VBS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C34 | C31 | sing | 1.51Å | 1.51Å | |
| N32 | C31 | doub | 1.32Å | 1.33Å | Aromatic |
| N32 | C33 | sing | 1.32Å | 1.32Å | Aromatic |
| C31 | N30 | sing | 1.32Å | 1.33Å | Aromatic |
| C33 | C28 | doub | 1.40Å | 1.40Å | Aromatic |
| N30 | C29 | doub | 1.32Å | 1.33Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C35 | N25 | sing | 1.46Å | 1.46Å | |
| C35 | C36 | sing | 1.53Å | 1.53Å | |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | C29 | sing | 1.40Å | 1.41Å | Aromatic |
| C28 | C26 | sing | 1.48Å | 1.48Å | |
| N25 | C26 | sing | 1.37Å | 1.37Å | Aromatic |
| N25 | C2 | sing | 1.37Å | 1.36Å | Aromatic |
| C26 | N27 | doub | 1.31Å | 1.32Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | N3 | doub | 1.33Å | 1.32Å | Aromatic |
| C2 | C1 | sing | 1.41Å | 1.41Å | Aromatic |
| N27 | C1 | sing | 1.34Å | 1.36Å | Aromatic |
| N3 | C4 | sing | 1.32Å | 1.32Å | Aromatic |
| C1 | C6 | doub | 1.41Å | 1.43Å | Aromatic |
| C18 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.51Å | 1.52Å | |
| C4 | N5 | doub | 1.32Å | 1.31Å | Aromatic |
| C6 | N5 | sing | 1.33Å | 1.34Å | Aromatic |
| C6 | C7 | sing | 1.48Å | 1.50Å | |
| C7 | C12 | doub | 1.40Å | 1.40Å | Aromatic |
| C7 | C8 | sing | 1.40Å | 1.41Å | Aromatic |
| C17 | C16 | sing | 1.53Å | 1.54Å | |
| C12 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C8 | C9 | doub | 1.37Å | 1.38Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C9 | C16 | sing | 1.51Å | 1.52Å | |
| C10 | N13 | sing | 1.39Å | 1.39Å | |
| C16 | C14 | sing | 1.51Å | 1.52Å | |
| C16 | C24 | sing | 1.53Å | 1.54Å | |
| N13 | C14 | sing | 1.34Å | 1.34Å | |
| C14 | O15 | doub | 1.21Å | 1.21Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C8 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.08Å | 1.08Å | |
| C12 | H4 | sing | 1.08Å | 1.08Å | |
| N13 | H5 | sing | 0.97Å | 1.00Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.08Å | 1.08Å | |
| C21 | H9 | sing | 1.08Å | 1.08Å | |
| C23 | H10 | sing | 1.08Å | 1.08Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C33 | H14 | sing | 1.08Å | 1.08Å | |
| C34 | H15 | sing | 1.09Å | 1.10Å | |
| C34 | H16 | sing | 1.09Å | 1.10Å | |
| C34 | H17 | sing | 1.09Å | 1.10Å | |
| C35 | H18 | sing | 1.09Å | 1.10Å | |
| C35 | H19 | sing | 1.09Å | 1.10Å | |
| C36 | H20 | sing | 1.09Å | 1.10Å | |
| C36 | H21 | sing | 1.09Å | 1.10Å | |
| C36 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.08Å | 1.08Å | |
| C22 | H24 | sing | 1.08Å | 1.08Å | |
| C29 | H25 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C34 | C31 | N32 | 118.6° | 119.0° |
