7VH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O38 | S34 | doub | 1.42Å | 1.49Å | |
| O35 | S34 | doub | 1.42Å | 1.43Å | |
| S34 | C36 | sing | 1.81Å | 1.83Å | |
| S34 | N33 | sing | 1.66Å | 1.72Å | |
| CL1 | C02 | sing | 1.74Å | 1.78Å | |
| C36 | C37 | sing | 1.53Å | 1.56Å | |
| N33 | C32 | sing | 1.36Å | 1.37Å | Aromatic |
| N33 | C39 | sing | 1.38Å | 1.37Å | Aromatic |
| C32 | C31 | doub | 1.36Å | 1.38Å | Aromatic |
| C39 | C40 | doub | 1.39Å | 1.43Å | Aromatic |
| C39 | C44 | sing | 1.41Å | 1.39Å | Aromatic |
| C02 | C30 | doub | 1.40Å | 1.40Å | Aromatic |
| C02 | C03 | sing | 1.38Å | 1.40Å | Aromatic |
| C40 | C41 | sing | 1.38Å | 1.40Å | Aromatic |
| C31 | C44 | sing | 1.47Å | 1.42Å | Aromatic |
| C31 | C30 | sing | 1.48Å | 1.57Å | |
| C44 | C43 | doub | 1.39Å | 1.42Å | Aromatic |
| C30 | N29 | sing | 1.33Å | 1.30Å | Aromatic |
| C03 | N04 | doub | 1.32Å | 1.33Å | Aromatic |
| C41 | C42 | doub | 1.39Å | 1.41Å | Aromatic |
| C43 | C42 | sing | 1.38Å | 1.40Å | Aromatic |
| N29 | C05 | doub | 1.32Å | 1.33Å | Aromatic |
| N04 | C05 | sing | 1.33Å | 1.32Å | Aromatic |
| C05 | N06 | sing | 1.39Å | 1.43Å | |
| N06 | C07 | sing | 1.40Å | 1.49Å | |
| C08 | C07 | doub | 1.39Å | 1.41Å | Aromatic |
| C08 | C09 | sing | 1.38Å | 1.42Å | Aromatic |
| C07 | C26 | sing | 1.39Å | 1.37Å | Aromatic |
| CL2 | C09 | sing | 1.74Å | 1.82Å | |
| C09 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C26 | O27 | sing | 1.36Å | 1.43Å | |
| C26 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| O27 | C28 | sing | 1.43Å | 1.42Å | |
| C11 | C25 | sing | 1.39Å | 1.43Å | Aromatic |
| C11 | N12 | sing | 1.40Å | 1.49Å | |
| C24 | N12 | sing | 1.47Å | 1.54Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| N12 | C13 | sing | 1.47Å | 1.54Å | |
| C23 | C15 | sing | 1.53Å | 1.46Å | |
| C13 | C14 | sing | 1.53Å | 1.54Å | |
| C15 | C14 | sing | 1.53Å | 1.46Å | |
| C15 | N16 | sing | 1.47Å | 1.33Å | |
| C17 | N16 | sing | 1.47Å | 1.36Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| N16 | C22 | sing | 1.47Å | 1.37Å | |
| C18 | N19 | sing | 1.47Å | 1.37Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| N19 | C21 | sing | 1.47Å | 1.37Å | |
| N19 | C20 | sing | 1.47Å | 1.29Å | |
| C14 | H1 | sing | 1.09Å | 1.10Å | |
| C14 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C03 | H5 | sing | 1.08Å | 1.08Å | |
| C08 | H6 | sing | 1.08Å | 1.08Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.09Å | 1.10Å | |
| C17 | H9 | sing | 1.09Å | 1.10Å | |
| C18 | H10 | sing | 1.09Å | 1.10Å | |
| C18 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C24 | H21 | sing | 1.09Å | 1.10Å | |
| C24 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.08Å | 1.08Å | |
| C28 | H24 | sing | 1.09Å | 1.10Å | |
