VTJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C15 | S13 | sing | 1.81Å | 1.74Å | |
| C1 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | C4 | sing | 1.37Å | 1.39Å | Aromatic |
| S13 | O14 | doub | 1.42Å | 1.44Å | |
| S13 | O16 | doub | 1.42Å | 1.44Å | |
| S13 | C4 | sing | 1.76Å | 1.80Å | |
| C2 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.43Å | Aromatic |
| C3 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.42Å | 1.42Å | Aromatic |
| C5 | C9 | sing | 1.44Å | 1.48Å | Aromatic |
| C6 | N7 | sing | 1.37Å | 1.39Å | Aromatic |
| C9 | C10 | sing | 1.50Å | 1.51Å | |
| C9 | C8 | doub | 1.36Å | 1.38Å | Aromatic |
| C10 | C11 | sing | 1.53Å | 1.54Å | |
| N7 | C8 | sing | 1.37Å | 1.38Å | Aromatic |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C8 | C18 | sing | 1.48Å | 1.46Å | |
| C12 | C17 | sing | 1.50Å | 1.51Å | |
| C18 | C17 | doub | 1.40Å | 1.41Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C17 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | C23 | sing | 1.51Å | 1.50Å | |
| C23 | N24 | sing | 1.47Å | 1.52Å | |
| O35 | C27 | sing | 1.43Å | 1.43Å | |
| C25 | N24 | sing | 1.48Å | 1.52Å | |
| C25 | C26 | sing | 1.55Å | 1.52Å | |
| N24 | C28 | sing | 1.47Å | 1.54Å | |
| C26 | C27 | sing | 1.55Å | 1.53Å | |
| C27 | C28 | sing | 1.54Å | 1.55Å | |
| C27 | C29 | sing | 1.51Å | 1.53Å | |
| C34 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C34 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C30 | sing | 1.38Å | 1.39Å | Aromatic |
| C33 | C32 | doub | 1.38Å | 1.38Å | Aromatic |
| C30 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
| C32 | C31 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C15 | H3 | sing | 1.09Å | 1.10Å | |
| C15 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.09Å | 1.10Å | |
| C21 | H6 | sing | 1.08Å | 1.08Å | |
| C22 | H7 | sing | 1.08Å | 1.08Å | |
| C26 | H8 | sing | 1.09Å | 1.10Å | |
| C26 | H9 | sing | 1.09Å | 1.10Å | |
| C28 | H10 | sing | 1.09Å | 1.10Å | |
| C28 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.08Å | 1.08Å | |
| C2 | H13 | sing | 1.08Å | 1.08Å | |
| C3 | H14 | sing | 1.08Å | 1.08Å | |
| N7 | H15 | sing | 0.97Å | 1.00Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.08Å | 1.08Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C30 | H26 | sing | 1.08Å | 1.08Å | |
| C31 | H27 | sing | 1.08Å | 1.08Å | |
| C32 | H28 | sing | 1.08Å | 1.08Å | |
| C33 | H29 | sing | 1.08Å | 1.08Å | |
| C34 | H30 | sing | 1.08Å | 1.08Å | |
| O35 | H31 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C15 | S13 | O14 | 108.0° | 110.6° |