| C34 | C31 | N30 | 119.3° | 119.0° |
| C31 | C34 | H15 | 109.5° | 109.4° |
| C31 | C34 | H16 | 109.4° | 109.5° |
| C31 | C34 | H17 | 109.5° | 109.5° |
| C31 | N32 | C33 | 120.9° | 121.0° |
| N32 | C31 | N30 | 122.1° | 122.1° |
| N32 | C33 | C28 | 119.2° | 118.9° |
| N32 | C33 | H14 | 120.4° | 120.5° |
| C31 | N30 | C29 | 120.5° | 121.0° |
| C33 | C28 | C29 | 118.0° | 118.1° |
| C33 | C28 | C26 | 119.6° | 121.0° |
| C28 | C33 | H14 | 120.4° | 120.5° |
| N30 | C29 | C28 | 119.2° | 119.0° |
| N30 | C29 | H25 | 120.4° | 120.5° |
| C21 | C20 | C19 | 120.3° | 120.0° |
| C20 | C21 | C22 | 119.4° | 120.0° |
| C20 | C21 | H9 | 120.3° | 120.0° |
| C21 | C20 | H23 | 119.8° | 120.0° |
| C20 | C19 | C18 | 120.6° | 120.0° |
| C20 | C19 | H8 | 119.7° | 120.0° |
| C19 | C20 | H23 | 119.8° | 120.0° |
| N25 | C35 | C36 | 112.4° | 109.5° |
| C35 | N25 | C26 | 130.8° | 126.4° |
| C35 | N25 | C2 | 121.4° | 126.4° |
| N25 | C35 | H18 | 108.7° | 109.5° |
| N25 | C35 | H19 | 108.7° | 109.4° |
| C36 | C35 | H18 | 108.8° | 109.5° |
| C36 | C35 | H19 | 108.7° | 109.5° |
| C35 | C36 | H20 | 109.5° | 109.5° |
| C35 | C36 | H21 | 109.5° | 109.5° |
| C35 | C36 | H22 | 109.4° | 109.5° |
| C21 | C22 | C23 | 120.1° | 120.0° |
| C22 | C21 | H9 | 120.3° | 120.0° |
| C21 | C22 | H24 | 120.0° | 120.0° |
| C29 | C28 | C26 | 122.3° | 120.9° |
| C28 | C29 | H25 | 120.4° | 120.5° |
| C28 | C26 | N25 | 126.1° | 125.2° |
| C28 | C26 | N27 | 124.8° | 125.1° |
| C26 | N25 | C2 | 107.8° | 107.2° |
| N25 | C26 | N27 | 109.1° | 109.7° |
| N25 | C2 | N3 | 132.3° | 134.8° |
| N25 | C2 | C1 | 107.0° | 106.1° |
| C26 | N27 | C1 | 109.7° | 109.5° |
| C19 | C18 | C23 | 118.7° | 120.0° |
| C19 | C18 | C17 | 119.9° | 120.0° |
| C18 | C19 | H8 | 119.7° | 120.0° |
| C22 | C23 | C18 | 120.9° | 120.0° |
| C22 | C23 | H10 | 119.6° | 120.0° |
| C23 | C22 | H24 | 120.0° | 120.0° |
| N3 | C2 | C1 | 120.8° | 119.1° |
| C2 | N3 | C4 | 120.3° | 120.7° |
| C2 | C1 | N27 | 106.5° | 107.5° |
| C2 | C1 | C6 | 116.7° | 118.0° |
| N27 | C1 | C6 | 136.8° | 134.5° |
| N3 | C4 | N5 | 121.8° | 122.6° |
| N3 | C4 | H1 | 119.1° | 118.7° |
| C1 | C6 | N5 | 117.5° | 118.4° |
| C1 | C6 | C7 | 124.1° | 120.8° |
| C23 | C18 | C17 | 121.3° | 120.0° |
| C18 | C23 | H10 | 119.5° | 120.0° |
| C18 | C17 | C16 | 117.7° | 109.5° |
| C18 | C17 | H6 | 107.4° | 109.5° |
| C18 | C17 | H7 | 107.4° | 109.5° |
| C4 | N5 | C6 | 122.8° | 121.2° |
| N5 | C4 | H1 | 119.1° | 118.7° |
| N5 | C6 | C7 | 118.4° | 120.8° |
| C6 | C7 | C12 | 121.2° | 120.2° |
| C6 | C7 | C8 | 120.5° | 120.2° |
| C12 | C7 | C8 | 118.3° | 119.6° |
| C7 | C12 | C11 | 120.6° | 120.2° |