| C28 | H25 | sing | 1.09Å | 1.10Å | |
| C28 | H26 | sing | 1.09Å | 1.10Å | |
| C32 | H27 | sing | 1.08Å | 1.08Å | |
| C36 | H28 | sing | 1.09Å | 1.10Å | |
| C36 | H29 | sing | 1.09Å | 1.10Å | |
| C37 | H30 | sing | 1.09Å | 1.10Å | |
| C37 | H31 | sing | 1.09Å | 1.10Å | |
| C37 | H32 | sing | 1.09Å | 1.10Å | |
| C40 | H33 | sing | 1.08Å | 1.08Å | |
| C41 | H34 | sing | 1.08Å | 1.08Å | |
| C42 | H35 | sing | 1.08Å | 1.08Å | |
| C43 | H36 | sing | 1.08Å | 1.08Å | |
| N06 | H37 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O38 | S34 | O35 | 102.8° | 121.0° |
| O38 | S34 | C36 | 112.2° | 110.5° |
| O38 | S34 | N33 | 112.8° | 104.3° |
| O35 | S34 | C36 | 112.4° | 110.5° |
| O35 | S34 | N33 | 112.7° | 104.3° |
| C36 | S34 | N33 | 104.4° | 104.5° |
| S34 | C36 | C37 | 109.3° | 109.5° |
| S34 | C36 | H28 | 109.5° | 109.5° |
| S34 | C36 | H29 | 109.5° | 109.5° |
| S34 | N33 | C32 | 127.2° | 124.9° |
| S34 | N33 | C39 | 122.9° | 124.9° |
| CL1 | C02 | C30 | 121.6° | 120.8° |
| CL1 | C02 | C03 | 119.4° | 120.8° |
| C37 | C36 | H28 | 109.5° | 109.4° |
| C37 | C36 | H29 | 109.5° | 109.5° |
| C36 | C37 | H30 | 109.5° | 109.5° |
| C36 | C37 | H31 | 109.5° | 109.4° |
| C36 | C37 | H32 | 109.5° | 109.5° |
| C32 | N33 | C39 | 109.9° | 110.2° |
| N33 | C32 | C31 | 107.3° | 109.8° |
| N33 | C32 | H27 | 126.3° | 125.1° |
| N33 | C39 | C40 | 130.5° | 133.3° |
| N33 | C39 | C44 | 108.2° | 107.4° |
| C32 | C31 | C44 | 108.1° | 106.6° |
| C32 | C31 | C30 | 126.8° | 126.7° |
| C31 | C32 | H27 | 126.3° | 125.1° |
| C40 | C39 | C44 | 121.3° | 119.4° |
| C39 | C40 | C41 | 118.7° | 120.0° |
| C39 | C40 | H33 | 120.6° | 120.0° |
| C39 | C44 | C31 | 106.4° | 106.0° |
| C39 | C44 | C43 | 119.8° | 120.1° |
| C30 | C02 | C03 | 118.9° | 118.4° |
| C02 | C30 | C31 | 125.5° | 120.5° |
| C02 | C30 | N29 | 117.6° | 118.9° |
| C02 | C03 | N04 | 119.1° | 119.3° |
| C02 | C03 | H5 | 120.4° | 120.3° |
| C40 | C41 | C42 | 119.9° | 120.6° |
| C41 | C40 | H33 | 120.6° | 120.0° |
| C40 | C41 | H34 | 120.1° | 119.7° |
| C44 | C31 | C30 | 125.0° | 126.7° |
| C31 | C44 | C43 | 133.8° | 133.9° |
| C31 | C30 | N29 | 116.8° | 120.5° |
| C44 | C43 | C42 | 118.9° | 119.6° |
| C44 | C43 | H36 | 120.5° | 120.2° |
| C30 | N29 | C05 | 122.4° | 120.6° |
| C03 | N04 | C05 | 119.8° | 121.0° |
| N04 | C03 | H5 | 120.4° | 120.4° |
| C41 | C42 | C43 | 121.4° | 120.4° |
| C42 | C41 | H34 | 120.0° | 119.7° |
| C41 | C42 | H35 | 119.3° | 119.8° |
| C43 | C42 | H35 | 119.3° | 119.9° |
| C42 | C43 | H36 | 120.6° | 120.2° |
| N29 | C05 | N04 | 122.1° | 121.7° |
| N29 | C05 | N06 | 119.9° | 119.1° |
| N04 | C05 | N06 | 118.0° | 119.1° |
| C05 | N06 | C07 | 124.7° | 120.0° |
| C05 | N06 | H37 | 117.6° | 120.0° |
| N06 | C07 | C08 | 125.2° | 120.0° |
