0MJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O28 | S26 | doub | 1.42Å | 1.46Å | |
| O27 | S26 | doub | 1.42Å | 1.46Å | |
| N21 | C20 | sing | 1.47Å | 1.48Å | |
| N21 | C23 | sing | 1.47Å | 1.49Å | |
| S26 | N25 | sing | 1.66Å | 1.64Å | |
| S26 | C29 | sing | 1.76Å | 1.78Å | |
| C20 | C22 | sing | 1.53Å | 1.55Å | |
| C22 | N25 | sing | 1.46Å | 1.45Å | |
| C22 | C19 | sing | 1.53Å | 1.55Å | |
| C23 | C18 | sing | 1.53Å | 1.57Å | |
| C34 | C29 | doub | 1.38Å | 1.41Å | Aromatic |
| C34 | C32 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.53Å | 1.56Å | |
| C18 | C17 | sing | 1.51Å | 1.53Å | |
| C29 | C30 | sing | 1.38Å | 1.41Å | Aromatic |
| N16 | C17 | sing | 1.35Å | 1.37Å | |
| N16 | C7 | sing | 1.46Å | 1.48Å | |
| C32 | C31 | doub | 1.38Å | 1.41Å | Aromatic |
| C17 | O24 | doub | 1.21Å | 1.23Å | |
| C30 | C33 | doub | 1.38Å | 1.41Å | Aromatic |
| C7 | C1 | sing | 1.53Å | 1.57Å | |
| C31 | C33 | sing | 1.38Å | 1.41Å | Aromatic |
| C31 | C35 | sing | 1.51Å | 1.54Å | |
| C9 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C9 | C3 | sing | 1.38Å | 1.41Å | Aromatic |
| C1 | C3 | sing | 1.50Å | 1.54Å | |
| C1 | C4 | sing | 1.50Å | 1.54Å | |
| C12 | C14 | sing | 1.38Å | 1.42Å | Aromatic |
| C3 | C5 | doub | 1.39Å | 1.42Å | Aromatic |
| C8 | C4 | doub | 1.38Å | 1.41Å | Aromatic |
| C8 | C13 | sing | 1.38Å | 1.42Å | Aromatic |
| C4 | C6 | sing | 1.39Å | 1.42Å | Aromatic |
| C13 | C15 | doub | 1.38Å | 1.41Å | Aromatic |
| C14 | C10 | doub | 1.38Å | 1.41Å | Aromatic |
| C5 | C10 | sing | 1.39Å | 1.40Å | Aromatic |
| C5 | O2 | sing | 1.35Å | 1.40Å | |
| C6 | O2 | sing | 1.35Å | 1.41Å | |
| C6 | C11 | doub | 1.39Å | 1.42Å | Aromatic |
| C15 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.08Å | 1.08Å | |
| C9 | H5 | sing | 1.08Å | 1.08Å | |
| C10 | H6 | sing | 1.08Å | 1.08Å | |
| C11 | H7 | sing | 1.08Å | 1.08Å | |
| C12 | H8 | sing | 1.08Å | 1.08Å | |
| C13 | H9 | sing | 1.08Å | 1.08Å | |
| C14 | H10 | sing | 1.08Å | 1.08Å | |
| C15 | H11 | sing | 1.08Å | 1.08Å | |
| N16 | H12 | sing | 0.97Å | 1.00Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C19 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| N21 | H18 | sing | 1.01Å | 1.00Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| N25 | H23 | sing | 0.97Å | 1.00Å | |
| C30 | H24 | sing | 1.08Å | 1.08Å | |
| C32 | H25 | sing | 1.08Å | 1.08Å | |
| C33 | H26 | sing | 1.08Å | 1.08Å | |
| C34 | H27 | sing | 1.08Å | 1.08Å | |
| C35 | H28 | sing | 1.09Å | 1.10Å | |