| C7 | C12 | H4 | 119.7° | 119.9° |
| C7 | C8 | C9 | 120.2° | 119.8° |
| C7 | C8 | H2 | 119.9° | 120.2° |
| C17 | C16 | C9 | 113.1° | 110.2° |
| C17 | C16 | C14 | 113.2° | 110.5° |
| C17 | C16 | C24 | 107.9° | 110.5° |
| C16 | C17 | H6 | 107.4° | 109.5° |
| C16 | C17 | H7 | 107.4° | 109.5° |
| C12 | C11 | C10 | 120.7° | 120.3° |
| C12 | C11 | H3 | 119.7° | 119.8° |
| C11 | C12 | H4 | 119.7° | 119.9° |
| C8 | C9 | C10 | 121.0° | 121.0° |
| C8 | C9 | C16 | 132.9° | 132.7° |
| C9 | C8 | H2 | 119.9° | 120.1° |
| C11 | C10 | C9 | 119.1° | 119.2° |
| C11 | C10 | N13 | 130.2° | 130.6° |
| C10 | C11 | H3 | 119.7° | 119.9° |
| C10 | C9 | C16 | 106.1° | 106.3° |
| C9 | C10 | N13 | 110.7° | 110.2° |
| C9 | C16 | C14 | 103.7° | 104.1° |
| C9 | C16 | C24 | 108.0° | 111.0° |
| C10 | N13 | C14 | 112.2° | 112.3° |
| C10 | N13 | H5 | 123.9° | 123.9° |
| C14 | C16 | C24 | 110.9° | 110.5° |
| C16 | C14 | N13 | 107.3° | 107.1° |
| C16 | C14 | O15 | 127.5° | 126.5° |
| C16 | C24 | H11 | 109.5° | 109.5° |
| C16 | C24 | H12 | 109.5° | 109.5° |
| C16 | C24 | H13 | 109.5° | 109.5° |
| N13 | C14 | O15 | 125.3° | 126.4° |
| C14 | N13 | H5 | 123.9° | 123.8° |
| H6 | C17 | H7 | 109.4° | 109.5° |
| H11 | C24 | H12 | 109.5° | 109.4° |
| H11 | C24 | H13 | 109.4° | 109.5° |
| H12 | C24 | H13 | 109.5° | 109.4° |
| H15 | C34 | H16 | 109.5° | 109.4° |
| H15 | C34 | H17 | 109.5° | 109.4° |
| H16 | C34 | H17 | 109.5° | 109.5° |
| H18 | C35 | H19 | 109.5° | 109.5° |
| H20 | C36 | H21 | 109.4° | 109.5° |
| H20 | C36 | H22 | 109.5° | 109.4° |
| H21 | C36 | H22 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C34 | C31 | N32 | N30 | 179.6° | 179.7° |
| C34 | C31 | N32 | C33 | 179.3° | 179.7° |
| C34 | C31 | N30 | C29 | 179.7° | 179.9° |
| C31 | C34 | H15 | H16 | 120.0° | 120.0° |
| C31 | C34 | H15 | H17 | 120.0° | 120.0° |
| C31 | C34 | H16 | H17 | 120.0° | 120.1° |
| C31 | N32 | C33 | C28 | 0.5° | 0.0° |
| N32 | C31 | N30 | C29 | 0.0° | 0.3° |
| C31 | N32 | C33 | H14 | 179.5° | 179.7° |
| N32 | C31 | C34 | H15 | 0.0° | 90.3° |
| N32 | C31 | C34 | H16 | 120.0° | 29.7° |
| N32 | C31 | C34 | H17 | 120.0° | 149.7° |
| C33 | N32 | C31 | N30 | 0.3° | 0.0° |
| N32 | C33 | C28 | H14 | 180.0° | 179.7° |
| N32 | C33 | C28 | C29 | 0.4° | 0.2° |
| N32 | C33 | C28 | C26 | 179.3° | 179.8° |
| C31 | N30 | C29 | C28 | 0.2° | 0.5° |
| N30 | C31 | C34 | H15 | 179.6° | 90.0° |
| N30 | C31 | C34 | H16 | 59.6° | 150.0° |
| N30 | C31 | C34 | H17 | 60.4° | 29.9° |
| C31 | N30 | C29 | H25 | 179.8° | 180.0° |
| C33 | C28 | C29 | N30 | 0.1° | 0.5° |
| C33 | C28 | C29 | C26 | 179.7° | 180.0° |
| C33 | C28 | C26 | N25 | 135.7° | 159.4° |