| N06 | C07 | C26 | 112.4° | 120.0° |
| C07 | N06 | H37 | 117.7° | 120.0° |
| C07 | C08 | C09 | 118.4° | 120.0° |
| C08 | C07 | C26 | 122.3° | 120.0° |
| C07 | C08 | H6 | 120.8° | 119.9° |
| C08 | C09 | CL2 | 117.2° | 120.0° |
| C08 | C09 | C11 | 119.5° | 120.1° |
| C09 | C08 | H6 | 120.8° | 120.0° |
| C07 | C26 | O27 | 114.4° | 120.0° |
| C07 | C26 | C25 | 120.4° | 120.0° |
| CL2 | C09 | C11 | 123.2° | 120.0° |
| C09 | C11 | C25 | 121.2° | 120.0° |
| C09 | C11 | N12 | 120.6° | 120.0° |
| O27 | C26 | C25 | 125.1° | 120.0° |
| C26 | O27 | C28 | 116.8° | 117.0° |
| C26 | C25 | C11 | 118.1° | 119.9° |
| C26 | C25 | H23 | 120.9° | 120.1° |
| O27 | C28 | H24 | 109.5° | 109.4° |
| O27 | C28 | H25 | 109.5° | 109.5° |
| O27 | C28 | H26 | 109.5° | 109.5° |
| C25 | C11 | N12 | 118.3° | 120.0° |
| C11 | C25 | H23 | 121.0° | 120.0° |
| C11 | N12 | C24 | 121.1° | 111.0° |
| C11 | N12 | C13 | 122.2° | 111.0° |
| N12 | C24 | C23 | 112.8° | 109.6° |
| C24 | N12 | C13 | 108.5° | 111.2° |
| N12 | C24 | H21 | 108.6° | 109.5° |
| N12 | C24 | H22 | 108.7° | 109.5° |
| C24 | C23 | C15 | 114.3° | 109.3° |
| C24 | C23 | H19 | 108.3° | 109.5° |
| C24 | C23 | H20 | 108.2° | 109.6° |
| C23 | C24 | H21 | 108.7° | 109.5° |
| C23 | C24 | H22 | 108.6° | 109.4° |
| N12 | C13 | C14 | 110.9° | 109.5° |
| N12 | C13 | H3 | 109.1° | 109.5° |
| N12 | C13 | H4 | 109.1° | 109.4° |
| C23 | C15 | C14 | 112.5° | 109.2° |
| C23 | C15 | N16 | 116.6° | 109.5° |
| C23 | C15 | H7 | 108.2° | 109.6° |
| C15 | C23 | H19 | 108.2° | 109.5° |
| C15 | C23 | H20 | 108.3° | 109.5° |
| C13 | C14 | C15 | 111.8° | 109.3° |
| C13 | C14 | H1 | 108.9° | 109.5° |
| C13 | C14 | H2 | 108.9° | 109.5° |
| C14 | C13 | H3 | 109.1° | 109.5° |
| C14 | C13 | H4 | 109.1° | 109.4° |
| C14 | C15 | N16 | 101.0° | 109.5° |
| C15 | C14 | H1 | 108.9° | 109.6° |
| C15 | C14 | H2 | 108.9° | 109.5° |
| C14 | C15 | H7 | 108.2° | 109.5° |
| C15 | N16 | C17 | 110.9° | 111.0° |
| C15 | N16 | C22 | 113.6° | 111.0° |
| N16 | C15 | H7 | 110.1° | 109.5° |
| N16 | C17 | C18 | 111.7° | 109.3° |
| C17 | N16 | C22 | 110.2° | 110.9° |
| N16 | C17 | H8 | 108.9° | 109.5° |
| N16 | C17 | H9 | 108.9° | 109.5° |
| C17 | C18 | N19 | 112.2° | 109.4° |
| C18 | C17 | H8 | 108.9° | 109.5° |
| C18 | C17 | H9 | 108.9° | 109.5° |
| C17 | C18 | H10 | 108.8° | 109.5° |
| C17 | C18 | H11 | 108.8° | 109.5° |
| N16 | C22 | C21 | 110.5° | 109.3° |
| N16 | C22 | H17 | 109.2° | 109.5° |
| N16 | C22 | H18 | 109.2° | 109.5° |
| C18 | N19 | C21 | 113.7° | 110.9° |
| C18 | N19 | C20 | 109.9° | 111.0° |
| N19 | C18 | H10 | 108.8° | 109.5° |
| N19 | C18 | H11 | 108.8° | 109.5° |
| C22 | C21 | N19 | 113.9° | 109.4° |
| C22 | C21 | H15 | 108.3° | 109.5° |
| C22 | C21 | H16 | 108.4° | 109.5° |