| C35 | H29 | sing | 1.09Å | 1.10Å | |
| C35 | H30 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O28 | S26 | O27 | 117.0° | 123.2° |
| O28 | S26 | N25 | 110.2° | 106.4° |
| O28 | S26 | C29 | 109.3° | 106.4° |
| O27 | S26 | N25 | 108.5° | 106.4° |
| O27 | S26 | C29 | 110.9° | 106.4° |
| C20 | N21 | C23 | 115.3° | 111.2° |
| N21 | C20 | C22 | 108.6° | 109.5° |
| N21 | C20 | H16 | 109.7° | 109.5° |
| N21 | C20 | H17 | 109.7° | 109.5° |
| C20 | N21 | H18 | 108.0° | 111.0° |
| N21 | C23 | C18 | 112.1° | 109.6° |
| C23 | N21 | H18 | 108.0° | 111.0° |
| N21 | C23 | H21 | 108.8° | 109.5° |
| N21 | C23 | H22 | 108.8° | 109.5° |
| N25 | S26 | C29 | 99.6° | 107.2° |
| S26 | N25 | C22 | 124.0° | 120.0° |
| S26 | N25 | H23 | 105.7° | 120.0° |
| S26 | C29 | C34 | 120.1° | 120.0° |
| S26 | C29 | C30 | 120.4° | 120.0° |
| C20 | C22 | N25 | 111.4° | 109.5° |
| C20 | C22 | C19 | 111.7° | 109.3° |
| C22 | C20 | H16 | 109.7° | 109.4° |
| C22 | C20 | H17 | 109.7° | 109.5° |
| C20 | C22 | H20 | 107.1° | 109.5° |
| N25 | C22 | C19 | 110.9° | 109.5° |
| N25 | C22 | H20 | 108.3° | 109.5° |
| C22 | N25 | H23 | 105.7° | 120.0° |
| C22 | C19 | C18 | 109.8° | 109.2° |
| C22 | C19 | H14 | 109.4° | 109.5° |
| C22 | C19 | H15 | 109.4° | 109.6° |
| C19 | C22 | H20 | 107.1° | 109.5° |
| C23 | C18 | C19 | 109.9° | 109.3° |
| C23 | C18 | C17 | 113.3° | 109.6° |
| C23 | C18 | H13 | 106.2° | 109.5° |
| C18 | C23 | H21 | 108.8° | 109.4° |
| C18 | C23 | H22 | 108.8° | 109.5° |
| C29 | C34 | C32 | 120.2° | 120.0° |
| C34 | C29 | C30 | 119.5° | 120.0° |
| C29 | C34 | H27 | 119.9° | 120.0° |
| C34 | C32 | C31 | 120.5° | 120.0° |
| C34 | C32 | H25 | 119.8° | 120.0° |
| C32 | C34 | H27 | 119.9° | 120.0° |
| C19 | C18 | C17 | 113.9° | 109.5° |
| C19 | C18 | H13 | 106.3° | 109.5° |
| C18 | C19 | H14 | 109.4° | 109.5° |
| C18 | C19 | H15 | 109.4° | 109.5° |
| C18 | C17 | N16 | 118.3° | 120.0° |
| C18 | C17 | O24 | 118.4° | 120.0° |
| C17 | C18 | H13 | 106.7° | 109.5° |
| C29 | C30 | C33 | 120.3° | 120.0° |
| C29 | C30 | H24 | 119.8° | 120.0° |
| C17 | N16 | C7 | 125.9° | 120.0° |
| N16 | C17 | O24 | 123.2° | 120.0° |
| C17 | N16 | H12 | 117.1° | 120.0° |
| N16 | C7 | C1 | 113.7° | 109.5° |
| N16 | C7 | H2 | 108.4° | 109.4° |
| N16 | C7 | H3 | 108.4° | 109.5° |
| C7 | N16 | H12 | 117.0° | 120.0° |
| C32 | C31 | C33 | 119.6° | 120.0° |
| C32 | C31 | C35 | 120.4° | 120.0° |
| C31 | C32 | H25 | 119.8° | 120.0° |
| C30 | C33 | C31 | 120.0° | 120.0° |
