HB7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O01 | C02 | doub | 1.22Å | 1.21Å | |
| O04 | N03 | sing | 1.42Å | 1.36Å | |
| C02 | N03 | sing | 1.35Å | 1.44Å | |
| C02 | C05 | sing | 1.48Å | 1.49Å | |
| C18 | N16 | sing | 1.47Å | 1.46Å | |
| C05 | C34 | doub | 1.40Å | 1.40Å | Aromatic |
| C05 | C06 | sing | 1.40Å | 1.38Å | Aromatic |
| C34 | C33 | sing | 1.38Å | 1.40Å | Aromatic |
| C06 | C07 | doub | 1.38Å | 1.38Å | Aromatic |
| N16 | C17 | sing | 1.47Å | 1.47Å | |
| N16 | C15 | sing | 1.39Å | 1.43Å | |
| C33 | C08 | doub | 1.38Å | 1.40Å | Aromatic |
| C07 | C08 | sing | 1.38Å | 1.38Å | Aromatic |
| C08 | C09 | sing | 1.51Å | 1.49Å | |
| C14 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C09 | N10 | sing | 1.46Å | 1.46Å | |
| C13 | C12 | doub | 1.40Å | 1.41Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C20 | sing | 1.40Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.48Å | 1.51Å | |
| N10 | C11 | sing | 1.35Å | 1.48Å | |
| N10 | C22 | sing | 1.47Å | 1.48Å | |
| C11 | O21 | doub | 1.22Å | 1.21Å | |
| C22 | C23 | sing | 1.51Å | 1.55Å | |
| N24 | C23 | sing | 1.35Å | 1.41Å | |
| N24 | C25 | sing | 1.46Å | 1.48Å | |
| C23 | O32 | doub | 1.21Å | 1.22Å | |
| C25 | C26 | sing | 1.51Å | 1.52Å | |
| C26 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C26 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C18 | H5 | sing | 1.09Å | 1.10Å | |
| C18 | H6 | sing | 1.09Å | 1.10Å | |
| C18 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H8 | sing | 1.08Å | 1.08Å | |
| C06 | H9 | sing | 1.08Å | 1.08Å | |
| C07 | H10 | sing | 1.08Å | 1.08Å | |
| C09 | H11 | sing | 1.09Å | 1.10Å | |
| C09 | H12 | sing | 1.09Å | 1.10Å | |
| C19 | H13 | sing | 1.08Å | 1.08Å | |
| C20 | H14 | sing | 1.08Å | 1.08Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C25 | H17 | sing | 1.09Å | 1.10Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.08Å | 1.08Å | |
| C28 | H20 | sing | 1.08Å | 1.08Å | |
| C29 | H21 | sing | 1.08Å | 1.08Å | |
| C30 | H22 | sing | 1.08Å | 1.08Å | |
| C31 | H23 | sing | 1.08Å | 1.08Å | |
| C33 | H24 | sing | 1.08Å | 1.08Å | |
| C34 | H25 | sing | 1.08Å | 1.08Å | |
| N03 | H26 | sing | 0.97Å | 1.00Å | |
| N24 | H27 | sing | 0.97Å | 1.00Å | |
| O04 | H28 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C02 | N03 | 121.3° | 120.1° |
| O01 | C02 | C05 | 124.6° | 120.0° |
| O04 | N03 | C02 | 110.8° | 119.9° |
| O04 | N03 | H26 | 124.6° | 120.0° |
