53Å | 1.54Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C22 | H3 | sing | 1.08Å | 1.08Å | |
| C24 | H4 | sing | 1.08Å | 1.08Å | |
| C26 | H5 | sing | 1.08Å | 1.08Å | |
| C28 | H6 | sing | 1.09Å | 1.10Å | |
| C28 | H7 | sing | 1.09Å | 1.10Å | |
| N8 | H8 | sing | 0.97Å | 1.00Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C9 | H11 | sing | 1.09Å | 1.10Å | |
| N10 | H12 | sing | 0.97Å | 1.00Å | |
| C11 | H13 | sing | 1.08Å | 1.08Å | |
| C12 | H14 | sing | 1.08Å | 1.08Å | |
| N20 | H15 | sing | 0.97Å | 1.00Å | |
| C27 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C29 | H18 | sing | 1.09Å | 1.10Å | |
| C29 | H19 | sing | 1.09Å | 1.10Å | |
| O31 | H20 | sing | 0.97Å | 0.95Å | |
| C32 | H21 | sing | 1.09Å | 1.10Å | |
| C32 | H22 | sing | 1.09Å | 1.10Å | |
| C32 | H23 | sing | 1.09Å | 1.10Å | |
| C33 | H24 | sing | 1.09Å | 1.10Å | |
| C33 | H25 | sing | 1.09Å | 1.10Å | |
| C33 | H26 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N10 | C1 | C5 | 128.7° | 127.3° |
| N10 | C1 | C2 | 126.0° | 127.3° |
| C1 | N10 | C18 | 120.6° | 120.0° |
| C1 | N10 | H12 | 119.7° | 120.0° |
| C5 | C1 | C2 | 105.3° | 105.4° |
| C1 | C5 | N4 | 107.0° | 107.1° |
| C1 | C5 | H1 | 126.5° | 126.5° |
| C1 | C2 | C6 | 126.3° | 126.5° |
| C1 | C2 | N3 | 107.6° | 107.1° |
| C6 | C2 | N3 | 125.9° | 126.4° |
| C2 | C6 | N8 | 121.7° | 120.0° |
| C2 | C6 | O7 | 118.4° | 120.0° |
| C2 | N3 | N4 | 110.5° | 110.3° |
| N3 | N4 | C9 | 123.6° | 124.9° |
| N3 | N4 | C5 | 109.5° | 110.2° |
| C9 | N4 | C5 | 126.9° | 124.9° |
| N4 | C9 | H9 | 109.5° | 109.5° |
| N4 | C9 | H10 | 109.5° | 109.4° |
| N4 | C9 | H11 | 109.5° | 109.5° |
| N4 | C5 | H1 | 126.5° | 126.5° |
| N8 | C6 | O7 | 119.9° | 120.0° |
| C6 | N8 | C29 | 119.2° | 120.0° |
| C6 | N8 | H8 | 120.4° | 120.0° |
| N8 | C29 | C30 | 106.4° | 109.5° |
| C29 | N8 | H8 | 120.4° | 120.0° |
| N8 | C29 | H18 | 110.2° | 109.5° |
| N8 | C29 | H19 | 110.2° | 109.5° |
| N10 | C18 | C15 | 115.0° | 120.0° |
| N10 | C18 | O19 | 122.5° | 120.0° |
| C18 | N10 | H12 | 119.7° | 120.0° |
| C12 | C11 | C16 | 119.1° | 118.4° |
| C11 | C12 | C13 | 119.1° | 119.5° |
| C12 | C11 | H13 | 120.5° | 120.8° |
| C11 | C12 | H14 | 120.4° | 120.2° |
| C11 | C16 | C15 | 117.9° | 118.9° |
| C11 | C16 | N20 | 121.6° | 120.6° |
| C16 | C11 | H13 | 120.4° | 120.8° |
| C12 | C13 | C17 | 123.3° | 119.4° |
| C12 | C13 | N14 | 120.9° | 121.1° |
| C13 | C12 | H14 | 120.5° | 120.3° |
| C17 | C13 | N14 | 115.8° | 119.5° |
| C13 | C17 | C27 | 117.5° | 117.5° |
| C13 | C17 | C28 | 114.1° | 117.5° |
| C13 | C17 | H2 | 117.8° | 115.6° |