| C15 | S13 | O16 | 108.2° | 110.6° |
| C15 | S13 | C4 | 107.5° | 104.5° |
| S13 | C15 | H3 | 109.5° | 109.5° |
| S13 | C15 | H4 | 109.5° | 109.4° |
| S13 | C15 | H5 | 109.5° | 109.5° |
| C2 | C1 | C4 | 120.5° | 122.2° |
| C1 | C2 | C3 | 120.7° | 122.2° |
| C2 | C1 | H12 | 119.7° | 118.9° |
| C1 | C2 | H13 | 119.6° | 118.9° |
| C1 | C4 | S13 | 116.4° | 121.6° |
| C1 | C4 | C5 | 120.9° | 116.9° |
| C4 | C1 | H12 | 119.8° | 118.9° |
| O14 | S13 | O16 | 117.7° | 121.0° |
| O14 | S13 | C4 | 107.4° | 104.3° |
| O16 | S13 | C4 | 107.8° | 104.3° |
| S13 | C4 | C5 | 122.3° | 121.5° |
| C2 | C3 | C6 | 119.1° | 117.0° |
| C3 | C2 | H13 | 119.7° | 118.9° |
| C2 | C3 | H14 | 120.5° | 121.5° |
| C4 | C5 | C6 | 116.0° | 121.1° |
| C4 | C5 | C9 | 138.3° | 132.7° |
| C3 | C6 | C5 | 122.6° | 120.6° |
| C3 | C6 | N7 | 129.0° | 131.8° |
| C6 | C3 | H14 | 120.4° | 121.5° |
| C6 | C5 | C9 | 105.7° | 106.2° |
| C5 | C6 | N7 | 108.3° | 107.6° |
| C5 | C9 | C10 | 123.8° | 129.8° |
| C5 | C9 | C8 | 106.7° | 106.7° |
| C6 | N7 | C8 | 109.7° | 109.2° |
| C6 | N7 | H15 | 125.2° | 125.4° |
| C10 | C9 | C8 | 129.3° | 123.5° |
| C9 | C10 | C11 | 119.0° | 110.9° |
| C9 | C10 | H1 | 107.0° | 109.2° |
| C9 | C10 | H2 | 107.0° | 109.2° |
| C9 | C8 | N7 | 109.6° | 110.3° |
| C9 | C8 | C18 | 123.3° | 120.2° |
| C10 | C11 | C12 | 114.5° | 109.5° |
| C11 | C10 | H1 | 107.1° | 109.2° |
| C11 | C10 | H2 | 107.0° | 109.2° |
| C10 | C11 | H16 | 108.2° | 109.5° |
| C10 | C11 | H17 | 108.2° | 109.5° |
| N7 | C8 | C18 | 127.0° | 129.5° |
| C8 | N7 | H15 | 125.1° | 125.4° |
| C11 | C12 | C17 | 116.4° | 113.9° |
| C12 | C11 | H16 | 108.2° | 109.5° |
| C12 | C11 | H17 | 108.2° | 109.4° |
| C11 | C12 | H18 | 107.7° | 108.7° |
| C11 | C12 | H19 | 107.7° | 108.6° |
| C8 | C18 | C17 | 120.9° | 117.6° |
| C8 | C18 | C19 | 119.7° | 122.0° |
| C12 | C17 | C18 | 123.6° | 118.7° |
| C12 | C17 | C22 | 117.4° | 121.6° |
| C17 | C12 | H18 | 107.7° | 108.6° |
| C17 | C12 | H19 | 107.7° | 108.6° |
| C17 | C18 | C19 | 119.3° | 120.3° |
| C18 | C17 | C22 | 118.5° | 119.6° |
| C18 | C19 | C20 | 121.6° | 119.4° |
| C18 | C19 | H20 | 119.2° | 120.3° |
| C17 | C22 | C21 | 121.1° | 119.9° |
| C17 | C22 | H7 | 119.5° | 120.0° |
| C19 | C20 | C21 | 118.4° | 120.1° |
| C19 | C20 | C23 | 120.6° | 119.9° |
| C20 | C19 | H20 | 119.2° | 120.3° |
| C22 | C21 | C20 | 121.0° | 120.5° |
| C22 | C21 | H6 | 119.5° | 119.7° |
| C21 | C22 | H7 | 119.5° | 120.1° |
| C21 | C20 | C23 | 120.9° | 120.0° |
| C20 | C21 | H6 | 119.5° | 119.8° |
| C20 | C23 | N24 | 113.7° | 109.4° |
| C20 | C23 | H21 | 108.4° | 109.5° |
| C20 | C23 | H22 | 108.4° | 109.4° |
