J3Y
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C6 | C7 | doub | 1.37Å | 1.37Å | Aromatic |
| C6 | C5 | sing | 1.40Å | 1.39Å | Aromatic |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C25 | O26 | sing | 1.43Å | 1.43Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| N4 | C5 | sing | 1.39Å | 1.39Å | |
| N4 | C2 | sing | 1.46Å | 1.47Å | |
| C7 | C8 | sing | 1.40Å | 1.40Å | Aromatic |
| C5 | N20 | doub | 1.32Å | 1.32Å | Aromatic |
| O26 | C27 | sing | 1.43Å | 1.43Å | |
| C2 | C29 | sing | 1.51Å | 1.51Å | |
| C27 | C28 | sing | 1.53Å | 1.54Å | |
| O22 | C21 | doub | 1.22Å | 1.22Å | |
| C8 | C9 | sing | 1.47Å | 1.48Å | Aromatic |
| C8 | C19 | doub | 1.40Å | 1.40Å | Aromatic |
| C24 | N23 | sing | 1.47Å | 1.47Å | |
| N20 | C19 | sing | 1.33Å | 1.33Å | Aromatic |
| C21 | N23 | sing | 1.35Å | 1.36Å | |
| C21 | C9 | sing | 1.47Å | 1.48Å | |
| N23 | C28 | sing | 1.47Å | 1.48Å | |
| C9 | C10 | doub | 1.36Å | 1.37Å | Aromatic |
| C19 | N11 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | N35 | doub | 1.32Å | 1.32Å | Aromatic |
| C29 | C30 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | N11 | sing | 1.36Å | 1.35Å | Aromatic |
| N11 | C12 | sing | 1.40Å | 1.40Å | |
| N35 | C34 | sing | 1.32Å | 1.32Å | Aromatic |
| C30 | C31 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | C12 | sing | 1.40Å | 1.36Å | Aromatic |
| C13 | C14 | doub | 1.35Å | 1.40Å | Aromatic |
| C12 | N17 | doub | 1.31Å | 1.36Å | Aromatic |
| C34 | C32 | doub | 1.38Å | 1.38Å | Aromatic |
| C14 | C15 | sing | 1.51Å | 1.51Å | |
| C14 | N16 | sing | 1.35Å | 1.31Å | Aromatic |
| N17 | N16 | sing | 1.40Å | 1.40Å | Aromatic |
| C31 | C32 | sing | 1.39Å | 1.39Å | Aromatic |
| C32 | F33 | sing | 1.35Å | 1.35Å | |
| C6 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | H2 | sing | 1.08Å | 1.08Å | |
| C10 | H3 | sing | 1.08Å | 1.08Å | |
| C13 | H4 | sing | 1.08Å | 1.08Å | |
| C15 | H5 | sing | 1.09Å | 1.10Å | |
| C15 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C24 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C28 | H10 | sing | 1.09Å | 1.10Å | |
| C28 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H15 | sing | 1.09Å | 1.10Å | |
| C25 | H16 | sing | 1.09Å | 1.10Å | |
| C25 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.09Å | 1.10Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å | |
| C31 | H21 | sing | 1.08Å | 1.08Å | |
| C34 | H22 | sing | 1.08Å | 1.08Å | |
| N16 | H23 | sing | 0.97Å | 1.00Å | |