| C33 | C28 | C26 | N27 | 43.3° | 20.3° |
| C33 | C28 | C29 | H25 | 180.0° | 180.0° |
| N30 | C29 | C28 | H25 | 180.0° | 179.5° |
| N30 | C29 | C28 | C26 | 179.6° | 179.5° |
| C21 | C20 | C19 | H23 | 180.0° | 179.7° |
| C20 | C21 | C22 | H9 | 180.0° | 179.5° |
| C21 | C20 | C19 | C18 | 1.0° | 0.1° |
| C20 | C21 | C22 | C23 | 0.2° | 0.5° |
| C21 | C20 | C19 | H8 | 179.0° | 180.0° |
| C20 | C21 | C22 | H24 | 179.8° | 180.0° |
| C19 | C20 | C21 | C22 | 0.1° | 0.3° |
| C20 | C19 | C18 | H8 | 180.0° | 179.9° |
| C20 | C19 | C18 | C23 | 1.8° | 0.1° |
| C20 | C19 | C18 | C17 | 178.9° | 179.8° |
| C19 | C20 | C21 | H9 | 179.9° | 179.8° |
| N25 | C35 | C36 | H18 | 120.4° | 120.0° |
| N25 | C35 | C36 | H19 | 120.4° | 120.0° |
| C35 | N25 | C26 | C28 | 0.4° | 0.0° |
| C35 | N25 | C26 | C2 | 179.9° | 180.0° |
| C35 | N25 | C26 | N27 | 179.6° | 179.7° |
| C35 | N25 | C2 | N3 | 0.6° | 0.0° |
| C35 | N25 | C2 | C1 | 179.9° | 180.0° |
| N25 | C35 | H18 | H19 | 118.6° | 120.0° |
| N25 | C35 | C36 | H20 | 180.0° | 180.0° |
| N25 | C35 | C36 | H21 | 60.0° | 60.0° |
| N25 | C35 | C36 | H22 | 60.0° | 60.0° |
| C36 | C35 | N25 | C26 | 114.2° | 94.5° |
| C36 | C35 | N25 | C2 | 65.7° | 85.5° |
| C36 | C35 | H18 | H19 | 118.7° | 120.0° |
| C35 | C36 | H20 | H21 | 120.0° | 120.0° |
| C35 | C36 | H20 | H22 | 120.0° | 120.0° |
| C35 | C36 | H21 | H22 | 120.0° | 120.0° |
| C21 | C22 | C23 | H24 | 180.0° | 179.6° |
| C21 | C22 | C23 | C18 | 1.1° | 0.5° |
| C21 | C22 | C23 | H10 | 178.8° | 179.5° |
| C22 | C21 | C20 | H23 | 179.9° | 180.0° |
| C29 | C28 | C26 | N25 | 43.9° | 20.6° |
| C29 | C28 | C26 | N27 | 137.0° | 159.7° |
| C29 | C28 | C33 | H14 | 179.6° | 180.0° |
| C28 | C26 | N25 | N27 | 179.2° | 179.7° |
| C28 | C26 | N25 | C2 | 179.7° | 180.0° |
| C28 | C26 | N27 | C1 | 179.8° | 179.8° |
| C26 | C28 | C33 | H14 | 0.7° | 0.0° |
| C26 | C28 | C29 | H25 | 0.4° | 0.0° |
| C26 | N25 | C2 | N3 | 179.4° | 179.9° |
| C26 | N25 | C2 | C1 | 0.2° | 0.0° |
| N25 | C26 | N27 | C1 | 0.6° | 0.4° |
| C26 | N25 | C35 | H18 | 125.3° | 25.5° |
| C26 | N25 | C35 | H19 | 6.3° | 145.4° |
| C2 | N25 | C26 | N27 | 0.5° | 0.3° |
| N25 | C2 | N3 | C1 | 179.5° | 179.9° |
| N25 | C2 | C1 | N27 | 0.1° | 0.2° |
| N25 | C2 | N3 | C4 | 179.7° | 180.0° |
| N25 | C2 | C1 | C6 | 179.5° | 180.0° |
| C2 | N25 | C35 | H18 | 54.7° | 154.5° |
| C2 | N25 | C35 | H19 | 173.8° | 34.5° |
| C26 | N27 | C1 | C2 | 0.5° | 0.4° |
| C26 | N27 | C1 | C6 | 179.1° | 179.9° |
| C19 | C18 | C23 | C22 | 1.9° | 0.3° |
| C19 | C18 | C23 | C17 | 177.0° | 179.7° |
| C19 | C18 | C17 | C16 | 102.0° | 89.7° |
| C19 | C18 | C17 | H6 | 136.8° | 150.3° |