| C23 | N24 | C25 | 118.3° | 111.0° |
| C23 | N24 | C28 | 112.2° | 111.0° |
| N24 | C23 | H21 | 108.4° | 109.5° |
| N24 | C23 | H22 | 108.4° | 109.5° |
| O35 | C27 | C26 | 107.8° | 110.7° |
| O35 | C27 | C28 | 101.9° | 110.7° |
| O35 | C27 | C29 | 116.5° | 110.8° |
| C27 | O35 | H31 | 109.5° | 114.0° |
| N24 | C25 | C26 | 104.8° | 104.8° |
| C25 | N24 | C28 | 107.2° | 108.5° |
| N24 | C25 | H24 | 110.6° | 110.4° |
| N24 | C25 | H25 | 110.7° | 110.4° |
| C25 | C26 | C27 | 104.9° | 101.6° |
| C25 | C26 | H8 | 110.6° | 111.0° |
| C25 | C26 | H9 | 110.6° | 111.0° |
| C26 | C25 | H24 | 110.6° | 110.4° |
| C26 | C25 | H25 | 110.6° | 110.3° |
| N24 | C28 | C27 | 105.6° | 107.3° |
| N24 | C28 | H10 | 110.4° | 109.9° |
| N24 | C28 | H11 | 110.5° | 109.9° |
| C26 | C27 | C28 | 102.1° | 103.0° |
| C26 | C27 | C29 | 113.5° | 110.7° |
| C27 | C26 | H8 | 110.6° | 111.0° |
| C27 | C26 | H9 | 110.6° | 111.0° |
| C28 | C27 | C29 | 113.5° | 110.7° |
| C27 | C28 | H10 | 110.4° | 109.9° |
| C27 | C28 | H11 | 110.4° | 110.1° |
| C27 | C29 | C34 | 120.7° | 120.0° |
| C27 | C29 | C30 | 121.2° | 120.0° |
| C29 | C34 | C33 | 120.9° | 120.0° |
| C34 | C29 | C30 | 118.1° | 120.0° |
| C29 | C34 | H30 | 119.6° | 120.0° |
| C34 | C33 | C32 | 120.3° | 120.0° |
| C34 | C33 | H29 | 119.9° | 120.0° |
| C33 | C34 | H30 | 119.6° | 120.0° |
| C29 | C30 | C31 | 120.9° | 120.0° |
| C29 | C30 | H26 | 119.6° | 120.0° |
| C33 | C32 | C31 | 119.6° | 120.0° |
| C33 | C32 | H28 | 120.2° | 120.0° |
| C32 | C33 | H29 | 119.8° | 120.0° |
| C30 | C31 | C32 | 120.3° | 120.0° |
| C31 | C30 | H26 | 119.6° | 120.0° |
| C30 | C31 | H27 | 119.9° | 120.0° |
| C32 | C31 | H27 | 119.8° | 120.0° |
| C31 | C32 | H28 | 120.2° | 120.0° |
| H1 | C10 | H2 | 109.5° | 109.1° |
| H3 | C15 | H4 | 109.5° | 109.5° |
| H3 | C15 | H5 | 109.5° | 109.5° |
| H4 | C15 | H5 | 109.5° | 109.5° |
| H8 | C26 | H9 | 109.5° | 110.8° |
| H10 | C28 | H11 | 109.5° | 109.9° |
| H16 | C11 | H17 | 109.5° | 109.4° |
| H18 | C12 | H19 | 109.4° | 108.4° |
| H21 | C23 | H22 | 109.5° | 109.5° |
| H24 | C25 | H25 | 109.4° | 110.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C15 | S13 | C4 | C1 | 12.6° | 111.0° |
| C15 | S13 | O14 | O16 | 122.7° | 131.5° |
| C15 | S13 | O14 | C4 | 115.6° | 111.8° |
| C15 | S13 | O16 | C4 | 115.9° | 111.8° |
| C15 | S13 | C4 | C5 | 173.8° | 69.3° |
| S13 | C15 | H3 | H4 | 120.0° | 120.0° |
| S13 | C15 | H3 | H5 | 120.0° | 120.0° |
| S13 | C15 | H4 | H5 | 120.0° | 120.0° |
| C2 | C1 | C4 | H12 | 180.0° | 180.0° |
| C2 | C1 | C4 | S13 | 178.8° | 179.8° |
| C1 | C2 | C3 | H13 | 180.0° | 180.0° |