| C21 | C22 | H17 | 109.2° | 109.5° |
| C21 | C22 | H18 | 109.2° | 109.5° |
| C21 | N19 | C20 | 110.2° | 111.0° |
| N19 | C21 | H15 | 108.4° | 109.5° |
| N19 | C21 | H16 | 108.3° | 109.5° |
| N19 | C20 | H12 | 109.5° | 109.4° |
| N19 | C20 | H13 | 109.4° | 109.5° |
| N19 | C20 | H14 | 109.5° | 109.4° |
| H1 | C14 | H2 | 109.5° | 109.5° |
| H3 | C13 | H4 | 109.4° | 109.5° |
| H8 | C17 | H9 | 109.5° | 109.5° |
| H10 | C18 | H11 | 109.5° | 109.5° |
| H12 | C20 | H13 | 109.5° | 109.5° |
| H12 | C20 | H14 | 109.4° | 109.4° |
| H13 | C20 | H14 | 109.5° | 109.5° |
| H15 | C21 | H16 | 109.5° | 109.4° |
| H17 | C22 | H18 | 109.5° | 109.5° |
| H19 | C23 | H20 | 109.5° | 109.5° |
| H21 | C24 | H22 | 109.4° | 109.4° |
| H24 | C28 | H25 | 109.4° | 109.5° |
| H24 | C28 | H26 | 109.5° | 109.4° |
| H25 | C28 | H26 | 109.5° | 109.5° |
| H28 | C36 | H29 | 109.5° | 109.4° |
| H30 | C37 | H31 | 109.5° | 109.4° |
| H30 | C37 | H32 | 109.5° | 109.5° |
| H31 | C37 | H32 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O38 | S34 | O35 | C36 | 120.8° | 131.5° |
| O38 | S34 | O35 | N33 | 121.6° | 116.8° |
| O38 | S34 | C36 | N33 | 122.4° | 111.6° |
| O38 | S34 | C36 | C37 | 82.7° | 68.4° |
| O38 | S34 | N33 | C32 | 13.3° | 128.9° |
| O38 | S34 | N33 | C39 | 169.8° | 50.7° |
| O38 | S34 | C36 | H28 | 37.3° | 51.6° |
| O38 | S34 | C36 | H29 | 157.3° | 171.6° |
| O35 | S34 | C36 | N33 | 122.4° | 111.6° |
| O35 | S34 | C36 | C37 | 162.1° | 68.4° |
| O35 | S34 | N33 | C32 | 129.1° | 1.0° |
| O35 | S34 | N33 | C39 | 54.0° | 178.6° |
| O35 | S34 | C36 | H28 | 77.9° | 171.6° |
| O35 | S34 | C36 | H29 | 42.1° | 51.7° |
| S34 | C36 | C37 | H28 | 120.0° | 120.0° |
| S34 | C36 | C37 | H29 | 120.0° | 120.0° |
| C36 | S34 | N33 | C32 | 108.7° | 115.1° |
| C36 | S34 | N33 | C39 | 68.2° | 65.3° |
| S34 | C36 | H28 | H29 | 120.1° | 120.0° |
| S34 | C36 | C37 | H30 | 180.0° | 60.0° |
| S34 | C36 | C37 | H31 | 60.0° | 60.0° |
| S34 | C36 | C37 | H32 | 60.0° | 180.0° |
| N33 | S34 | C36 | C37 | 39.7° | 180.0° |
| S34 | N33 | C32 | C39 | 177.3° | 179.7° |
| S34 | N33 | C32 | C31 | 179.0° | 180.0° |
| S34 | N33 | C39 | C40 | 2.4° | 0.4° |
| S34 | N33 | C39 | C44 | 178.0° | 179.9° |
| S34 | N33 | C32 | H27 | 1.0° | 0.1° |
| N33 | S34 | C36 | H28 | 159.6° | 60.0° |
| N33 | S34 | C36 | H29 | 80.3° | 60.0° |
| CL1 | C02 | C30 | C03 | 178.7° | 179.8° |
| CL1 | C02 | C30 | C31 | 4.2° | 0.3° |
| CL1 | C02 | C30 | N29 | 179.7° | 179.8° |
| CL1 | C02 | C03 | N04 | 179.5° | 179.7° |
| CL1 | C02 | C03 | H5 | 0.5° | 0.2° |
| C37 | C36 | H28 | H29 | 120.1° | 120.0° |
| C36 | C37 | H30 | H31 | 120.0° | 120.0° |
| C36 | C37 | H30 | H32 | 120.0° | 120.1° |
| C36 | C37 | H31 | H32 | 120.0° | 120.0° |
| N33 | C32 | C31 | H27 | 180.0° | 179.9° |