| N03 | O04 | H28 | 109.5° | 114.0° |
| N03 | C02 | C05 | 114.0° | 120.0° |
| C02 | N03 | H26 | 124.6° | 120.0° |
| C02 | C05 | C34 | 120.9° | 120.2° |
| C02 | C05 | C06 | 120.7° | 120.1° |
| C18 | N16 | C17 | 115.5° | 120.0° |
| C18 | N16 | C15 | 120.4° | 120.0° |
| N16 | C18 | H5 | 109.5° | 109.4° |
| N16 | C18 | H6 | 109.5° | 109.4° |
| N16 | C18 | H7 | 109.5° | 109.5° |
| C34 | C05 | C06 | 118.4° | 119.7° |
| C05 | C34 | C33 | 120.4° | 119.9° |
| C05 | C34 | H25 | 119.8° | 120.1° |
| C05 | C06 | C07 | 120.8° | 119.8° |
| C05 | C06 | H9 | 119.6° | 120.1° |
| C34 | C33 | C08 | 121.2° | 120.1° |
| C34 | C33 | H24 | 119.4° | 119.9° |
| C33 | C34 | H25 | 119.8° | 120.1° |
| C06 | C07 | C08 | 122.4° | 120.2° |
| C07 | C06 | H9 | 119.6° | 120.1° |
| C06 | C07 | H10 | 118.8° | 119.9° |
| C17 | N16 | C15 | 124.1° | 120.0° |
| N16 | C17 | H2 | 109.5° | 109.5° |
| N16 | C17 | H3 | 109.5° | 109.5° |
| N16 | C17 | H4 | 109.5° | 109.5° |
| N16 | C15 | C14 | 121.8° | 119.9° |
| N16 | C15 | C19 | 121.3° | 119.9° |
| C33 | C08 | C07 | 116.9° | 120.3° |
| C33 | C08 | C09 | 121.6° | 119.8° |
| C08 | C33 | H24 | 119.4° | 119.9° |
| C07 | C08 | C09 | 121.6° | 119.9° |
| C08 | C07 | H10 | 118.8° | 119.9° |
| C08 | C09 | N10 | 118.9° | 109.5° |
| C08 | C09 | H11 | 107.1° | 109.5° |
| C08 | C09 | H12 | 107.1° | 109.5° |
| C15 | C14 | C13 | 121.1° | 120.1° |
| C14 | C15 | C19 | 117.0° | 120.2° |
| C15 | C14 | H8 | 119.5° | 120.0° |
| C14 | C13 | C12 | 121.4° | 119.9° |
| C14 | C13 | H1 | 119.3° | 120.0° |
| C13 | C14 | H8 | 119.4° | 119.9° |
| C15 | C19 | C20 | 121.7° | 120.0° |
| C15 | C19 | H13 | 119.1° | 120.0° |
| C09 | N10 | C11 | 120.4° | 120.0° |
| C09 | N10 | C22 | 122.7° | 120.0° |
| N10 | C09 | H11 | 107.1° | 109.5° |
| N10 | C09 | H12 | 107.1° | 109.5° |
| C13 | C12 | C20 | 117.0° | 119.9° |
| C13 | C12 | C11 | 121.4° | 120.0° |
| C12 | C13 | H1 | 119.3° | 120.1° |
| C19 | C20 | C12 | 121.8° | 119.9° |
| C20 | C19 | H13 | 119.2° | 119.9° |
| C19 | C20 | H14 | 119.1° | 120.1° |
| C20 | C12 | C11 | 121.6° | 120.1° |
| C12 | C20 | H14 | 119.1° | 120.0° |
| C12 | C11 | N10 | 126.8° | 120.0° |
| C12 | C11 | O21 | 116.6° | 120.0° |
| C11 | N10 | C22 | 116.9° | 120.0° |
| N10 | C11 | O21 | 116.6° | 120.0° |
| N10 | C22 | C23 | 118.4° | 109.5° |
| N10 | C22 | H15 | 107.2° | 109.4° |
| N10 | C22 | H16 | 107.2° | 109.4° |
| C22 | C23 | N24 | 118.1° | 120.0° |