| C2 | C1 | C4 | C5 | 5.1° | 0.0° |
| C1 | C2 | C3 | C6 | 1.3° | 0.1° |
| C1 | C2 | C3 | H14 | 178.7° | 180.0° |
| C1 | C4 | S13 | O14 | 103.3° | 5.1° |
| C1 | C4 | S13 | O16 | 129.0° | 132.9° |
| C1 | C4 | S13 | C5 | 173.6° | 179.7° |
| C4 | C1 | C2 | C3 | 4.4° | 0.0° |
| C1 | C4 | C5 | C6 | 2.6° | 0.0° |
| C1 | C4 | C5 | C9 | 175.1° | 180.0° |
| C4 | C1 | C2 | H13 | 175.6° | 180.0° |
| O14 | S13 | O16 | C4 | 121.5° | 116.7° |
| O14 | S13 | C4 | C5 | 70.2° | 174.6° |
| O14 | S13 | C15 | H3 | 180.0° | 67.8° |
| O14 | S13 | C15 | H4 | 60.0° | 172.2° |
| O14 | S13 | C15 | H5 | 60.0° | 52.2° |
| O16 | S13 | C4 | C5 | 57.5° | 46.8° |
| O16 | S13 | C15 | H3 | 51.7° | 69.0° |
| O16 | S13 | C15 | H4 | 68.3° | 51.1° |
| O16 | S13 | C15 | H5 | 171.7° | 171.0° |
| S13 | C4 | C5 | C6 | 175.9° | 179.7° |
| S13 | C4 | C5 | C9 | 1.8° | 0.3° |
| C4 | S13 | C15 | H3 | 64.4° | 179.4° |
| C4 | S13 | C15 | H4 | 175.5° | 60.6° |
| C4 | S13 | C15 | H5 | 55.6° | 59.4° |
| S13 | C4 | C1 | H12 | 1.2° | 0.2° |
| C2 | C3 | C6 | H14 | 180.0° | 179.9° |
| C2 | C3 | C6 | C5 | 1.1° | 0.1° |
| C2 | C3 | C6 | N7 | 179.4° | 179.8° |
| C3 | C2 | C1 | H12 | 175.6° | 179.9° |
| C4 | C5 | C6 | C3 | 0.4° | 0.1° |
| C4 | C5 | C6 | C9 | 178.5° | 180.0° |
| C4 | C5 | C6 | N7 | 180.0° | 179.8° |
| C4 | C5 | C9 | C10 | 3.2° | 1.6° |
| C4 | C5 | C9 | C8 | 178.8° | 179.2° |
| C5 | C4 | C1 | H12 | 174.9° | 179.9° |
| C3 | C6 | C5 | N7 | 179.6° | 179.9° |
| C3 | C6 | C5 | C9 | 178.9° | 179.9° |
| C3 | C6 | N7 | C8 | 178.8° | 179.4° |
| C6 | C3 | C2 | H13 | 178.7° | 179.9° |
| C3 | C6 | N7 | H15 | 1.1° | 0.6° |
| C6 | C5 | C9 | C10 | 174.8° | 178.4° |
| C6 | C5 | C9 | C8 | 0.9° | 0.8° |
| C5 | C6 | N7 | C8 | 1.6° | 0.5° |
| C5 | C6 | C3 | H14 | 178.9° | 180.0° |
| C5 | C6 | N7 | H15 | 178.4° | 179.5° |
| C9 | C5 | C6 | N7 | 1.5° | 0.2° |
| C5 | C9 | C10 | C8 | 174.6° | 179.1° |
| C5 | C9 | C10 | C11 | 131.7° | 106.3° |
| C5 | C9 | C8 | N7 | 0.0° | 1.2° |
| C5 | C9 | C8 | C18 | 178.2° | 178.6° |
| C5 | C9 | C10 | H1 | 107.0° | 133.3° |
| C5 | C9 | C10 | H2 | 10.3° | 14.1° |
| C6 | N7 | C8 | C9 | 1.0° | 1.1° |
| C6 | N7 | C8 | H15 | 180.0° | 180.0° |
| C6 | N7 | C8 | C18 | 177.2° | 178.7° |
| N7 | C6 | C3 | H14 | 0.6° | 0.1° |
| C9 | C10 | C11 | H1 | 121.3° | 120.4° |
| C9 | C10 | C11 | H2 | 121.3° | 120.4° |
| C10 | C9 | C8 | N7 | 175.4° | 178.1° |
| C9 | C10 | C11 | C12 | 20.3° | 42.4° |
| C10 | C9 | C8 | C18 | 2.9° | 2.1° |
| C9 | C10 | H1 | H2 | 115.7° | 119.3° |
| C9 | C10 | C11 | H16 | 141.0° | 162.4° |
| C9 | C10 | C11 | H17 | 100.5° | 77.6° |
| C8 | C9 | C10 | C11 | 53.7° | 74.6° |