| C19 | C18 | C17 | H7 | 19.2° | 30.3° |
| C19 | C18 | C23 | H10 | 178.1° | 179.7° |
| C18 | C19 | C20 | H23 | 179.0° | 179.8° |
| C22 | C23 | C18 | H10 | 180.0° | 180.0° |
| C22 | C23 | C18 | C17 | 178.9° | 180.0° |
| C23 | C22 | C21 | H9 | 179.8° | 180.0° |
| N3 | C2 | C1 | N27 | 179.8° | 179.7° |
| N3 | C2 | C1 | C6 | 0.1° | 0.1° |
| C2 | N3 | C4 | N5 | 0.1° | 0.0° |
| C2 | N3 | C4 | H1 | 179.8° | 180.0° |
| C2 | C1 | N27 | C6 | 179.5° | 179.7° |
| C1 | C2 | N3 | C4 | 0.7° | 0.0° |
| C2 | C1 | C6 | N5 | 1.8° | 0.0° |
| C2 | C1 | C6 | C7 | 179.4° | 180.0° |
| N27 | C1 | C6 | N5 | 178.7° | 179.7° |
| N27 | C1 | C6 | C7 | 0.1° | 0.3° |
| N3 | C4 | N5 | H1 | 180.0° | 180.0° |
| N3 | C4 | N5 | C6 | 2.1° | 0.0° |
| C1 | C6 | N5 | C4 | 2.8° | 0.0° |
| C1 | C6 | N5 | C7 | 178.8° | 180.0° |
| C1 | C6 | C7 | C12 | 22.2° | 35.0° |
| C1 | C6 | C7 | C8 | 158.2° | 145.3° |
| C23 | C18 | C17 | C16 | 81.0° | 90.0° |
| C23 | C18 | C17 | H6 | 40.2° | 30.0° |
| C23 | C18 | C17 | H7 | 157.8° | 150.0° |
| C23 | C18 | C19 | H8 | 178.2° | 180.0° |
| C18 | C23 | C22 | H24 | 178.8° | 180.0° |
| C18 | C17 | C16 | H6 | 121.2° | 120.0° |
| C18 | C17 | C16 | H7 | 121.2° | 120.0° |
| C18 | C17 | C16 | C9 | 63.4° | 175.9° |
| C18 | C17 | C16 | C14 | 54.2° | 61.4° |
| C18 | C17 | C16 | C24 | 177.3° | 61.2° |
| C18 | C17 | H6 | H7 | 116.2° | 120.0° |
| C17 | C18 | C19 | H8 | 1.1° | 0.3° |
| C17 | C18 | C23 | H10 | 1.1° | 0.1° |
| C4 | N5 | C6 | C7 | 178.3° | 180.0° |
| N5 | C6 | C7 | C12 | 159.0° | 145.0° |
| N5 | C6 | C7 | C8 | 20.6° | 34.7° |
| C6 | N5 | C4 | H1 | 177.9° | 180.0° |
| C6 | C7 | C12 | C8 | 179.7° | 179.7° |
| C6 | C7 | C12 | C11 | 178.7° | 179.9° |
| C6 | C7 | C8 | C9 | 178.9° | 180.0° |
| C6 | C7 | C8 | H2 | 1.1° | 0.1° |
| C6 | C7 | C12 | H4 | 1.3° | 0.0° |
| C7 | C12 | C11 | H4 | 180.0° | 179.9° |
| C12 | C7 | C8 | C9 | 1.4° | 0.3° |
| C7 | C12 | C11 | C10 | 1.6° | 0.1° |
| C12 | C7 | C8 | H2 | 178.6° | 179.8° |
| C7 | C12 | C11 | H3 | 178.4° | 179.8° |
| C8 | C7 | C12 | C11 | 1.6° | 0.2° |
| C7 | C8 | C9 | H2 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 1.2° | 0.0° |
| C7 | C8 | C9 | C16 | 179.3° | 180.0° |
| C8 | C7 | C12 | H4 | 178.4° | 179.7° |
| C17 | C16 | C9 | C8 | 58.5° | 61.2° |
| C17 | C16 | C9 | C10 | 123.1° | 118.8° |
| C17 | C16 | C9 | C14 | 123.0° | 118.5° |
| C17 | C16 | C9 | C24 | 119.3° | 122.7° |
| C17 | C16 | C14 | C24 | 121.4° | 122.6° |
| C17 | C16 | C14 | N13 | 122.8° | 118.8° |
| C17 | C16 | C14 | O15 | 57.3° | 61.2° |
| C16 | C17 | H6 | H7 | 116.3° | 120.0° |
| C17 | C16 | C24 | H11 | 180.0° | 61.2° |
| C17 | C16 | C24 | H12 | 60.0° | 58.9° |