| C22 | C23 | O32 | 121.5° | 120.0° |
| C23 | C22 | H15 | 107.2° | 109.5° |
| C23 | C22 | H16 | 107.2° | 109.5° |
| C23 | N24 | C25 | 123.2° | 120.0° |
| N24 | C23 | O32 | 120.4° | 120.0° |
| C23 | N24 | H27 | 118.4° | 120.0° |
| N24 | C25 | C26 | 112.1° | 109.5° |
| N24 | C25 | H17 | 108.8° | 109.5° |
| N24 | C25 | H18 | 108.8° | 109.5° |
| C25 | N24 | H27 | 118.4° | 120.0° |
| C25 | C26 | C27 | 121.2° | 120.0° |
| C25 | C26 | C31 | 121.2° | 120.0° |
| C26 | C25 | H17 | 108.8° | 109.5° |
| C26 | C25 | H18 | 108.8° | 109.4° |
| C27 | C26 | C31 | 117.6° | 120.0° |
| C26 | C27 | C28 | 121.2° | 120.0° |
| C26 | C27 | H19 | 119.4° | 120.0° |
| C26 | C31 | C30 | 121.3° | 120.0° |
| C26 | C31 | H23 | 119.3° | 120.0° |
| C27 | C28 | C29 | 120.4° | 120.0° |
| C28 | C27 | H19 | 119.4° | 120.0° |
| C27 | C28 | H20 | 119.8° | 120.0° |
| C31 | C30 | C29 | 120.7° | 120.0° |
| C31 | C30 | H22 | 119.7° | 120.1° |
| C30 | C31 | H23 | 119.4° | 119.9° |
| C28 | C29 | C30 | 118.7° | 120.0° |
| C29 | C28 | H20 | 119.8° | 120.0° |
| C28 | C29 | H21 | 120.6° | 120.0° |
| C30 | C29 | H21 | 120.6° | 120.0° |
| C29 | C30 | H22 | 119.6° | 120.0° |
| H2 | C17 | H3 | 109.4° | 109.5° |
| H2 | C17 | H4 | 109.4° | 109.4° |
| H3 | C17 | H4 | 109.5° | 109.5° |
| H5 | C18 | H6 | 109.5° | 109.5° |
| H5 | C18 | H7 | 109.5° | 109.5° |
| H6 | C18 | H7 | 109.4° | 109.5° |
| H11 | C09 | H12 | 109.5° | 109.4° |
| H15 | C22 | H16 | 109.5° | 109.5° |
| H17 | C25 | H18 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C02 | N03 | O04 | 0.1° | 0.0° |
| O01 | C02 | N03 | C05 | 179.8° | 180.0° |
| O01 | C02 | C05 | C34 | 16.4° | 0.0° |
| O01 | C02 | C05 | C06 | 163.9° | 179.7° |
| O01 | C02 | N03 | H26 | 179.9° | 180.0° |
| O04 | N03 | C02 | H26 | 180.0° | 180.0° |
| O04 | N03 | C02 | C05 | 179.8° | 180.0° |
| N03 | C02 | C05 | C34 | 163.8° | 180.0° |
| N03 | C02 | C05 | C06 | 15.8° | 0.3° |
| C02 | N03 | O04 | H28 | 0.0° | 180.0° |
| C02 | C05 | C34 | C06 | 179.7° | 179.7° |
| C02 | C05 | C34 | C33 | 179.8° | 179.8° |
| C02 | C05 | C06 | C07 | 179.9° | 180.0° |
| C02 | C05 | C06 | H9 | 0.2° | 0.1° |
| C02 | C05 | C34 | H25 | 0.2° | 0.0° |
| C05 | C02 | N03 | H26 | 0.2° | 0.0° |
| C18 | N16 | C17 | C15 | 179.3° | 180.0° |
| C18 | N16 | C15 | C14 | 6.0° | 179.2° |
| C18 | N16 | C15 | C19 | 174.3° | 0.0° |
| C18 | N16 | C17 | H2 | 180.0° | 0.1° |
| C18 | N16 | C17 | H3 | 60.0° | 120.0° |