| C9 | C8 | N7 | C18 | 178.2° | 179.8° |
| C9 | C8 | C18 | C17 | 36.3° | 44.8° |
| C9 | C8 | C18 | C19 | 141.8° | 133.9° |
| C8 | C9 | C10 | H1 | 67.6° | 45.7° |
| C8 | C9 | C10 | H2 | 175.1° | 165.0° |
| C9 | C8 | N7 | H15 | 179.0° | 178.9° |
| C10 | C11 | C12 | H16 | 120.7° | 120.1° |
| C10 | C11 | C12 | H17 | 120.7° | 120.0° |
| C10 | C11 | C12 | C17 | 49.7° | 44.2° |
| C11 | C10 | H1 | H2 | 115.7° | 119.3° |
| C10 | C11 | H16 | H17 | 117.7° | 120.0° |
| C10 | C11 | C12 | H18 | 170.7° | 77.0° |
| C10 | C11 | C12 | H19 | 71.3° | 165.2° |
| N7 | C8 | C18 | C17 | 145.7° | 135.0° |
| N7 | C8 | C18 | C19 | 36.2° | 46.3° |
| C11 | C12 | C17 | H18 | 121.0° | 121.2° |
| C11 | C12 | C17 | H19 | 121.0° | 121.1° |
| C11 | C12 | C17 | C18 | 70.8° | 80.5° |
| C11 | C12 | C17 | C22 | 117.4° | 102.8° |
| C12 | C11 | C10 | H1 | 101.0° | 78.0° |
| C12 | C11 | C10 | H2 | 141.6° | 162.8° |
| C12 | C11 | H16 | H17 | 117.8° | 119.9° |
| C11 | C12 | H18 | H19 | 116.9° | 117.9° |
| C8 | C18 | C17 | C12 | 6.6° | 8.1° |
| C8 | C18 | C17 | C19 | 178.1° | 178.8° |
| C8 | C18 | C17 | C22 | 178.3° | 175.2° |
| C8 | C18 | C19 | C20 | 179.9° | 176.0° |
| C18 | C8 | N7 | H15 | 2.8° | 1.3° |
| C8 | C18 | C19 | H20 | 0.1° | 4.1° |
| C12 | C17 | C18 | C22 | 171.7° | 176.7° |
| C12 | C17 | C18 | C19 | 175.3° | 173.1° |
| C12 | C17 | C22 | C21 | 175.2° | 174.9° |
| C12 | C17 | C22 | H7 | 4.8° | 5.1° |
| C17 | C12 | C11 | H16 | 71.0° | 75.9° |
| C17 | C12 | C11 | H17 | 170.4° | 164.2° |
| C17 | C12 | H18 | H19 | 116.9° | 117.8° |
| C17 | C18 | C19 | C20 | 1.9° | 2.8° |
| C18 | C17 | C22 | C21 | 3.0° | 1.7° |
| C18 | C17 | C22 | H7 | 177.0° | 178.3° |
| C18 | C17 | C12 | H18 | 168.2° | 40.7° |
| C18 | C17 | C12 | H19 | 50.2° | 158.4° |
| C17 | C18 | C19 | H20 | 178.1° | 177.2° |
| C19 | C18 | C17 | C22 | 3.6° | 3.6° |
| C18 | C19 | C20 | H20 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 0.5° | 0.0° |
| C18 | C19 | C20 | C23 | 177.6° | 180.0° |
| C17 | C22 | C21 | H7 | 180.0° | 180.0° |
| C17 | C22 | C21 | C20 | 0.5° | 1.0° |
| C17 | C22 | C21 | H6 | 179.5° | 178.9° |
| C22 | C17 | C12 | H18 | 3.6° | 136.0° |
| C22 | C17 | C12 | H19 | 121.6° | 18.3° |
| C19 | C20 | C21 | C22 | 1.2° | 1.9° |
| C19 | C20 | C21 | C23 | 177.1° | 180.0° |
| C19 | C20 | C23 | N24 | 106.2° | 90.1° |
| C19 | C20 | C21 | H6 | 178.8° | 178.1° |
| C19 | C20 | C23 | H21 | 14.4° | 30.0° |
| C19 | C20 | C23 | H22 | 133.2° | 150.0° |
| C22 | C21 | C20 | H6 | 180.0° | 179.9° |
| C22 | C21 | C20 | C23 | 178.3° | 178.2° |
| C21 | C20 | C23 | N24 | 70.8° | 90.0° |
| C20 | C21 | C22 | H7 | 179.4° | 179.0° |