| C13 | N14 | C15 | 121.8° | 121.8° |
| N14 | C15 | C18 | 114.8° | 119.8° |
| N14 | C15 | C16 | 121.2° | 120.3° |
| C18 | C15 | C16 | 123.9° | 119.8° |
| C15 | C18 | O19 | 122.4° | 120.0° |
| C15 | C16 | N20 | 120.5° | 120.5° |
| C16 | N20 | C21 | 123.2° | 120.0° |
| C16 | N20 | H15 | 118.4° | 119.9° |
| C27 | C17 | C28 | 59.8° | 60.0° |
| C17 | C27 | C28 | 60.3° | 60.0° |
| C27 | C17 | H2 | 117.3° | 117.4° |
| C17 | C27 | H16 | 120.0° | 117.6° |
| C17 | C27 | H17 | 119.9° | 117.4° |
| C17 | C28 | C27 | 59.9° | 60.0° |
| C28 | C17 | H2 | 117.2° | 117.5° |
| C17 | C28 | H6 | 120.0° | 117.5° |
| C17 | C28 | H7 | 120.0° | 117.5° |
| N20 | C21 | C22 | 121.2° | 120.8° |
| N20 | C21 | C26 | 121.3° | 120.9° |
| C21 | N20 | H15 | 118.4° | 120.1° |
| C22 | C21 | C26 | 117.6° | 118.2° |
| C21 | C22 | N23 | 120.2° | 119.0° |
| C21 | C22 | H3 | 119.9° | 120.5° |
| C21 | C26 | N25 | 117.9° | 119.0° |
| C21 | C26 | H5 | 121.1° | 120.5° |
| C22 | N23 | C24 | 119.9° | 120.8° |
| N23 | C22 | H3 | 119.9° | 120.5° |
| N23 | C24 | N25 | 121.9° | 122.0° |
| N23 | C24 | H4 | 119.1° | 119.0° |
| C24 | N25 | C26 | 122.6° | 120.9° |
| N25 | C24 | H4 | 119.1° | 119.1° |
| N25 | C26 | H5 | 121.0° | 120.5° |
| C27 | C28 | H6 | 120.0° | 117.5° |
| C27 | C28 | H7 | 120.0° | 117.5° |
| C28 | C27 | H16 | 120.0° | 117.5° |
| C28 | C27 | H17 | 119.9° | 117.5° |
| C29 | C30 | O31 | 108.1° | 109.5° |
| C29 | C30 | C32 | 109.8° | 109.5° |
| C29 | C30 | C33 | 111.6° | 109.5° |
| C30 | C29 | H18 | 110.2° | 109.5° |
| C30 | C29 | H19 | 110.2° | 109.5° |
| O31 | C30 | C32 | 107.2° | 109.4° |
| O31 | C30 | C33 | 108.9° | 109.5° |
| C30 | O31 | H20 | 109.5° | 114.0° |
| C32 | C30 | C33 | 111.2° | 109.5° |
| C30 | C32 | H21 | 109.5° | 109.5° |
| C30 | C32 | H22 | 109.5° | 109.5° |
| C30 | C32 | H23 | 109.5° | 109.5° |
| C30 | C33 | H24 | 109.5° | 109.5° |
| C30 | C33 | H25 | 109.5° | 109.5° |
| C30 | C33 | H26 | 109.5° | 109.5° |
| H6 | C28 | H7 | 109.5° | 115.6° |
| H9 | C9 | H10 | 109.4° | 109.5° |
| H9 | C9 | H11 | 109.5° | 109.5° |
| H10 | C9 | H11 | 109.5° | 109.5° |
| H16 | C27 | H17 | 109.5° | 115.6° |
| H18 | C29 | H19 | 109.5° | 109.5° |
| H21 | C32 | H22 | 109.5° | 109.4° |
| H21 | C32 | H23 | 109.4° | 109.4° |
| H22 | C32 | H23 | 109.5° | 109.5° |
| H24 | C33 | H25 | 109.5° | 109.4° |
| H24 | C33 | H26 | 109.5° | 109.4° |
| H25 | C33 | H26 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N10 | C1 | C5 | C2 | 177.0° | 179.9° |
| N10 | C1 | C2 | C6 | 4.4° | 0.1° |
| N10 | C1 | C2 | N3 | 179.9° | 179.9° |
| N10 | C1 | C5 | N4 | 178.6° | 180.0° |
| C1 | N10 | C18 | H12 | 180.0° | 179.9° |