| N4 | H24 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C7 | C6 | C5 | 119.5° | 119.4° |
| C6 | C7 | C8 | 118.6° | 118.3° |
| C7 | C6 | H1 | 120.2° | 120.3° |
| C6 | C7 | H2 | 120.7° | 120.8° |
| C6 | C5 | N4 | 119.9° | 119.3° |
| C6 | C5 | N20 | 120.9° | 121.3° |
| C5 | C6 | H1 | 120.2° | 120.3° |
| C1 | C2 | N4 | 109.5° | 109.5° |
| C1 | C2 | C29 | 109.6° | 109.5° |
| C2 | C1 | H12 | 109.5° | 109.5° |
| C2 | C1 | H13 | 109.5° | 109.5° |
| C2 | C1 | H14 | 109.5° | 109.5° |
| C1 | C2 | H15 | 108.7° | 109.5° |
| O26 | C25 | C24 | 109.4° | 109.2° |
| C25 | O26 | C27 | 113.4° | 114.1° |
| O26 | C25 | H16 | 109.5° | 109.5° |
| O26 | C25 | H17 | 109.5° | 109.5° |
| C25 | C24 | N23 | 109.7° | 108.4° |
| C25 | C24 | H8 | 109.4° | 109.7° |
| C25 | C24 | H9 | 109.4° | 109.7° |
| C24 | C25 | H16 | 109.5° | 109.5° |
| C24 | C25 | H17 | 109.5° | 109.5° |
| C5 | N4 | C2 | 120.5° | 120.0° |
| N4 | C5 | N20 | 119.2° | 119.4° |
| C5 | N4 | H24 | 106.7° | 119.9° |
| N4 | C2 | C29 | 110.6° | 109.5° |
| N4 | C2 | H15 | 109.5° | 109.4° |
| C2 | N4 | H24 | 106.7° | 120.0° |
| C7 | C8 | C9 | 134.3° | 134.1° |
| C7 | C8 | C19 | 119.2° | 119.8° |
| C8 | C7 | H2 | 120.7° | 120.9° |
| C5 | N20 | C19 | 121.8° | 121.5° |
| O26 | C27 | C28 | 108.5° | 109.3° |
| O26 | C27 | H18 | 109.7° | 109.5° |
| O26 | C27 | H19 | 109.7° | 109.5° |
| C2 | C29 | N35 | 120.0° | 119.6° |
| C2 | C29 | C30 | 119.3° | 119.6° |
| C29 | C2 | H15 | 109.0° | 109.4° |
| C27 | C28 | N23 | 109.0° | 108.4° |
| C27 | C28 | H10 | 109.6° | 109.7° |
| C27 | C28 | H11 | 109.6° | 109.7° |
| C28 | C27 | H18 | 109.7° | 109.5° |
| C28 | C27 | H19 | 109.7° | 109.5° |
| O22 | C21 | N23 | 117.2° | 120.0° |
| O22 | C21 | C9 | 117.1° | 120.0° |
| C9 | C8 | C19 | 106.5° | 106.1° |
| C8 | C9 | C21 | 125.7° | 126.8° |
| C8 | C9 | C10 | 105.4° | 106.4° |
| C8 | C19 | N20 | 120.0° | 119.7° |
| C8 | C19 | N11 | 107.3° | 107.4° |
| C24 | N23 | C21 | 118.8° | 121.0° |
| C24 | N23 | C28 | 116.3° | 118.1° |
| N23 | C24 | H8 | 109.4° | 109.6° |
| N23 | C24 | H9 | 109.4° | 109.7° |
| N20 | C19 | N11 | 132.7° | 132.9° |
| N23 | C21 | C9 | 125.7° | 120.0° |
| C21 | N23 | C28 | 124.9° | 121.0° |
| C21 | C9 | C10 | 128.9° | 126.8° |
| N23 | C28 | H10 | 109.6° | 109.6° |
| N23 | C28 | H11 | 109.6° | 109.8° |
| C9 | C10 | N11 | 110.6° | 109.7° |
| C9 | C10 | H3 | 124.7° | 125.2° |
| C19 | N11 | C10 | 110.2° | 110.5° |
| C19 | N11 | C12 | 125.5° | 124.8° |
| N35 | C29 | C30 | 120.7° | 120.8° |