| C18 | N16 | C17 | H4 | 60.0° | 120.0° |
| N16 | C18 | H5 | H6 | 120.0° | 119.9° |
| N16 | C18 | H5 | H7 | 120.0° | 120.0° |
| N16 | C18 | H6 | H7 | 120.0° | 120.0° |
| C05 | C34 | C33 | H25 | 180.0° | 179.7° |
| C34 | C05 | C06 | C07 | 0.2° | 0.3° |
| C05 | C34 | C33 | C08 | 0.5° | 0.5° |
| C34 | C05 | C06 | H9 | 179.8° | 179.8° |
| C05 | C34 | C33 | H24 | 179.5° | 179.7° |
| C06 | C05 | C34 | C33 | 0.2° | 0.6° |
| C05 | C06 | C07 | H9 | 180.0° | 179.9° |
| C05 | C06 | C07 | C08 | 0.4° | 0.1° |
| C05 | C06 | C07 | H10 | 179.6° | 180.0° |
| C06 | C05 | C34 | H25 | 179.8° | 179.7° |
| C34 | C33 | C08 | H24 | 180.0° | 179.8° |
| C34 | C33 | C08 | C07 | 1.1° | 0.3° |
| C34 | C33 | C08 | C09 | 179.3° | 179.7° |
| C06 | C07 | C08 | C33 | 1.1° | 0.0° |
| C06 | C07 | C08 | H10 | 180.0° | 180.0° |
| C06 | C07 | C08 | C09 | 179.3° | 180.0° |
| C17 | N16 | C15 | C14 | 173.2° | 0.8° |
| C17 | N16 | C15 | C19 | 6.4° | 180.0° |
| N16 | C17 | H2 | H3 | 120.0° | 120.0° |
| N16 | C17 | H2 | H4 | 120.0° | 120.0° |
| N16 | C17 | H3 | H4 | 120.0° | 120.0° |
| C17 | N16 | C18 | H5 | 180.0° | 90.1° |
| C17 | N16 | C18 | H6 | 60.0° | 150.0° |
| C17 | N16 | C18 | H7 | 60.0° | 29.9° |
| N16 | C15 | C14 | C19 | 179.7° | 179.2° |
| N16 | C15 | C14 | C13 | 179.5° | 179.7° |
| N16 | C15 | C19 | C20 | 179.7° | 180.0° |
| C15 | N16 | C17 | H2 | 0.7° | 180.0° |
| C15 | N16 | C17 | H3 | 120.7° | 60.0° |
| C15 | N16 | C17 | H4 | 119.2° | 60.0° |
| C15 | N16 | C18 | H5 | 0.7° | 90.0° |
| C15 | N16 | C18 | H6 | 119.3° | 30.0° |
| C15 | N16 | C18 | H7 | 120.7° | 150.0° |
| N16 | C15 | C14 | H8 | 0.5° | 0.3° |
| N16 | C15 | C19 | H13 | 0.3° | 0.8° |
| C33 | C08 | C07 | C09 | 178.2° | 180.0° |
| C33 | C08 | C09 | N10 | 120.4° | 90.0° |
| C33 | C08 | C07 | H10 | 178.9° | 180.0° |
| C33 | C08 | C09 | H11 | 118.3° | 30.0° |
| C33 | C08 | C09 | H12 | 1.0° | 150.0° |
| C08 | C33 | C34 | H25 | 179.5° | 179.7° |
| C07 | C08 | C09 | N10 | 57.8° | 90.0° |
| C08 | C07 | C06 | H9 | 179.5° | 180.0° |
| C07 | C08 | C09 | H11 | 63.6° | 150.0° |
| C07 | C08 | C09 | H12 | 179.1° | 30.0° |
| C07 | C08 | C33 | H24 | 178.9° | 180.0° |
| C08 | C09 | N10 | H11 | 121.3° | 120.1° |
| C08 | C09 | N10 | H12 | 121.3° | 120.0° |
| C08 | C09 | N10 | C11 | 115.7° | 90.0° |
| C08 | C09 | N10 | C22 | 63.1° | 89.9° |
| C09 | C08 | C07 | H10 | 0.7° | 0.0° |
| C08 | C09 | H11 | H12 | 115.7° | 120.0° |
| C09 | C08 | C33 | H24 | 0.7° | 0.0° |