| C21 | C20 | C19 | H20 | 179.5° | 179.9° |
| C21 | C20 | C23 | H21 | 168.6° | 150.0° |
| C21 | C20 | C23 | H22 | 49.8° | 30.0° |
| C20 | C23 | N24 | H21 | 120.6° | 120.0° |
| C20 | C23 | N24 | H22 | 120.6° | 119.9° |
| C20 | C23 | N24 | C25 | 43.8° | 69.2° |
| C20 | C23 | N24 | C28 | 169.4° | 170.0° |
| C23 | C20 | C21 | H6 | 1.7° | 1.9° |
| C23 | C20 | C19 | H20 | 2.4° | 0.1° |
| C20 | C23 | H21 | H22 | 118.1° | 120.0° |
| C23 | N24 | C25 | C28 | 128.0° | 122.2° |
| C23 | N24 | C25 | C26 | 143.9° | 146.3° |
| C23 | N24 | C28 | C27 | 122.9° | 123.2° |
| C23 | N24 | C28 | H10 | 3.5° | 3.8° |
| C23 | N24 | C28 | H11 | 117.7° | 117.2° |
| N24 | C23 | H21 | H22 | 118.0° | 120.0° |
| C23 | N24 | C25 | H24 | 96.8° | 27.5° |
| C23 | N24 | C25 | H25 | 24.6° | 94.9° |
| O35 | C27 | C26 | C25 | 67.3° | 82.7° |
| O35 | C27 | C28 | N24 | 82.2° | 96.1° |
| O35 | C27 | C26 | C28 | 106.9° | 118.4° |
| O35 | C27 | C26 | C29 | 130.6° | 123.2° |
| O35 | C27 | C28 | C29 | 126.1° | 123.3° |
| O35 | C27 | C29 | C34 | 11.2° | 177.3° |
| O35 | C27 | C29 | C30 | 169.4° | 2.9° |
| O35 | C27 | C26 | H8 | 173.4° | 159.2° |
| O35 | C27 | C26 | H9 | 51.9° | 35.4° |
| O35 | C27 | C28 | H10 | 37.2° | 23.3° |
| O35 | C27 | C28 | H11 | 158.4° | 144.4° |
| N24 | C25 | C26 | H24 | 119.3° | 118.9° |
| N24 | C25 | C26 | H25 | 119.3° | 118.8° |
| N24 | C25 | C26 | C27 | 34.8° | 37.1° |
| C25 | N24 | C28 | C27 | 8.5° | 1.0° |
| N24 | C25 | C26 | H8 | 84.5° | 81.0° |
| N24 | C25 | C26 | H9 | 154.1° | 155.2° |
| C25 | N24 | C28 | H10 | 127.9° | 118.4° |
| C25 | N24 | C28 | H11 | 110.9° | 120.6° |
| C25 | N24 | C23 | H21 | 76.8° | 50.8° |
| C25 | N24 | C23 | H22 | 164.4° | 170.9° |
| N24 | C25 | H24 | H25 | 122.2° | 122.3° |
| C26 | C25 | N24 | C28 | 15.9° | 24.1° |
| C25 | C26 | C27 | H8 | 119.3° | 118.1° |
| C25 | C26 | C27 | H9 | 119.3° | 118.2° |
| C25 | C26 | C27 | C28 | 39.5° | 35.7° |
| C25 | C26 | C27 | C29 | 162.1° | 154.0° |
| C25 | C26 | H8 | H9 | 122.1° | 123.9° |
| C26 | C25 | H24 | H25 | 122.2° | 122.3° |
| N24 | C28 | C27 | C26 | 29.1° | 22.3° |
| N24 | C28 | C27 | H10 | 119.4° | 119.4° |
| N24 | C28 | C27 | H11 | 119.4° | 119.5° |
| N24 | C28 | C27 | C29 | 151.7° | 140.7° |
| N24 | C28 | H10 | H11 | 121.8° | 121.0° |
| C28 | N24 | C23 | H21 | 48.7° | 70.0° |
| C28 | N24 | C23 | H22 | 70.0° | 50.1° |
| C28 | N24 | C25 | H24 | 135.2° | 94.7° |
| C28 | N24 | C25 | H25 | 103.4° | 142.9° |
| C26 | C27 | C28 | C29 | 122.6° | 118.4° |
| C26 | C27 | C29 | C34 | 137.3° | 54.2° |
| C26 | C27 | C29 | C30 | 43.3° | 126.1° |
| C27 | C26 | H8 | H9 | 122.1° | 123.9° |