| C29 | N35 | C34 | 121.9° | 121.8° |
| C29 | C30 | C31 | 119.2° | 119.2° |
| C29 | C30 | H20 | 120.4° | 120.4° |
| C10 | N11 | C12 | 124.3° | 124.7° |
| N11 | C10 | H3 | 124.7° | 125.1° |
| N11 | C12 | C13 | 126.6° | 126.0° |
| N11 | C12 | N17 | 125.9° | 125.9° |
| N35 | C34 | C32 | 120.6° | 120.7° |
| N35 | C34 | H22 | 119.7° | 119.7° |
| C30 | C31 | C32 | 118.5° | 118.4° |
| C31 | C30 | H20 | 120.4° | 120.4° |
| C30 | C31 | H21 | 120.8° | 120.8° |
| C12 | C13 | C14 | 107.9° | 107.9° |
| C13 | C12 | N17 | 107.4° | 108.1° |
| C12 | C13 | H4 | 126.1° | 126.1° |
| C13 | C14 | C15 | 125.7° | 126.1° |
| C13 | C14 | N16 | 108.4° | 107.9° |
| C14 | C13 | H4 | 126.0° | 126.1° |
| C12 | N17 | N16 | 107.8° | 108.1° |
| C34 | C32 | C31 | 119.1° | 119.1° |
| C34 | C32 | F33 | 120.6° | 120.4° |
| C32 | C34 | H22 | 119.7° | 119.6° |
| C15 | C14 | N16 | 125.9° | 126.1° |
| C14 | C15 | H5 | 109.5° | 109.4° |
| C14 | C15 | H6 | 109.5° | 109.5° |
| C14 | C15 | H7 | 109.5° | 109.5° |
| C14 | N16 | N17 | 108.5° | 108.1° |
| C14 | N16 | H23 | 125.7° | 126.0° |
| N17 | N16 | H23 | 125.8° | 126.0° |
| C31 | C32 | F33 | 120.4° | 120.5° |
| C32 | C31 | H21 | 120.7° | 120.8° |
| H5 | C15 | H6 | 109.4° | 109.5° |
| H5 | C15 | H7 | 109.5° | 109.5° |
| H6 | C15 | H7 | 109.5° | 109.5° |
| H8 | C24 | H9 | 109.5° | 109.7° |
| H10 | C28 | H11 | 109.4° | 109.7° |
| H12 | C1 | H13 | 109.5° | 109.5° |
| H12 | C1 | H14 | 109.5° | 109.5° |
| H13 | C1 | H14 | 109.4° | 109.4° |
| H16 | C25 | H17 | 109.5° | 109.6° |
| H18 | C27 | H19 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C7 | C6 | C5 | H1 | 180.0° | 179.9° |
| C7 | C6 | C5 | N4 | 179.9° | 179.8° |
| C6 | C7 | C8 | H2 | 180.0° | 180.0° |
| C7 | C6 | C5 | N20 | 0.2° | 0.0° |
| C6 | C7 | C8 | C9 | 179.7° | 180.0° |
| C6 | C7 | C8 | C19 | 0.2° | 0.1° |
| C6 | C5 | N4 | N20 | 180.0° | 179.8° |
| C6 | C5 | N4 | C2 | 177.1° | 0.3° |
| C5 | C6 | C7 | C8 | 0.0° | 0.0° |
| C6 | C5 | N20 | C19 | 0.3° | 0.1° |
| C5 | C6 | C7 | H2 | 180.0° | 180.0° |
| C6 | C5 | N4 | H24 | 55.5° | 179.7° |
| C1 | C2 | N4 | C5 | 166.3° | 85.0° |
| C1 | C2 | N4 | C29 | 120.8° | 120.0° |
| C1 | C2 | N4 | H15 | 119.1° | 120.1° |
| C1 | C2 | C29 | H15 | 118.8° | 120.0° |
| C1 | C2 | C29 | N35 | 97.7° | 94.9° |
| C1 | C2 | C29 | C30 | 82.5° | 84.7° |
| C2 | C1 | H12 | H13 | 120.0° | 120.0° |
| C2 | C1 | H12 | H14 | 120.0° | 120.0° |
| C2 | C1 | H13 | H14 | 120.0° | 120.0° |
| C1 | C2 | N4 | H24 | 44.8° | 95.0° |