| C33 | C30 | H24 | 119.9° | 120.0° |
| C30 | C33 | H26 | 120.0° | 120.0° |
| C7 | C1 | C3 | 108.4° | 109.3° |
| C7 | C1 | C4 | 109.5° | 109.2° |
| C7 | C1 | H1 | 109.7° | 109.2° |
| C1 | C7 | H2 | 108.4° | 109.5° |
| C1 | C7 | H3 | 108.4° | 109.4° |
| C33 | C31 | C35 | 120.0° | 120.0° |
| C31 | C33 | H26 | 120.0° | 120.0° |
| C31 | C35 | H28 | 109.5° | 109.4° |
| C31 | C35 | H29 | 109.4° | 109.5° |
| C31 | C35 | H30 | 109.4° | 109.4° |
| C12 | C9 | C3 | 119.4° | 120.3° |
| C9 | C12 | C14 | 118.9° | 120.0° |
| C12 | C9 | H5 | 120.3° | 119.9° |
| C9 | C12 | H8 | 120.5° | 120.0° |
| C9 | C3 | C1 | 120.2° | 119.4° |
| C9 | C3 | C5 | 120.8° | 119.9° |
| C3 | C9 | H5 | 120.3° | 119.9° |
| C3 | C1 | C4 | 109.2° | 110.5° |
| C1 | C3 | C5 | 119.0° | 120.7° |
| C3 | C1 | H1 | 110.1° | 109.3° |
| C1 | C4 | C8 | 122.3° | 119.4° |
| C1 | C4 | C6 | 119.3° | 120.7° |
| C4 | C1 | H1 | 110.0° | 109.3° |
| C12 | C14 | C10 | 122.4° | 120.0° |
| C14 | C12 | H8 | 120.5° | 120.0° |
| C12 | C14 | H10 | 118.8° | 119.9° |
| C3 | C5 | C10 | 120.3° | 119.7° |
| C3 | C5 | O2 | 120.9° | 121.1° |
| C4 | C8 | C13 | 120.4° | 120.2° |
| C8 | C4 | C6 | 118.4° | 119.9° |
| C4 | C8 | H4 | 119.8° | 119.9° |
| C8 | C13 | C15 | 121.3° | 120.0° |
| C13 | C8 | H4 | 119.8° | 119.9° |
| C8 | C13 | H9 | 119.4° | 120.0° |
| C4 | C6 | O2 | 120.1° | 121.0° |
| C4 | C6 | C11 | 120.4° | 119.7° |
| C13 | C15 | C11 | 118.2° | 120.0° |
| C15 | C13 | H9 | 119.4° | 120.0° |
| C13 | C15 | H11 | 120.9° | 119.9° |
| C14 | C10 | C5 | 118.1° | 120.1° |
| C14 | C10 | H6 | 121.0° | 119.9° |
| C10 | C14 | H10 | 118.8° | 120.0° |
| C10 | C5 | O2 | 118.7° | 119.2° |
| C5 | C10 | H6 | 120.9° | 119.9° |
| C5 | O2 | C6 | 117.3° | 120.0° |
| O2 | C6 | C11 | 119.5° | 119.3° |
| C6 | C11 | C15 | 121.3° | 120.2° |
| C6 | C11 | H7 | 119.3° | 119.9° |
| C15 | C11 | H7 | 119.3° | 120.0° |
| C11 | C15 | H11 | 120.9° | 120.1° |
| H2 | C7 | H3 | 109.5° | 109.5° |
| H14 | C19 | H15 | 109.5° | 109.5° |
| H16 | C20 | H17 | 109.5° | 109.5° |
| H21 | C23 | H22 | 109.5° | 109.4° |
| H28 | C35 | H29 | 109.5° | 109.5° |
| H28 | C35 | H30 | 109.5° | 109.5° |
| H29 | C35 | H30 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O28 | S26 | O27 | N25 | 125.3° | 123.0° |
| O28 | S26 | O27 | C29 | 126.3° | 122.9° |
| O28 | S26 | N25 | C29 | 114.8° | 113.5° |
| O28 | S26 | N25 | C22 | 2.2° | 48.6° |
| O28 | S26 | C29 | C34 | 6.2° | 23.3° |
| O28 | S26 | C29 | C30 | 175.3° | 156.5° |