| C32 | N33 | C39 | C40 | 179.8° | 179.9° |
| C32 | N33 | C39 | C44 | 0.6° | 0.5° |
| N33 | C32 | C31 | C44 | 2.2° | 0.1° |
| N33 | C32 | C31 | C30 | 177.6° | 179.8° |
| C39 | N33 | C32 | C31 | 1.7° | 0.3° |
| N33 | C39 | C40 | C44 | 179.5° | 179.4° |
| N33 | C39 | C40 | C41 | 179.5° | 179.4° |
| N33 | C39 | C44 | C31 | 0.7° | 0.4° |
| N33 | C39 | C44 | C43 | 179.8° | 179.6° |
| C39 | N33 | C32 | H27 | 178.3° | 179.8° |
| N33 | C39 | C40 | H33 | 0.5° | 0.6° |
| C32 | C31 | C44 | C39 | 1.8° | 0.2° |
| C32 | C31 | C30 | C02 | 27.1° | 42.8° |
| C32 | C31 | C44 | C30 | 175.5° | 179.8° |
| C32 | C31 | C44 | C43 | 179.3° | 179.8° |
| C32 | C31 | C30 | N29 | 148.4° | 137.1° |
| C39 | C40 | C41 | H33 | 180.0° | 179.9° |
| C40 | C39 | C44 | C31 | 178.9° | 179.9° |
| C40 | C39 | C44 | C43 | 0.2° | 0.0° |
| C39 | C40 | C41 | C42 | 0.4° | 0.1° |
| C39 | C40 | C41 | H34 | 179.6° | 179.9° |
| C44 | C39 | C40 | C41 | 0.1° | 0.0° |
| C39 | C44 | C31 | C43 | 178.9° | 180.0° |
| C39 | C44 | C31 | C30 | 177.4° | 180.0° |
| C39 | C44 | C43 | C42 | 0.0° | 0.0° |
| C44 | C39 | C40 | H33 | 179.9° | 180.0° |
| C39 | C44 | C43 | H36 | 180.0° | 180.0° |
| C02 | C30 | C31 | C44 | 158.2° | 137.4° |
| C02 | C30 | C31 | N29 | 175.5° | 179.9° |
| C30 | C02 | C03 | N04 | 0.8° | 0.1° |
| C02 | C30 | N29 | C05 | 1.8° | 0.0° |
| C30 | C02 | C03 | H5 | 179.2° | 180.0° |
| C03 | C02 | C30 | C31 | 177.1° | 179.9° |
| C03 | C02 | C30 | N29 | 1.6° | 0.0° |
| C02 | C03 | N04 | H5 | 180.0° | 179.9° |
| C02 | C03 | N04 | C05 | 0.1° | 0.0° |
| C40 | C41 | C42 | H34 | 180.0° | 180.0° |
| C40 | C41 | C42 | C43 | 0.6° | 0.1° |
| C40 | C41 | C42 | H35 | 179.4° | 180.0° |
| C44 | C31 | C30 | N29 | 26.3° | 42.6° |
| C31 | C44 | C43 | C42 | 178.7° | 179.9° |
| C44 | C31 | C32 | H27 | 177.8° | 180.0° |
| C31 | C44 | C43 | H36 | 1.3° | 0.1° |
| C30 | C31 | C44 | C43 | 3.8° | 0.1° |
| C31 | C30 | N29 | C05 | 177.7° | 180.0° |
| C30 | C31 | C32 | H27 | 2.4° | 0.2° |
| C44 | C43 | C42 | C41 | 0.4° | 0.1° |
| C44 | C43 | C42 | H36 | 180.0° | 180.0° |
| C44 | C43 | C42 | H35 | 179.6° | 180.0° |
| C30 | N29 | C05 | N04 | 1.1° | 0.1° |
| C30 | N29 | C05 | N06 | 178.9° | 180.0° |
| C03 | N04 | C05 | N29 | 0.2° | 0.0° |
| C03 | N04 | C05 | N06 | 179.8° | 180.0° |
| C41 | C42 | C43 | H35 | 180.0° | 179.9° |
| C42 | C41 | C40 | H33 | 179.5° | 180.0° |
| C41 | C42 | C43 | H36 | 179.6° | 180.0° |
| C43 | C42 | C41 | H34 | 179.4° | 179.9° |
| N29 | C05 | N04 | N06 | 180.0° | 180.0° |
| N29 | C05 | N06 | C07 | 7.0° | 174.2° |
| N29 | C05 | N06 | H37 | 173.0° | 5.8° |
| N04 | C05 | N06 | C07 | 173.0° | 5.8° |
| C05 | N04 | C03 | H5 | 179.9° | 180.0° |
| N04 | C05 | N06 | H37 | 7.0° | 174.2° |
| C05 | N06 | C07 | H37 | 180.0° | 180.0° |