| O26 | C25 | C24 | H16 | 120.0° | 119.9° |
| O26 | C25 | C24 | H17 | 120.0° | 119.9° |
| C25 | O26 | C27 | C28 | 64.1° | 62.6° |
| O26 | C25 | C24 | N23 | 51.7° | 52.3° |
| O26 | C25 | C24 | H8 | 171.7° | 172.0° |
| O26 | C25 | C24 | H9 | 68.3° | 67.4° |
| O26 | C25 | H16 | H17 | 120.0° | 120.2° |
| C25 | O26 | C27 | H18 | 176.0° | 57.4° |
| C25 | O26 | C27 | H19 | 55.8° | 177.4° |
| C24 | C25 | O26 | C27 | 62.6° | 62.6° |
| C25 | C24 | N23 | H8 | 120.0° | 119.7° |
| C25 | C24 | N23 | H9 | 120.0° | 119.8° |
| C25 | C24 | N23 | C21 | 131.4° | 129.4° |
| C25 | C24 | N23 | C28 | 49.1° | 50.5° |
| C25 | C24 | H8 | H9 | 119.9° | 120.6° |
| C24 | C25 | H16 | H17 | 120.0° | 120.1° |
| C5 | N4 | C2 | H24 | 121.6° | 180.0° |
| C5 | N4 | C2 | C29 | 72.8° | 154.9° |
| N4 | C5 | N20 | C19 | 179.8° | 179.7° |
| N4 | C5 | C6 | H1 | 0.1° | 0.3° |
| C5 | N4 | C2 | H15 | 47.3° | 35.0° |
| C2 | N4 | C5 | N20 | 2.9° | 180.0° |
| N4 | C2 | C29 | H15 | 120.4° | 119.9° |
| N4 | C2 | C29 | N35 | 23.0° | 25.1° |
| N4 | C2 | C29 | C30 | 156.7° | 155.3° |
| N4 | C2 | C1 | H12 | 180.0° | 180.0° |
| N4 | C2 | C1 | H13 | 60.0° | 60.0° |
| N4 | C2 | C1 | H14 | 60.0° | 60.0° |
| C7 | C8 | C9 | C19 | 179.6° | 179.9° |
| C7 | C8 | C19 | N20 | 0.1° | 0.0° |
| C7 | C8 | C9 | C21 | 1.4° | 0.0° |
| C7 | C8 | C9 | C10 | 179.6° | 179.9° |
| C7 | C8 | C19 | N11 | 180.0° | 179.9° |
| C8 | C7 | C6 | H1 | 180.0° | 180.0° |
| C5 | N20 | C19 | C8 | 0.1° | 0.1° |
| C5 | N20 | C19 | N11 | 179.8° | 180.0° |
| N20 | C5 | C6 | H1 | 179.8° | 179.9° |
| N20 | C5 | N4 | H24 | 124.5° | 0.1° |
| O26 | C27 | C28 | H18 | 119.9° | 119.9° |
| O26 | C27 | C28 | H19 | 119.8° | 120.0° |
| O26 | C27 | C28 | N23 | 54.7° | 52.2° |
| O26 | C27 | C28 | H10 | 65.3° | 67.4° |
| O26 | C27 | C28 | H11 | 174.6° | 172.1° |
| C27 | O26 | C25 | H16 | 57.4° | 177.5° |
| C27 | O26 | C25 | H17 | 177.4° | 57.4° |
| O26 | C27 | H18 | H19 | 120.4° | 120.1° |
| C2 | C29 | N35 | C30 | 179.7° | 179.6° |
| C2 | C29 | N35 | C34 | 179.8° | 179.8° |
| C2 | C29 | C30 | C31 | 179.8° | 179.9° |
| C29 | C2 | C1 | H12 | 58.6° | 60.0° |
| C29 | C2 | C1 | H13 | 178.6° | 180.0° |
| C29 | C2 | C1 | H14 | 61.5° | 60.1° |
| C2 | C29 | C30 | H20 | 0.2° | 0.1° |
| C29 | C2 | N4 | H24 | 165.6° | 25.0° |
| C27 | C28 | N23 | C24 | 50.7° | 50.5° |
| C27 | C28 | N23 | C21 | 129.9° | 129.4° |
| C27 | C28 | N23 | H10 | 119.9° | 119.7° |
| C27 | C28 | N23 | H11 | 119.9° | 119.8° |
| C27 | C28 | H10 | H11 | 120.2° | 120.6° |