| O28 | S26 | N25 | H23 | 124.2° | 131.5° |
| O27 | S26 | N25 | C29 | 116.0° | 113.5° |
| O27 | S26 | N25 | C22 | 127.0° | 178.5° |
| O27 | S26 | C29 | C34 | 124.2° | 156.2° |
| O27 | S26 | C29 | C30 | 54.2° | 23.6° |
| O27 | S26 | N25 | H23 | 5.1° | 1.4° |
| C20 | N21 | C23 | H18 | 120.8° | 124.1° |
| N21 | C20 | C22 | H16 | 119.9° | 120.0° |
| N21 | C20 | C22 | H17 | 119.9° | 120.1° |
| N21 | C20 | C22 | N25 | 177.8° | 179.1° |
| N21 | C20 | C22 | C19 | 57.5° | 59.1° |
| C20 | N21 | C23 | C18 | 55.0° | 61.7° |
| N21 | C20 | H16 | H17 | 120.4° | 120.0° |
| N21 | C20 | C22 | H20 | 59.5° | 60.8° |
| C20 | N21 | C23 | H21 | 175.4° | 58.3° |
| C20 | N21 | C23 | H22 | 65.4° | 178.2° |
| C23 | N21 | C20 | C22 | 56.5° | 61.7° |
| N21 | C23 | C18 | H21 | 120.4° | 120.0° |
| N21 | C23 | C18 | H22 | 120.4° | 120.1° |
| N21 | C23 | C18 | C19 | 51.6° | 59.1° |
| N21 | C23 | C18 | C17 | 179.7° | 179.1° |
| N21 | C23 | C18 | H13 | 63.0° | 60.8° |
| C23 | N21 | C20 | H16 | 63.4° | 58.2° |
| C23 | N21 | C20 | H17 | 176.4° | 178.2° |
| N21 | C23 | H21 | H22 | 118.8° | 120.0° |
| S26 | N25 | C22 | C20 | 123.4° | 95.0° |
| S26 | N25 | C22 | H23 | 122.0° | 179.9° |
| S26 | N25 | C22 | C19 | 111.5° | 145.2° |
| N25 | S26 | C29 | C34 | 121.6° | 90.2° |
| N25 | S26 | C29 | C30 | 59.9° | 90.0° |
| S26 | N25 | C22 | H20 | 5.8° | 25.0° |
| C29 | S26 | N25 | C22 | 117.0° | 65.0° |
| S26 | C29 | C34 | C30 | 178.5° | 179.8° |
| S26 | C29 | C34 | C32 | 178.6° | 180.0° |
| S26 | C29 | C30 | C33 | 179.0° | 180.0° |
| C29 | S26 | N25 | H23 | 121.1° | 115.0° |
| S26 | C29 | C30 | H24 | 1.0° | 0.0° |
| S26 | C29 | C34 | H27 | 1.4° | 0.0° |
| C20 | C22 | N25 | C19 | 125.1° | 119.8° |
| C20 | C22 | N25 | H20 | 117.6° | 120.0° |
| C20 | C22 | C19 | H20 | 117.0° | 119.9° |
| C20 | C22 | C19 | C18 | 57.8° | 57.6° |
| C20 | C22 | C19 | H14 | 62.3° | 177.5° |
| C20 | C22 | C19 | H15 | 177.9° | 62.3° |
| C22 | C20 | H16 | H17 | 120.4° | 120.0° |
| C22 | C20 | N21 | H18 | 64.4° | 62.4° |
| C20 | C22 | N25 | H23 | 1.4° | 85.1° |
| N25 | C22 | C19 | H20 | 118.0° | 120.1° |
| N25 | C22 | C19 | C18 | 177.3° | 177.6° |
| N25 | C22 | C19 | H14 | 62.7° | 62.5° |
| N25 | C22 | C19 | H15 | 57.2° | 57.6° |
| N25 | C22 | C20 | H16 | 62.3° | 59.2° |
| N25 | C22 | C20 | H17 | 57.9° | 60.8° |
| C22 | C19 | C18 | C23 | 53.4° | 57.6° |
| C22 | C19 | C18 | H14 | 120.0° | 119.9° |
| C22 | C19 | C18 | H15 | 120.1° | 120.0° |
| C22 | C19 | C18 | C17 | 178.3° | 177.6° |
| C22 | C19 | C18 | H13 | 61.2° | 62.3° |