| C1 | N10 | C18 | C15 | 178.3° | 180.0° |
| C1 | N10 | C18 | O19 | 0.9° | 0.1° |
| N10 | C1 | C5 | H1 | 1.4° | 0.2° |
| C5 | C1 | C2 | C6 | 178.4° | 180.0° |
| C5 | C1 | C2 | N3 | 2.8° | 0.0° |
| C1 | C5 | N4 | N3 | 0.3° | 0.1° |
| C1 | C5 | N4 | C9 | 178.2° | 180.0° |
| C1 | C5 | N4 | H1 | 180.0° | 179.8° |
| C5 | C1 | N10 | C18 | 9.4° | 0.2° |
| C5 | C1 | N10 | H12 | 170.6° | 179.9° |
| C1 | C2 | C6 | N3 | 174.9° | 180.0° |
| C1 | C2 | N3 | N4 | 3.1° | 0.0° |
| C2 | C1 | C5 | N4 | 1.5° | 0.1° |
| C1 | C2 | C6 | N8 | 155.2° | 180.0° |
| C1 | C2 | C6 | O7 | 27.6° | 0.0° |
| C2 | C1 | N10 | C18 | 167.1° | 180.0° |
| C2 | C1 | C5 | H1 | 178.5° | 179.9° |
| C2 | C1 | N10 | H12 | 13.0° | 0.0° |
| C6 | C2 | N3 | N4 | 178.8° | 180.0° |
| C2 | C6 | N8 | O7 | 177.2° | 180.0° |
| C2 | C6 | N8 | C29 | 177.8° | 180.0° |
| C2 | C6 | N8 | H8 | 2.2° | 0.0° |
| C2 | N3 | N4 | C9 | 176.3° | 180.0° |
| C2 | N3 | N4 | C5 | 2.2° | 0.1° |
| N3 | C2 | C6 | N8 | 29.9° | 0.0° |
| N3 | C2 | C6 | O7 | 147.3° | 180.0° |
| N3 | N4 | C9 | C5 | 178.3° | 179.9° |
| N3 | N4 | C5 | H1 | 179.7° | 180.0° |
| N3 | N4 | C9 | H9 | 0.0° | 90.1° |
| N3 | N4 | C9 | H10 | 120.0° | 149.9° |
| N3 | N4 | C9 | H11 | 120.0° | 29.9° |
| C9 | N4 | C5 | H1 | 1.8° | 0.1° |
| N4 | C9 | H9 | H10 | 120.0° | 120.0° |
| N4 | C9 | H9 | H11 | 120.0° | 120.0° |
| N4 | C9 | H10 | H11 | 120.0° | 120.0° |
| C5 | N4 | C9 | H9 | 178.2° | 90.0° |
| C5 | N4 | C9 | H10 | 58.3° | 29.9° |
| C5 | N4 | C9 | H11 | 61.8° | 149.9° |
| C6 | N8 | C29 | H8 | 180.0° | 180.0° |
| C6 | N8 | C29 | C30 | 114.6° | 180.0° |
| C6 | N8 | C29 | H18 | 4.9° | 60.0° |
| C6 | N8 | C29 | H19 | 125.9° | 60.0° |
| O7 | C6 | N8 | C29 | 0.6° | 0.0° |
| O7 | C6 | N8 | H8 | 179.4° | 180.0° |
| N8 | C29 | C30 | H18 | 119.5° | 120.0° |
| N8 | C29 | C30 | H19 | 119.5° | 120.0° |
| N8 | C29 | C30 | O31 | 77.8° | 60.0° |
| N8 | C29 | C30 | C32 | 38.8° | 60.0° |
| N8 | C29 | C30 | C33 | 162.5° | 180.0° |
| N8 | C29 | H18 | H19 | 121.4° | 120.0° |
| N10 | C18 | C15 | N14 | 11.2° | 5.3° |
| N10 | C18 | C15 | O19 | 177.4° | 179.9° |
| N10 | C18 | C15 | C16 | 166.1° | 174.7° |
| C12 | C11 | C16 | H13 | 180.0° | 179.9° |
| C11 | C12 | C13 | H14 | 180.0° | 179.9° |
| C11 | C12 | C13 | C17 | 179.7° | 180.0° |
| C11 | C12 | C13 | N14 | 0.6° | 0.3° |
| C12 | C11 | C16 | C15 | 1.2° | 0.2° |
| C12 | C11 | C16 | N20 | 179.3° | 180.0° |
| C16 | C11 | C12 | C13 | 0.3° | 0.1° |
| C11 | C16 | C15 | N14 | 1.2° | 0.2° |
| C11 | C16 | C15 | C18 | 178.4° | 179.8° |
| C11 | C16 | C15 | N20 | 178.2° | 179.8° |
| C11 | C16 | N20 | C21 | 6.2° | 99.1° |