| C05 | N06 | C07 | C08 | 25.2° | 31.8° |
| C05 | N06 | C07 | C26 | 156.5° | 148.2° |
| N06 | C07 | C08 | C26 | 178.2° | 180.0° |
| N06 | C07 | C08 | C09 | 179.7° | 179.2° |
| N06 | C07 | C26 | O27 | 0.8° | 0.0° |
| N06 | C07 | C26 | C25 | 179.8° | 179.4° |
| N06 | C07 | C08 | H6 | 0.3° | 0.0° |
| C07 | C08 | C09 | H6 | 180.0° | 179.2° |
| C07 | C08 | C09 | CL2 | 179.9° | 179.4° |
| C07 | C08 | C09 | C11 | 0.8° | 0.5° |
| C08 | C07 | C26 | O27 | 179.2° | 180.0° |
| C08 | C07 | C26 | C25 | 1.4° | 0.6° |
| C08 | C07 | N06 | H37 | 154.8° | 148.2° |
| C09 | C08 | C07 | C26 | 1.5° | 0.8° |
| C08 | C09 | CL2 | C11 | 179.2° | 179.9° |
| C08 | C09 | C11 | C25 | 0.0° | 0.1° |
| C08 | C09 | C11 | N12 | 179.3° | 179.7° |
| C07 | C26 | O27 | C25 | 179.3° | 179.4° |
| C07 | C26 | O27 | C28 | 168.5° | 180.0° |
| C07 | C26 | C25 | C11 | 0.6° | 0.0° |
| C26 | C07 | C08 | H6 | 178.5° | 180.0° |
| C07 | C26 | C25 | H23 | 179.4° | 180.0° |
| C26 | C07 | N06 | H37 | 23.6° | 31.8° |
| CL2 | C09 | C11 | C25 | 179.1° | 180.0° |
| CL2 | C09 | C11 | N12 | 0.2° | 0.4° |
| CL2 | C09 | C08 | H6 | 0.0° | 0.2° |
| C09 | C11 | C25 | C26 | 0.2° | 0.3° |
| C09 | C11 | C25 | N12 | 179.3° | 179.6° |
| C09 | C11 | N12 | C24 | 62.3° | 120.3° |
| C09 | C11 | N12 | C13 | 152.6° | 115.5° |
| C11 | C09 | C08 | H6 | 179.2° | 179.7° |
| C09 | C11 | C25 | H23 | 179.9° | 179.6° |
| O27 | C26 | C25 | C11 | 179.8° | 179.4° |
| O27 | C26 | C25 | H23 | 0.1° | 0.6° |
| C26 | O27 | C28 | H24 | 180.0° | 180.0° |
| C26 | O27 | C28 | H25 | 60.0° | 60.0° |
| C26 | O27 | C28 | H26 | 60.0° | 60.0° |
| C25 | C26 | O27 | C28 | 12.2° | 0.6° |
| C26 | C25 | C11 | H23 | 180.0° | 179.9° |
| C26 | C25 | C11 | N12 | 179.4° | 179.9° |
| O27 | C28 | H24 | H25 | 120.0° | 120.1° |
| O27 | C28 | H24 | H26 | 120.0° | 120.0° |
| O27 | C28 | H25 | H26 | 120.0° | 120.0° |
| C25 | C11 | N12 | C24 | 118.4° | 60.0° |
| C25 | C11 | N12 | C13 | 26.7° | 64.1° |
| C11 | N12 | C24 | C13 | 149.3° | 124.1° |
| C11 | N12 | C24 | C23 | 159.3° | 174.1° |
| C11 | N12 | C13 | C14 | 155.4° | 174.2° |
| C11 | N12 | C13 | H3 | 84.4° | 54.2° |
| C11 | N12 | C13 | H4 | 35.2° | 65.8° |
| C11 | N12 | C24 | H21 | 38.8° | 65.8° |
| C11 | N12 | C24 | H22 | 80.2° | 54.1° |
| N12 | C11 | C25 | H23 | 0.6° | 0.0° |
| N12 | C24 | C23 | H21 | 120.5° | 120.1° |
| N12 | C24 | C23 | H22 | 120.5° | 120.0° |
| N12 | C24 | C23 | C15 | 49.9° | 59.2° |
| C24 | N12 | C13 | C14 | 55.7° | 61.7° |
| C24 | N12 | C13 | H3 | 64.6° | 178.3° |
| C24 | N12 | C13 | H4 | 175.9° | 58.3° |
| N12 | C24 | C23 | H19 | 70.8° | 179.1° |
| N12 | C24 | C23 | H20 | 170.6° | 60.7° |
| N12 | C24 | H21 | H22 | 118.5° | 120.0° |
| C23 | C24 | N12 | C13 | 51.4° | 61.8° |
| C24 | C23 | C15 | H19 | 120.7° | 119.9° |