| C17 | C16 | C24 | H13 | 60.0° | 178.8° |
| C12 | C11 | C10 | H3 | 180.0° | 179.6° |
| C12 | C11 | C10 | C9 | 1.3° | 0.4° |
| C12 | C11 | C10 | N13 | 178.7° | 180.0° |
| C8 | C9 | C10 | C11 | 1.1° | 0.3° |
| C8 | C9 | C10 | C16 | 178.6° | 180.0° |
| C8 | C9 | C10 | N13 | 178.9° | 180.0° |
| C8 | C9 | C16 | C14 | 178.5° | 179.7° |
| C8 | C9 | C16 | C24 | 60.8° | 61.5° |
| C11 | C10 | C9 | N13 | 180.0° | 179.7° |
| C11 | C10 | C9 | C16 | 179.7° | 179.7° |
| C11 | C10 | N13 | C14 | 179.6° | 180.0° |
| C10 | C11 | C12 | H4 | 178.4° | 180.0° |
| C11 | C10 | N13 | H5 | 0.4° | 0.6° |
| C10 | C9 | C16 | C14 | 0.2° | 0.3° |
| C10 | C9 | C16 | C24 | 117.6° | 118.5° |
| C9 | C10 | N13 | C14 | 0.4° | 0.4° |
| C10 | C9 | C8 | H2 | 178.8° | 179.9° |
| C9 | C10 | C11 | H3 | 178.7° | 179.9° |
| C9 | C10 | N13 | H5 | 179.6° | 179.8° |
| C16 | C9 | C10 | N13 | 0.4° | 0.0° |
| C9 | C16 | C14 | C24 | 115.7° | 119.2° |
| C9 | C16 | C14 | N13 | 0.1° | 0.5° |
| C9 | C16 | C14 | O15 | 179.8° | 179.5° |
| C16 | C9 | C8 | H2 | 0.7° | 0.0° |
| C9 | C16 | C17 | H6 | 175.4° | 55.9° |
| C9 | C16 | C17 | H7 | 57.8° | 64.1° |
| C9 | C16 | C24 | H11 | 57.5° | 176.3° |
| C9 | C16 | C24 | H12 | 177.5° | 63.6° |
| C9 | C16 | C24 | H13 | 62.5° | 56.3° |
| C10 | N13 | C14 | C16 | 0.3° | 0.6° |
| C10 | N13 | C14 | H5 | 180.0° | 179.4° |
| C10 | N13 | C14 | O15 | 179.6° | 179.5° |
| N13 | C10 | C11 | H3 | 1.2° | 0.3° |
| C16 | C14 | N13 | O15 | 179.9° | 180.0° |
| C16 | C14 | N13 | H5 | 179.7° | 180.0° |
| C14 | C16 | C17 | H6 | 67.0° | 58.6° |
| C14 | C16 | C17 | H7 | 175.3° | 178.6° |
| C14 | C16 | C24 | H11 | 55.5° | 61.4° |
| C14 | C16 | C24 | H12 | 64.5° | 178.6° |
| C14 | C16 | C24 | H13 | 175.5° | 58.6° |
| C24 | C16 | C14 | N13 | 115.8° | 118.6° |
| C24 | C16 | C14 | O15 | 64.1° | 61.3° |
| C24 | C16 | C17 | H6 | 56.1° | 178.8° |
| C24 | C16 | C17 | H7 | 61.6° | 58.8° |
| C16 | C24 | H11 | H12 | 120.0° | 120.0° |
| C16 | C24 | H11 | H13 | 120.0° | 120.0° |
| C16 | C24 | H12 | H13 | 120.0° | 120.0° |
| O15 | C14 | N13 | H5 | 0.4° | 0.1° |
| H3 | C11 | C12 | H4 | 1.6° | 0.3° |
| H8 | C19 | C20 | H23 | 0.9° | 0.3° |
| H9 | C21 | C20 | H23 | 0.1° | 0.5° |
| H9 | C21 | C22 | H24 | 0.2° | 0.5° |
| H10 | C23 | C22 | H24 | 1.2° | 0.0° |
| H11 | C24 | H12 | H13 | 120.0° | 120.0° |
| H15 | C34 | H16 | H17 | 120.0° | 120.0° |
| H18 | C35 | C36 | H20 | 59.6° | 60.0° |
| H18 | C35 | C36 | H21 | 179.5° | 60.0° |
| H18 | C35 | C36 | H22 | 60.4° | NaN° |
| H19 | C35 | C36 | H20 | 59.5° | 60.0° |
| H19 | C35 | C36 | H21 | 60.4° | 180.0° |
| H19 | C35 | C36 | H22 | 179.6° | 60.0° |
| H20 | C36 | H21 | H22 | 120.0° | 120.0° |