| C26 | C27 | C28 | H10 | 148.5° | 141.7° |
| C26 | C27 | C28 | H11 | 90.3° | 97.2° |
| C27 | C26 | C25 | H24 | 154.1° | 81.8° |
| C27 | C26 | C25 | H25 | 84.5° | 155.9° |
| C26 | C27 | O35 | H31 | 180.0° | 61.5° |
| C28 | C27 | C29 | C34 | 106.7° | 59.4° |
| C28 | C27 | C29 | C30 | 72.7° | 120.3° |
| C28 | C27 | C26 | H8 | 79.7° | 82.4° |
| C28 | C27 | C26 | H9 | 158.8° | 153.8° |
| C27 | C28 | H10 | H11 | 121.8° | 121.2° |
| C28 | C27 | O35 | H31 | 72.9° | 175.0° |
| C27 | C29 | C34 | C30 | 179.4° | 179.7° |
| C27 | C29 | C34 | C33 | 178.8° | 179.7° |
| C27 | C29 | C30 | C31 | 180.0° | 180.0° |
| C29 | C27 | C26 | H8 | 42.8° | 36.0° |
| C29 | C27 | C26 | H9 | 78.7° | 87.8° |
| C29 | C27 | C28 | H10 | 88.9° | 99.9° |
| C29 | C27 | C28 | H11 | 32.3° | 21.2° |
| C27 | C29 | C30 | H26 | 0.0° | 0.0° |
| C27 | C29 | C34 | H30 | 1.3° | 0.0° |
| C29 | C27 | O35 | H31 | 51.1° | 61.7° |
| C29 | C34 | C33 | H30 | 180.0° | 179.7° |
| C29 | C34 | C33 | C32 | 2.2° | 0.6° |
| C34 | C29 | C30 | C31 | 0.6° | 0.2° |
| C34 | C29 | C30 | H26 | 179.4° | 179.7° |
| C29 | C34 | C33 | H29 | 177.8° | 179.7° |
| C33 | C34 | C29 | C30 | 1.8° | 0.6° |
| C34 | C33 | C32 | H29 | 180.0° | 179.7° |
| C34 | C33 | C32 | C31 | 1.4° | 0.2° |
| C34 | C33 | C32 | H28 | 178.6° | 179.7° |
| C29 | C30 | C31 | H26 | 180.0° | 179.9° |
| C29 | C30 | C31 | C32 | 0.2° | 0.1° |
| C29 | C30 | C31 | H27 | 179.8° | 179.9° |
| C30 | C29 | C34 | H30 | 178.2° | 179.8° |
| C33 | C32 | C31 | C30 | 0.2° | 0.1° |
| C33 | C32 | C31 | H28 | 180.0° | 180.0° |
| C33 | C32 | C31 | H27 | 179.8° | 179.9° |
| C32 | C33 | C34 | H30 | 177.8° | 179.8° |
| C30 | C31 | C32 | H27 | 180.0° | 179.9° |
| C30 | C31 | C32 | H28 | 179.8° | 179.9° |
| C32 | C31 | C30 | H26 | 179.8° | 180.0° |
| C31 | C32 | C33 | H29 | 178.6° | 180.0° |
| H1 | C10 | C11 | H16 | 19.7° | 42.0° |
| H1 | C10 | C11 | H17 | 138.2° | 162.0° |
| H2 | C10 | C11 | H16 | 97.7° | 77.2° |
| H2 | C10 | C11 | H17 | 20.9° | 42.8° |
| H3 | C15 | H4 | H5 | 120.0° | 120.0° |
| H6 | C21 | C22 | H7 | 0.5° | 1.1° |
| H8 | C26 | C25 | H24 | 34.8° | 160.1° |
| H8 | C26 | C25 | H25 | 156.2° | 37.8° |
| H9 | C26 | C25 | H24 | 86.7° | 36.4° |
| H9 | C26 | C25 | H25 | 34.8° | 86.0° |
| H12 | C1 | C2 | H13 | 4.4° | 0.1° |
| H13 | C2 | C3 | H14 | 1.3° | 0.0° |
| H16 | C11 | C12 | H18 | 50.0° | 162.9° |
| H16 | C11 | C12 | H19 | 168.0° | 45.2° |
| H17 | C11 | C12 | H18 | 68.5° | 43.0° |
| H17 | C11 | C12 | H19 | 49.4° | 74.8° |
| H26 | C30 | C31 | H27 | 0.2° | 0.1° |
| H27 | C31 | C32 | H28 | 0.2° | 0.1° |
| H28 | C32 | C33 | H29 | 1.4° | 0.0° |
| H29 | C33 | C34 | H30 | 2.2° | 0.0° |