| C15 | C14 | C13 | H8 | 180.0° | 180.0° |
| C15 | C14 | C13 | C12 | 0.9° | 0.0° |
| C14 | C15 | C19 | C20 | 0.1° | 0.8° |
| C15 | C14 | C13 | H1 | 179.1° | 179.7° |
| C14 | C15 | C19 | H13 | 179.9° | 180.0° |
| C13 | C14 | C15 | C19 | 0.1° | 0.5° |
| C14 | C13 | C12 | H1 | 180.0° | 179.7° |
| C14 | C13 | C12 | C20 | 1.5° | 0.3° |
| C14 | C13 | C12 | C11 | 179.1° | 179.7° |
| C15 | C19 | C20 | H13 | 180.0° | 179.2° |
| C15 | C19 | C20 | C12 | 0.6° | 0.5° |
| C19 | C15 | C14 | H8 | 179.9° | 179.5° |
| C15 | C19 | C20 | H14 | 179.4° | 179.4° |
| C09 | N10 | C11 | C12 | 1.3° | 175.9° |
| C09 | N10 | C11 | C22 | 178.8° | 179.9° |
| C09 | N10 | C11 | O21 | 179.5° | 4.2° |
| C09 | N10 | C22 | C23 | 117.1° | 84.6° |
| N10 | C09 | H11 | H12 | 115.8° | 120.0° |
| C09 | N10 | C22 | H15 | 4.2° | 35.4° |
| C09 | N10 | C22 | H16 | 121.7° | 155.4° |
| C13 | C12 | C20 | C19 | 1.3° | 0.0° |
| C13 | C12 | C20 | C11 | 177.6° | 180.0° |
| C13 | C12 | C11 | N10 | 52.9° | 50.2° |
| C13 | C12 | C11 | O21 | 126.3° | 129.9° |
| C12 | C13 | C14 | H8 | 179.1° | 180.0° |
| C13 | C12 | C20 | H14 | 178.7° | 180.0° |
| C19 | C20 | C12 | H14 | 180.0° | 180.0° |
| C19 | C20 | C12 | C11 | 178.9° | 180.0° |
| C20 | C12 | C11 | N10 | 129.6° | 129.8° |
| C20 | C12 | C11 | O21 | 51.2° | 50.2° |
| C20 | C12 | C13 | H1 | 178.5° | 180.0° |
| C12 | C20 | C19 | H13 | 179.4° | 179.7° |
| C12 | C11 | N10 | O21 | 179.2° | 179.9° |
| C12 | C11 | N10 | C22 | 179.9° | 4.1° |
| C11 | C12 | C13 | H1 | 0.9° | 0.1° |
| C11 | C12 | C20 | H14 | 1.1° | 0.1° |
| C11 | N10 | C22 | C23 | 64.2° | 95.3° |
| C11 | N10 | C09 | H11 | 5.7° | 30.1° |
| C11 | N10 | C09 | H12 | 123.0° | 150.0° |
| C11 | N10 | C22 | H15 | 174.5° | 144.6° |
| C11 | N10 | C22 | H16 | 57.1° | 24.7° |
| C22 | N10 | C11 | O21 | 0.7° | 175.8° |
| N10 | C22 | C23 | H15 | 121.3° | 120.0° |
| N10 | C22 | C23 | H16 | 121.3° | 120.0° |
| N10 | C22 | C23 | N24 | 24.1° | 180.0° |
| N10 | C22 | C23 | O32 | 154.8° | 0.0° |
| C22 | N10 | C09 | H11 | 175.6° | 150.0° |
| C22 | N10 | C09 | H12 | 58.3° | 30.0° |
| N10 | C22 | H15 | H16 | 115.9° | 120.0° |
| C22 | C23 | N24 | O32 | 179.0° | 180.0° |
| C22 | C23 | N24 | C25 | 179.4° | 180.0° |
| C23 | C22 | H15 | H16 | 115.9° | 120.0° |
| C22 | C23 | N24 | H27 | 0.6° | 0.0° |
| C23 | N24 | C25 | H27 | 180.0° | 179.9° |
| C23 | N24 | C25 | C26 | 91.5° | 180.0° |
| N24 | C23 | C22 | H15 | 97.1° | 60.0° |