| C16 | C11 | C12 | H14 | 179.7° | 180.0° |
| C11 | C16 | N20 | H15 | 173.8° | 80.9° |
| C12 | C13 | C17 | N14 | 179.1° | 179.7° |
| C12 | C13 | N14 | C15 | 0.6° | 0.3° |
| C12 | C13 | C17 | C27 | 146.5° | 84.7° |
| C12 | C13 | C17 | C28 | 146.3° | 16.1° |
| C12 | C13 | C17 | H2 | 2.9° | 129.6° |
| C13 | C12 | C11 | H13 | 179.7° | 179.9° |
| C17 | C13 | N14 | C15 | 179.7° | 180.0° |
| C13 | C17 | C27 | C28 | 103.2° | 107.5° |
| C13 | C17 | C27 | H2 | 149.6° | 145.0° |
| C13 | C17 | C28 | H2 | 143.7° | 145.0° |
| C13 | C17 | C28 | H6 | 0.5° | 0.0° |
| C13 | C17 | C28 | H7 | 141.6° | 145.0° |
| C17 | C13 | C12 | H14 | 0.3° | 0.1° |
| C13 | C17 | C27 | H16 | 147.2° | 145.0° |
| C13 | C17 | C27 | H17 | 6.3° | 0.0° |
| C13 | N14 | C15 | C18 | 177.7° | 180.0° |
| C13 | N14 | C15 | C16 | 0.3° | 0.0° |
| N14 | C13 | C17 | C27 | 34.4° | 95.0° |
| N14 | C13 | C17 | C28 | 32.8° | 163.6° |
| N14 | C13 | C17 | H2 | 176.2° | 50.7° |
| N14 | C13 | C12 | H14 | 179.4° | 179.8° |
| N14 | C15 | C18 | C16 | 177.3° | 180.0° |
| N14 | C15 | C16 | N20 | 179.4° | 180.0° |
| N14 | C15 | C18 | O19 | 171.4° | 174.6° |
| C18 | C15 | C16 | N20 | 3.4° | 0.0° |
| C15 | C18 | N10 | H12 | 1.7° | 0.1° |
| C16 | C15 | C18 | O19 | 11.3° | 5.4° |
| C15 | C16 | N20 | C21 | 171.9° | 81.1° |
| C15 | C16 | C11 | H13 | 178.8° | 179.7° |
| C15 | C16 | N20 | H15 | 8.1° | 98.9° |
| C16 | N20 | C21 | H15 | 180.0° | 180.0° |
| C16 | N20 | C21 | C22 | 158.4° | 177.3° |
| C16 | N20 | C21 | C26 | 20.6° | 2.4° |
| N20 | C16 | C11 | H13 | 0.6° | 0.1° |
| C27 | C17 | C28 | H2 | 107.4° | 107.4° |
| C17 | C27 | C28 | H16 | 109.5° | 107.6° |
| C17 | C27 | C28 | H17 | 109.5° | 107.4° |
| C27 | C17 | C28 | H6 | 109.5° | 107.5° |
| C27 | C17 | C28 | H7 | 109.4° | 107.4° |
| C17 | C27 | H16 | H17 | 144.6° | 145.7° |
| C17 | C28 | H6 | H7 | 144.8° | 145.7° |
| O19 | C18 | N10 | H12 | 179.1° | 180.0° |
| N20 | C21 | C22 | C26 | 179.1° | 179.7° |
| N20 | C21 | C22 | N23 | 179.7° | 179.7° |
| N20 | C21 | C26 | N25 | 179.0° | 179.8° |
| N20 | C21 | C22 | H3 | 0.3° | 0.2° |
| N20 | C21 | C26 | H5 | 1.0° | 0.3° |
| C21 | C22 | N23 | H3 | 180.0° | 179.9° |
| C21 | C22 | N23 | C24 | 1.0° | 0.0° |
| C22 | C21 | C26 | N25 | 0.1° | 0.1° |
| C22 | C21 | C26 | H5 | 179.9° | 180.0° |
| C22 | C21 | N20 | H15 | 21.6° | 2.7° |
| C26 | C21 | C22 | N23 | 0.6° | 0.0° |
| C21 | C26 | N25 | C24 | 0.4° | 0.1° |
| C21 | C26 | N25 | H5 | 180.0° | 179.9° |
| C26 | C21 | C22 | H3 | 179.4° | 179.9° |
| C26 | C21 | N20 | H15 | 159.4° | 177.6° |
| C22 | N23 | C24 | N25 | 0.8° | 0.0° |