| C28 | C27 | H18 | H19 | 120.4° | 120.1° |
| O22 | C21 | C9 | C8 | 25.5° | 37.7° |
| O22 | C21 | N23 | C24 | 0.4° | 5.2° |
| O22 | C21 | N23 | C9 | 179.9° | 179.9° |
| O22 | C21 | N23 | C28 | 179.9° | 174.7° |
| O22 | C21 | C9 | C10 | 152.3° | 142.2° |
| C9 | C8 | C19 | N20 | 179.8° | 179.9° |
| C8 | C9 | C21 | N23 | 154.4° | 142.3° |
| C8 | C9 | C21 | C10 | 177.8° | 179.9° |
| C9 | C8 | C19 | N11 | 0.3° | 0.0° |
| C8 | C9 | C10 | N11 | 1.0° | 0.0° |
| C9 | C8 | C7 | H2 | 0.3° | 0.1° |
| C8 | C9 | C10 | H3 | 179.0° | 180.0° |
| C8 | C19 | N20 | N11 | 179.9° | 179.9° |
| C19 | C8 | C9 | C21 | 179.0° | 180.0° |
| C19 | C8 | C9 | C10 | 0.8° | 0.0° |
| C8 | C19 | N11 | C10 | 0.3° | 0.0° |
| C8 | C19 | N11 | C12 | 179.9° | 180.0° |
| C19 | C8 | C7 | H2 | 179.9° | 180.0° |
| C24 | N23 | C21 | C28 | 179.4° | 179.9° |
| C24 | N23 | C21 | C9 | 179.7° | 174.7° |
| N23 | C24 | H8 | H9 | 119.9° | 120.5° |
| C24 | N23 | C28 | H10 | 69.3° | 69.2° |
| C24 | N23 | C28 | H11 | 170.6° | 170.3° |
| N23 | C24 | C25 | H16 | 68.3° | 172.2° |
| N23 | C24 | C25 | H17 | 171.7° | 67.6° |
| N20 | C19 | N11 | C10 | 179.6° | 179.9° |
| N20 | C19 | N11 | C12 | 0.0° | 0.1° |
| N23 | C21 | C9 | C10 | 27.9° | 37.7° |
| C21 | N23 | C24 | H8 | 11.4° | 9.7° |
| C21 | N23 | C24 | H9 | 108.6° | 110.8° |
| C21 | N23 | C28 | H10 | 110.2° | 110.9° |
| C21 | N23 | C28 | H11 | 10.0° | 9.7° |
| C9 | C21 | N23 | C28 | 0.3° | 5.4° |
| C21 | C9 | C10 | N11 | 179.1° | 180.0° |
| C21 | C9 | C10 | H3 | 0.9° | 0.1° |
| C28 | N23 | C24 | H8 | 169.1° | 170.2° |
| C28 | N23 | C24 | H9 | 70.9° | 69.2° |
| N23 | C28 | H10 | H11 | 120.2° | 120.6° |
| N23 | C28 | C27 | H18 | 174.6° | 67.7° |
| N23 | C28 | C27 | H19 | 65.1° | 172.2° |
| C9 | C10 | N11 | C19 | 0.9° | 0.0° |
| C9 | C10 | N11 | H3 | 180.0° | 180.0° |
| C9 | C10 | N11 | C12 | 179.6° | 180.0° |
| C19 | N11 | C10 | C12 | 179.6° | 180.0° |
| C19 | N11 | C12 | C13 | 9.9° | 180.0° |
| C19 | N11 | C12 | N17 | 169.1° | 0.0° |
| C19 | N11 | C10 | H3 | 179.2° | 180.0° |
| N35 | C29 | C30 | C31 | 0.1° | 0.3° |
| C29 | N35 | C34 | C32 | 0.1° | 0.6° |
| N35 | C29 | C2 | H15 | 143.4° | 145.0° |
| N35 | C29 | C30 | H20 | 179.9° | 179.7° |
| C29 | N35 | C34 | H22 | 179.9° | 179.6° |
| C30 | C29 | N35 | C34 | 0.1° | 0.6° |
| C29 | C30 | C31 | H20 | 180.0° | 180.0° |
| C29 | C30 | C31 | C32 | 0.1° | 0.0° |
| C30 | C29 | C2 | H15 | 36.3° | 35.3° |
| C29 | C30 | C31 | H21 | 179.9° | 180.0° |
| C10 | N11 | C12 | C13 | 170.6° | 0.0° |