| N24 | C23 | C22 | H16 | 145.4° | 60.0° |
| C23 | N24 | C25 | H17 | 148.1° | 60.0° |
| C23 | N24 | C25 | H18 | 28.8° | 60.0° |
| C25 | N24 | C23 | O32 | 0.4° | 0.1° |
| N24 | C25 | C26 | H17 | 120.4° | 120.0° |
| N24 | C25 | C26 | H18 | 120.4° | 120.0° |
| N24 | C25 | C26 | C27 | 18.5° | 90.0° |
| N24 | C25 | C26 | C31 | 161.6° | 90.2° |
| N24 | C25 | H17 | H18 | 118.8° | 120.0° |
| O32 | C23 | C22 | H15 | 83.9° | 120.0° |
| O32 | C23 | C22 | H16 | 33.5° | 119.9° |
| O32 | C23 | N24 | H27 | 179.6° | 180.0° |
| C25 | C26 | C27 | C31 | 179.9° | 179.8° |
| C25 | C26 | C27 | C28 | 179.9° | 180.0° |
| C25 | C26 | C31 | C30 | 179.9° | 179.8° |
| C26 | C25 | H17 | H18 | 118.8° | 120.0° |
| C25 | C26 | C27 | H19 | 0.0° | 0.0° |
| C25 | C26 | C31 | H23 | 0.1° | 0.1° |
| C26 | C25 | N24 | H27 | 88.5° | 0.0° |
| C26 | C27 | C28 | H19 | 180.0° | 180.0° |
| C27 | C26 | C31 | C30 | 0.0° | 0.5° |
| C26 | C27 | C28 | C29 | 0.1° | 0.0° |
| C27 | C26 | C25 | H17 | 138.9° | 150.0° |
| C27 | C26 | C25 | H18 | 101.8° | 30.0° |
| C26 | C27 | C28 | H20 | 180.0° | 180.0° |
| C27 | C26 | C31 | H23 | 180.0° | 179.7° |
| C31 | C26 | C27 | C28 | 0.0° | 0.3° |
| C26 | C31 | C30 | H23 | 180.0° | 179.8° |
| C26 | C31 | C30 | C29 | 0.1° | 0.4° |
| C31 | C26 | C25 | H17 | 41.1° | 29.8° |
| C31 | C26 | C25 | H18 | 78.1° | 149.7° |
| C31 | C26 | C27 | H19 | 180.0° | 179.7° |
| C26 | C31 | C30 | H22 | 179.9° | 179.7° |
| C27 | C28 | C29 | H20 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 0.1° | 0.0° |
| C27 | C28 | C29 | H21 | 179.9° | 180.0° |
| C31 | C30 | C29 | C28 | 0.1° | 0.2° |
| C31 | C30 | C29 | H22 | 180.0° | 179.8° |
| C31 | C30 | C29 | H21 | 179.9° | 179.8° |
| C28 | C29 | C30 | H21 | 180.0° | 179.9° |
| C29 | C28 | C27 | H19 | 180.0° | 180.0° |
| C28 | C29 | C30 | H22 | 179.9° | 180.0° |
| C30 | C29 | C28 | H20 | 179.9° | 180.0° |
| C29 | C30 | C31 | H23 | 179.9° | 179.7° |
| H1 | C13 | C14 | H8 | 0.9° | 0.3° |
| H2 | C17 | H3 | H4 | 119.9° | 120.0° |
| H5 | C18 | H6 | H7 | 120.0° | 120.0° |
| H9 | C06 | C07 | H10 | 0.5° | 0.1° |
| H13 | C19 | C20 | H14 | 0.6° | 0.2° |
| H17 | C25 | N24 | H27 | 31.9° | 120.0° |
| H18 | C25 | N24 | H27 | 151.2° | 120.0° |
| H19 | C27 | C28 | H20 | 0.0° | 0.0° |
| H20 | C28 | C29 | H21 | 0.1° | 0.1° |
| H21 | C29 | C30 | H22 | 0.1° | 0.1° |
| H22 | C30 | C31 | H23 | 0.1° | 0.1° |
| H24 | C33 | C34 | H25 | 0.5° | 0.0° |
| H26 | N03 | O04 | H28 | 180.0° | 0.0° |