| C22 | N23 | C24 | H4 | 179.2° | 179.9° |
| N23 | C24 | N25 | H4 | 180.0° | 179.9° |
| N23 | C24 | N25 | C26 | 0.0° | 0.1° |
| C24 | N23 | C22 | H3 | 179.0° | 180.0° |
| C24 | N25 | C26 | H5 | 179.6° | 180.0° |
| C26 | N25 | C24 | H4 | 180.0° | 180.0° |
| C27 | C28 | H6 | H7 | 144.8° | 145.7° |
| C28 | C27 | H16 | H17 | 144.6° | 145.7° |
| C29 | C30 | O31 | C32 | 118.3° | 120.0° |
| C29 | C30 | O31 | C33 | 121.4° | 120.1° |
| C29 | C30 | C32 | C33 | 124.0° | 120.1° |
| C30 | C29 | N8 | H8 | 65.5° | 0.0° |
| C30 | C29 | H18 | H19 | 121.4° | 120.0° |
| C29 | C30 | O31 | H20 | 180.0° | 60.0° |
| C29 | C30 | C32 | H21 | 180.0° | 60.0° |
| C29 | C30 | C32 | H22 | 60.0° | 180.0° |
| C29 | C30 | C32 | H23 | 60.0° | 59.9° |
| C29 | C30 | C33 | H24 | 180.0° | 60.0° |
| C29 | C30 | C33 | H25 | 60.0° | 180.0° |
| C29 | C30 | C33 | H26 | 60.0° | 60.0° |
| O31 | C30 | C32 | C33 | 118.9° | 120.0° |
| O31 | C30 | C29 | H18 | 162.7° | 180.0° |
| O31 | C30 | C29 | H19 | 41.7° | 60.0° |
| O31 | C30 | C32 | H21 | 62.9° | 180.0° |
| O31 | C30 | C32 | H22 | 57.1° | 60.0° |
| O31 | C30 | C32 | H23 | 177.2° | 60.0° |
| O31 | C30 | C33 | H24 | 60.8° | 60.0° |
| O31 | C30 | C33 | H25 | 179.2° | 60.0° |
| O31 | C30 | C33 | H26 | 59.2° | 180.0° |
| C32 | C30 | C29 | H18 | 80.7° | 60.1° |
| C32 | C30 | C29 | H19 | 158.3° | 180.0° |
| C32 | C30 | O31 | H20 | 61.8° | 180.0° |
| C30 | C32 | H21 | H22 | 120.0° | 120.0° |
| C30 | C32 | H21 | H23 | 120.0° | 120.0° |
| C30 | C32 | H22 | H23 | 120.0° | 120.0° |
| C32 | C30 | C33 | H24 | 57.1° | 180.0° |
| C32 | C30 | C33 | H25 | 62.9° | 59.9° |
| C32 | C30 | C33 | H26 | 177.1° | 60.1° |
| C33 | C30 | C29 | H18 | 43.0° | 60.0° |
| C33 | C30 | C29 | H19 | 78.0° | 60.0° |
| C33 | C30 | O31 | H20 | 58.6° | 60.0° |
| C33 | C30 | C32 | H21 | 56.0° | 60.0° |
| C33 | C30 | C32 | H22 | 176.0° | 59.9° |
| C33 | C30 | C32 | H23 | 64.0° | 180.0° |
| C30 | C33 | H24 | H25 | 120.0° | 120.1° |
| C30 | C33 | H24 | H26 | 120.0° | 120.0° |
| C30 | C33 | H25 | H26 | 120.0° | 120.0° |
| H2 | C17 | C28 | H6 | 143.2° | 145.1° |
| H2 | C17 | C28 | H7 | 2.1° | 0.0° |
| H2 | C17 | C27 | H16 | 2.4° | 0.0° |
| H2 | C17 | C27 | H17 | 143.3° | 145.0° |
| H6 | C28 | C27 | H16 | 141.0° | 145.0° |
| H6 | C28 | C27 | H17 | 0.1° | 0.0° |
| H7 | C28 | C27 | H16 | 0.1° | 0.0° |
| H7 | C28 | C27 | H17 | 141.0° | 145.0° |
| H8 | N8 | C29 | H18 | 175.0° | 120.0° |
| H8 | N8 | C29 | H19 | 54.1° | 120.0° |
| H9 | C9 | H10 | H11 | 120.0° | 120.0° |
| H13 | C11 | C12 | H14 | 0.3° | 0.1° |
| H21 | C32 | H22 | H23 | 120.0° | 120.0° |
| H24 | C33 | H25 | H26 | 120.0° | 119.9° |