| C24 | C23 | C15 | H20 | 120.7° | 120.0° |
| C24 | C23 | C15 | C14 | 50.9° | 57.6° |
| C24 | C23 | C15 | N16 | 166.8° | 177.6° |
| C24 | C23 | C15 | H7 | 68.5° | 62.3° |
| C24 | C23 | H19 | H20 | 117.8° | 120.2° |
| C23 | C24 | H21 | H22 | 118.5° | 119.9° |
| N12 | C13 | C14 | H3 | 120.2° | 120.0° |
| N12 | C13 | C14 | H4 | 120.2° | 120.0° |
| N12 | C13 | C14 | C15 | 58.7° | 59.1° |
| N12 | C13 | C14 | H1 | 179.1° | 179.2° |
| N12 | C13 | C14 | H2 | 61.7° | 60.8° |
| N12 | C13 | H3 | H4 | 119.4° | 119.9° |
| C13 | N12 | C24 | H21 | 171.9° | 58.3° |
| C13 | N12 | C24 | H22 | 69.1° | 178.2° |
| C23 | C15 | C14 | C13 | 55.0° | 57.6° |
| C23 | C15 | C14 | N16 | 125.0° | 119.9° |
| C23 | C15 | C14 | H7 | 119.4° | 120.0° |
| C23 | C15 | N16 | H7 | 123.7° | 120.2° |
| C23 | C15 | N16 | C17 | 34.3° | 60.3° |
| C23 | C15 | N16 | C22 | 159.0° | 175.9° |
| C23 | C15 | C14 | H1 | 175.4° | 177.6° |
| C23 | C15 | C14 | H2 | 65.3° | 62.3° |
| C15 | C23 | H19 | H20 | 117.8° | 120.0° |
| C15 | C23 | C24 | H21 | 170.4° | 60.9° |
| C15 | C23 | C24 | H22 | 70.6° | 179.2° |
| C13 | C14 | C15 | H1 | 120.4° | 120.0° |
| C13 | C14 | C15 | H2 | 120.4° | 119.9° |
| C13 | C14 | C15 | N16 | 180.0° | 177.5° |
| C13 | C14 | H1 | H2 | 118.9° | 120.0° |
| C14 | C13 | H3 | H4 | 119.3° | 120.0° |
| C13 | C14 | C15 | H7 | 64.4° | 62.4° |
| C14 | C15 | N16 | H7 | 114.2° | 120.1° |
| C14 | C15 | N16 | C17 | 156.5° | 180.0° |
| C14 | C15 | N16 | C22 | 78.8° | 56.2° |
| C15 | C14 | H1 | H2 | 118.9° | 120.1° |
| C15 | C14 | C13 | H3 | 61.5° | 179.2° |
| C15 | C14 | C13 | H4 | 178.9° | 60.9° |
| C14 | C15 | C23 | H19 | 69.8° | 177.6° |
| C14 | C15 | C23 | H20 | 171.6° | 62.4° |
| C15 | N16 | C17 | C22 | 126.6° | 123.8° |
| C15 | N16 | C17 | C18 | 174.1° | 176.8° |
| C15 | N16 | C22 | C21 | 177.2° | 176.8° |
| N16 | C15 | C14 | H1 | 59.6° | 62.5° |
| N16 | C15 | C14 | H2 | 59.6° | 57.6° |
| C15 | N16 | C17 | H8 | 53.8° | 63.2° |
| C15 | N16 | C17 | H9 | 65.5° | 56.8° |
| C15 | N16 | C22 | H17 | 62.7° | 56.9° |
| C15 | N16 | C22 | H18 | 57.0° | 63.2° |
| N16 | C15 | C23 | H19 | 46.1° | 62.5° |
| N16 | C15 | C23 | H20 | 72.4° | 57.6° |
| N16 | C17 | C18 | H8 | 120.3° | 120.0° |
| N16 | C17 | C18 | H9 | 120.4° | 119.9° |
| N16 | C17 | C18 | N19 | 53.4° | 58.4° |
| C17 | N16 | C22 | C21 | 57.7° | 59.3° |
| C17 | N16 | C15 | H7 | 89.4° | 59.9° |
| N16 | C17 | H8 | H9 | 119.0° | 120.1° |
| N16 | C17 | C18 | H10 | 67.0° | 61.6° |
| N16 | C17 | C18 | H11 | 173.8° | 178.4° |
| C17 | N16 | C22 | H17 | 62.4° | 179.3° |
| C17 | N16 | C22 | H18 | 177.9° | 60.6° |
| C18 | C17 | N16 | C22 | 59.2° | 59.4° |
| C17 | C18 | N19 | H10 | 120.4° | 120.0° |
| C17 | C18 | N19 | H11 | 120.4° | 119.9° |
| C17 | C18 | N19 | C21 | 46.8° | 59.3° |