| C22 | C19 | H14 | H15 | 119.8° | 120.2° |
| C19 | C22 | C20 | H16 | 62.3° | 60.8° |
| C19 | C22 | C20 | H17 | 177.4° | 179.2° |
| C19 | C22 | N25 | H23 | 126.6° | 34.8° |
| C23 | C18 | C19 | C17 | 128.3° | 120.0° |
| C23 | C18 | C19 | H13 | 114.5° | 119.9° |
| C23 | C18 | C17 | H13 | 116.5° | 120.1° |
| C23 | C18 | C17 | N16 | 55.0° | 60.2° |
| C23 | C18 | C17 | O24 | 124.8° | 119.9° |
| C23 | C18 | C19 | H14 | 66.7° | 177.5° |
| C23 | C18 | C19 | H15 | 173.4° | 62.4° |
| C18 | C23 | N21 | H18 | 65.9° | 62.4° |
| C18 | C23 | H21 | H22 | 118.8° | 119.9° |
| C29 | C34 | C32 | H27 | 180.0° | 180.0° |
| C29 | C34 | C32 | C31 | 0.6° | 0.0° |
| C34 | C29 | C30 | C33 | 0.5° | 0.3° |
| C34 | C29 | C30 | H24 | 179.5° | 179.8° |
| C29 | C34 | C32 | H25 | 179.4° | 179.8° |
| C32 | C34 | C29 | C30 | 0.1° | 0.3° |
| C34 | C32 | C31 | H25 | 180.0° | 179.8° |
| C34 | C32 | C31 | C33 | 0.9° | 0.2° |
| C34 | C32 | C31 | C35 | 179.5° | 180.0° |
| C19 | C18 | C17 | H13 | 116.9° | 120.1° |
| C19 | C18 | C17 | N16 | 178.4° | 180.0° |
| C19 | C18 | C17 | O24 | 1.8° | 0.0° |
| C18 | C19 | H14 | H15 | 119.9° | 120.1° |
| C18 | C19 | C22 | H20 | 59.2° | 62.3° |
| C19 | C18 | C23 | H21 | 172.0° | 60.9° |
| C19 | C18 | C23 | H22 | 68.8° | 179.3° |
| C18 | C17 | N16 | O24 | 179.8° | 180.0° |
| C18 | C17 | N16 | C7 | 177.2° | 180.0° |
| C18 | C17 | N16 | H12 | 2.8° | 0.1° |
| C17 | C18 | C19 | H14 | 61.7° | 62.5° |
| C17 | C18 | C19 | H15 | 58.2° | 57.6° |
| C17 | C18 | C23 | H21 | 59.3° | 59.1° |
| C17 | C18 | C23 | H22 | 59.9° | 60.7° |
| C29 | C30 | C33 | H24 | 180.0° | 180.0° |
| C29 | C30 | C33 | C31 | 0.1° | 0.0° |
| C29 | C30 | C33 | H26 | 179.9° | 180.0° |
| C30 | C29 | C34 | H27 | 179.9° | 179.7° |
| C17 | N16 | C7 | H12 | 180.0° | 179.9° |
| C17 | N16 | C7 | C1 | 106.6° | 180.0° |
| C17 | N16 | C7 | H2 | 14.0° | 60.0° |
| C17 | N16 | C7 | H3 | 132.8° | 60.0° |
| N16 | C17 | C18 | H13 | 61.5° | 59.9° |
| C7 | N16 | C17 | O24 | 2.5° | 0.0° |
| N16 | C7 | C1 | H2 | 120.6° | 120.0° |
| N16 | C7 | C1 | H3 | 120.6° | 120.0° |
| N16 | C7 | C1 | C3 | 49.1° | 175.0° |
| N16 | C7 | C1 | C4 | 168.1° | 64.0° |
| N16 | C7 | C1 | H1 | 71.1° | 55.5° |
| N16 | C7 | H2 | H3 | 118.1° | 120.0° |
| C32 | C31 | C33 | C30 | 0.6° | 0.2° |
| C32 | C31 | C33 | C35 | 179.6° | 179.8° |
| C32 | C31 | C33 | H26 | 179.4° | 179.8° |
| C31 | C32 | C34 | H27 | 179.4° | 180.0° |
| C32 | C31 | C35 | H28 | 90.2° | 89.8° |
| C32 | C31 | C35 | H29 | 149.8° | 30.2° |