| C10 | N11 | C12 | N17 | 10.4° | 180.0° |
| N11 | C12 | C13 | N17 | 179.2° | 180.0° |
| N11 | C12 | C13 | C14 | 179.5° | 180.0° |
| N11 | C12 | N17 | N16 | 179.6° | 180.0° |
| C12 | N11 | C10 | H3 | 0.4° | 0.0° |
| N11 | C12 | C13 | H4 | 0.5° | 0.3° |
| N35 | C34 | C32 | H22 | 180.0° | 179.8° |
| N35 | C34 | C32 | C31 | 0.0° | 0.3° |
| N35 | C34 | C32 | F33 | 180.0° | 179.8° |
| C30 | C31 | C32 | C34 | 0.0° | 0.0° |
| C30 | C31 | C32 | H21 | 180.0° | 180.0° |
| C30 | C31 | C32 | F33 | 180.0° | 179.9° |
| C12 | C13 | C14 | H4 | 180.0° | 179.7° |
| C12 | C13 | C14 | C15 | 179.9° | 180.0° |
| C12 | C13 | C14 | N16 | 0.2° | 0.0° |
| C13 | C12 | N17 | N16 | 0.4° | 0.0° |
| C14 | C13 | C12 | N17 | 0.4° | 0.0° |
| C13 | C14 | C15 | N16 | 179.9° | 179.9° |
| C13 | C14 | N16 | N17 | 0.0° | 0.0° |
| C13 | C14 | C15 | H5 | 89.9° | 90.1° |
| C13 | C14 | C15 | H6 | 150.1° | 150.0° |
| C13 | C14 | C15 | H7 | 30.1° | 30.0° |
| C13 | C14 | N16 | H23 | 179.9° | 180.0° |
| C12 | N17 | N16 | C14 | 0.3° | 0.0° |
| N17 | C12 | C13 | H4 | 179.7° | 179.7° |
| C12 | N17 | N16 | H23 | 179.7° | 180.0° |
| C34 | C32 | C31 | F33 | 180.0° | 179.9° |
| C34 | C32 | C31 | H21 | 180.0° | 180.0° |
| C15 | C14 | N16 | N17 | 179.9° | 180.0° |
| C15 | C14 | C13 | H4 | 0.1° | 0.2° |
| C14 | C15 | H5 | H6 | 120.0° | 120.0° |
| C14 | C15 | H5 | H7 | 120.0° | 120.0° |
| C14 | C15 | H6 | H7 | 120.0° | 120.0° |
| C15 | C14 | N16 | H23 | 0.2° | 0.0° |
| C14 | N16 | N17 | H23 | 180.0° | 180.0° |
| N16 | C14 | C13 | H4 | 179.8° | 179.7° |
| N16 | C14 | C15 | H5 | 89.9° | 90.0° |
| N16 | C14 | C15 | H6 | 30.0° | 30.0° |
| N16 | C14 | C15 | H7 | 150.0° | 150.0° |
| C32 | C31 | C30 | H20 | 179.9° | 180.0° |
| C31 | C32 | C34 | H22 | 179.9° | 179.9° |
| F33 | C32 | C31 | H21 | 0.0° | 0.1° |
| F33 | C32 | C34 | H22 | 0.0° | 0.0° |
| H1 | C6 | C7 | H2 | 0.0° | 0.1° |
| H5 | C15 | H6 | H7 | 120.0° | 120.1° |
| H8 | C24 | C25 | H16 | 51.7° | 68.1° |
| H8 | C24 | C25 | H17 | 68.3° | 52.0° |
| H9 | C24 | C25 | H16 | 171.6° | 52.5° |
| H9 | C24 | C25 | H17 | 51.6° | 172.6° |
| H10 | C28 | C27 | H18 | 54.6° | 172.7° |
| H10 | C28 | C27 | H19 | 174.9° | 52.6° |
| H11 | C28 | C27 | H18 | 65.5° | 52.1° |
| H11 | C28 | C27 | H19 | 54.8° | 68.0° |
| H12 | C1 | H13 | H14 | 120.0° | 120.0° |
| H12 | C1 | C2 | H15 | 60.4° | 60.0° |
| H13 | C1 | C2 | H15 | 59.6° | 60.0° |
| H14 | C1 | C2 | H15 | 179.5° | 180.0° |
| H15 | C2 | N4 | H24 | 74.3° | 144.9° |
| H20 | C30 | C31 | H21 | 0.1° | 0.0° |