| C32 | C31 | C35 | H30 | 29.8° | 150.2° |
| O24 | C17 | N16 | H12 | 177.5° | 180.0° |
| O24 | C17 | C18 | H13 | 118.7° | 120.1° |
| C30 | C33 | C31 | H26 | 180.0° | 180.0° |
| C30 | C33 | C31 | C35 | 179.8° | 180.0° |
| C7 | C1 | C3 | C9 | 90.4° | 77.9° |
| C7 | C1 | C3 | C4 | 119.2° | 120.2° |
| C7 | C1 | C3 | H1 | 120.0° | 119.4° |
| C7 | C1 | C4 | H1 | 120.6° | 119.4° |
| C7 | C1 | C3 | C5 | 88.5° | 102.2° |
| C7 | C1 | C4 | C8 | 90.8° | 77.9° |
| C7 | C1 | C4 | C6 | 89.0° | 102.2° |
| C1 | C7 | H2 | H3 | 118.1° | 119.9° |
| C1 | C7 | N16 | H12 | 73.4° | 0.0° |
| C31 | C33 | C30 | H24 | 179.8° | 180.0° |
| C33 | C31 | C32 | H25 | 179.1° | 180.0° |
| C33 | C31 | C35 | H28 | 90.2° | 90.0° |
| C33 | C31 | C35 | H29 | 29.8° | 150.0° |
| C33 | C31 | C35 | H30 | 149.8° | 30.0° |
| C35 | C31 | C32 | H25 | 0.5° | 0.2° |
| C35 | C31 | C33 | H26 | 0.2° | 0.0° |
| C31 | C35 | H28 | H29 | 120.0° | 120.0° |
| C31 | C35 | H28 | H30 | 120.0° | 119.9° |
| C31 | C35 | H29 | H30 | 120.0° | 120.0° |
| C12 | C9 | C3 | H5 | 180.0° | 180.0° |
| C12 | C9 | C3 | C1 | 177.4° | 180.0° |
| C9 | C12 | C14 | H8 | 180.0° | 180.0° |
| C12 | C9 | C3 | C5 | 1.6° | 0.1° |
| C9 | C12 | C14 | C10 | 1.9° | 0.2° |
| C9 | C12 | C14 | H10 | 178.0° | 180.0° |
| C9 | C3 | C1 | C5 | 179.0° | 179.9° |
| C9 | C3 | C1 | C4 | 150.4° | 161.8° |
| C3 | C9 | C12 | C14 | 2.8° | 0.1° |
| C9 | C3 | C5 | C10 | 0.6° | 0.1° |
| C9 | C3 | C5 | O2 | 177.5° | 179.9° |
| C9 | C3 | C1 | H1 | 29.5° | 41.5° |
| C3 | C9 | C12 | H8 | 177.2° | 180.0° |
| C3 | C1 | C4 | H1 | 120.9° | 120.4° |
| C3 | C1 | C4 | C8 | 150.7° | 161.9° |
| C3 | C1 | C4 | C6 | 29.5° | 18.1° |
| C1 | C3 | C5 | C10 | 179.6° | 180.0° |
| C1 | C3 | C5 | O2 | 3.5° | 0.0° |
| C3 | C1 | C7 | H2 | 71.5° | 65.0° |
| C3 | C1 | C7 | H3 | 169.8° | 55.0° |
| C1 | C3 | C9 | H5 | 2.6° | 0.0° |
| C4 | C1 | C3 | C5 | 30.6° | 18.1° |
| C1 | C4 | C8 | C6 | 179.8° | 179.9° |
| C1 | C4 | C8 | C13 | 179.8° | 180.0° |
| C1 | C4 | C6 | O2 | 1.2° | 0.0° |
| C1 | C4 | C6 | C11 | 179.4° | 180.0° |
| C4 | C1 | C7 | H2 | 47.5° | 56.0° |
| C4 | C1 | C7 | H3 | 71.2° | 176.0° |
| C1 | C4 | C8 | H4 | 0.2° | 0.0° |
| C12 | C14 | C10 | H10 | 180.0° | 179.9° |
| C12 | C14 | C10 | C5 | 0.2° | 0.1° |
| C14 | C12 | C9 | H5 | 177.2° | 179.9° |
| C12 | C14 | C10 | H6 | 179.8° | 180.0° |
| C3 | C5 | C10 | C14 | 1.5° | 0.0° |
| C3 | C5 | C10 | O2 | 177.0° | 180.0° |
| C3 | C5 | O2 | C6 | 28.3° | 20.7° |
| C5 | C3 | C1 | H1 | 151.5° | 138.4° |
| C5 | C3 | C9 | H5 | 178.4° | 179.9° |
| C3 | C5 | C10 | H6 | 178.6° | 179.9° |
| C4 | C8 | C13 | H4 | 180.0° | 180.0° |
| C4 | C8 | C13 | C15 | 0.4° | 0.0° |
| C8 | C4 | C6 | O2 | 178.9° | 179.9° |
| C8 | C4 | C6 | C11 | 0.8° | 0.1° |
| C8 | C4 | C1 | H1 | 29.8° | 41.5° |
| C4 | C8 | C13 | H9 | 179.6° | 180.0° |
| C13 | C8 | C4 | C6 | 0.4° | 0.1° |
| C8 | C13 | C15 | H9 | 180.0° | 180.0° |
| C8 | C13 | C15 | C11 | 0.8° | 0.0° |
| C8 | C13 | C15 | H11 | 179.2° | 180.0° |
| C4 | C6 | O2 | C5 | 29.3° | 20.6° |
| C4 | C6 | O2 | C11 | 178.2° | 180.0° |
| C4 | C6 | C11 | C15 | 1.3° | 0.0° |
| C6 | C4 | C1 | H1 | 150.4° | 138.4° |
| C6 | C4 | C8 | H4 | 179.6° | 179.9° |
| C4 | C6 | C11 | H7 | 178.7° | 180.0° |
| C13 | C15 | C11 | C6 | 1.3° | 0.0° |
| C13 | C15 | C11 | H11 | 180.0° | 180.0° |
| C15 | C13 | C8 | H4 | 179.6° | 180.0° |
| C13 | C15 | C11 | H7 | 178.7° | 180.0° |
| C14 | C10 | C5 | H6 | 180.0° | 179.9° |
| C14 | C10 | C5 | O2 | 178.4° | 180.0° |
| C10 | C14 | C12 | H8 | 178.0° | 179.9° |
| C10 | C5 | O2 | C6 | 148.7° | 159.3° |
| C5 | C10 | C14 | H10 | 179.8° | 180.0° |
| C5 | O2 | C6 | C11 | 148.8° | 159.3° |
| O2 | C5 | C10 | H6 | 1.6° | 0.1° |
| O2 | C6 | C11 | C15 | 179.4° | 180.0° |
| O2 | C6 | C11 | H7 | 0.6° | 0.0° |
| C6 | C11 | C15 | H7 | 180.0° | 180.0° |
| C6 | C11 | C15 | H11 | 178.7° | 180.0° |
| C11 | C15 | C13 | H9 | 179.2° | 180.0° |
| H1 | C1 | C7 | H2 | 168.3° | 175.5° |
| H1 | C1 | C7 | H3 | 49.6° | 64.5° |
| H2 | C7 | N16 | H12 | 166.0° | 120.1° |
| H3 | C7 | N16 | H12 | 47.2° | 119.9° |
| H4 | C8 | C13 | H9 | 0.4° | 0.0° |
| H5 | C9 | C12 | H8 | 2.8° | 0.0° |
| H6 | C10 | C14 | H10 | 0.2° | 0.1° |
| H7 | C11 | C15 | H11 | 1.3° | 0.1° |
| H8 | C12 | C14 | H10 | 2.0° | 0.0° |
| H9 | C13 | C15 | H11 | 0.8° | 0.0° |
| H13 | C18 | C19 | H14 | 178.8° | 57.6° |
| H13 | C18 | C19 | H15 | 58.9° | 177.8° |
| H13 | C18 | C23 | H21 | 57.4° | 179.2° |
| H13 | C18 | C23 | H22 | 176.6° | 59.4° |
| H14 | C19 | C22 | H20 | 179.3° | 57.6° |
| H15 | C19 | C22 | H20 | 60.8° | 177.8° |
| H16 | C20 | N21 | H18 | 175.8° | 177.7° |
| H16 | C20 | C22 | H20 | 179.4° | 179.2° |
| H17 | C20 | N21 | H18 | 55.5° | 57.7° |
| H17 | C20 | C22 | H20 | 60.4° | 59.2° |
| H18 | N21 | C23 | H21 | 54.5° | 177.6° |
| H18 | N21 | C23 | H22 | 173.8° | 57.7° |
| H20 | C22 | N25 | H23 | 116.1° | 154.9° |
| H24 | C30 | C33 | H26 | 0.2° | 0.0° |
| H25 | C32 | C34 | H27 | 0.6° | 0.3° |
| H28 | C35 | H29 | H30 | 120.0° | 120.0° |