| C17 | C18 | N19 | C20 | 170.7° | 176.8° |
| C18 | C17 | H8 | H9 | 119.0° | 120.1° |
| C17 | C18 | H10 | H11 | 118.8° | 120.0° |
| N16 | C22 | C21 | H17 | 120.2° | 120.0° |
| N16 | C22 | C21 | H18 | 120.2° | 120.0° |
| N16 | C22 | C21 | N19 | 52.0° | 58.4° |
| C22 | N16 | C15 | H7 | 35.4° | 63.9° |
| C22 | N16 | C17 | H8 | 179.5° | 60.6° |
| C22 | N16 | C17 | H9 | 61.1° | 179.3° |
| N16 | C22 | C21 | H15 | 172.7° | 178.4° |
| N16 | C22 | C21 | H16 | 68.6° | 61.6° |
| N16 | C22 | H17 | H18 | 119.6° | 120.1° |
| C18 | N19 | C21 | C22 | 46.9° | 59.3° |
| C18 | N19 | C21 | C20 | 123.8° | 123.9° |
| N19 | C18 | C17 | H8 | 173.7° | 61.5° |
| N19 | C18 | C17 | H9 | 67.0° | 178.4° |
| N19 | C18 | H10 | H11 | 118.7° | 120.1° |
| C18 | N19 | C20 | H12 | 180.0° | 59.9° |
| C18 | N19 | C20 | H13 | 60.0° | 180.0° |
| C18 | N19 | C20 | H14 | 60.0° | 60.0° |
| C18 | N19 | C21 | H15 | 167.6° | 179.3° |
| C18 | N19 | C21 | H16 | 73.8° | 60.7° |
| C22 | C21 | N19 | H15 | 120.7° | 120.0° |
| C22 | C21 | N19 | H16 | 120.7° | 120.0° |
| C22 | C21 | N19 | C20 | 170.7° | 176.8° |
| C22 | C21 | H15 | H16 | 118.0° | 120.0° |
| C21 | C22 | H17 | H18 | 119.5° | 120.0° |
| C21 | N19 | C18 | H10 | 73.7° | 60.6° |
| C21 | N19 | C18 | H11 | 167.2° | 179.3° |
| C21 | N19 | C20 | H12 | 54.1° | 176.2° |
| C21 | N19 | C20 | H13 | 66.0° | 56.2° |
| C21 | N19 | C20 | H14 | 174.0° | 63.8° |
| N19 | C21 | H15 | H16 | 117.9° | 120.1° |
| N19 | C21 | C22 | H17 | 68.1° | 178.4° |
| N19 | C21 | C22 | H18 | 172.2° | 61.6° |
| C20 | N19 | C18 | H10 | 50.3° | 63.2° |
| C20 | N19 | C18 | H11 | 68.9° | 56.8° |
| N19 | C20 | H12 | H13 | 120.0° | 120.1° |
| N19 | C20 | H12 | H14 | 120.0° | 119.9° |
| N19 | C20 | H13 | H14 | 120.0° | 120.0° |
| C20 | N19 | C21 | H15 | 68.7° | 56.8° |
| C20 | N19 | C21 | H16 | 50.0° | 63.2° |
| H1 | C14 | C13 | H3 | 58.8° | 60.8° |
| H1 | C14 | C13 | H4 | 60.7° | 59.2° |
| H1 | C14 | C15 | H7 | 55.9° | 57.6° |
| H2 | C14 | C13 | H3 | 178.1° | 59.2° |
| H2 | C14 | C13 | H4 | 58.6° | 179.2° |
| H2 | C14 | C15 | H7 | 175.2° | 177.7° |
| H7 | C15 | C23 | H19 | 170.8° | 57.6° |
| H7 | C15 | C23 | H20 | 52.2° | 177.7° |
| H8 | C17 | C18 | H10 | 53.3° | 178.5° |
| H8 | C17 | C18 | H11 | 65.9° | 58.4° |
| H9 | C17 | C18 | H10 | 172.6° | 58.4° |
| H9 | C17 | C18 | H11 | 53.4° | 61.7° |
| H12 | C20 | H13 | H14 | 120.0° | 120.0° |
| H15 | C21 | C22 | H17 | 52.6° | 61.6° |
| H15 | C21 | C22 | H18 | 67.1° | 58.4° |
| H16 | C21 | C22 | H17 | 171.2° | 58.3° |
| H16 | C21 | C22 | H18 | 51.5° | 178.4° |
| H19 | C23 | C24 | H21 | 49.7° | 59.0° |
| H19 | C23 | C24 | H22 | 168.7° | 60.8° |
| H20 | C23 | C24 | H21 | 68.9° | 179.2° |
| H20 | C23 | C24 | H22 | 50.1° | 59.3° |
| H24 | C28 | H25 | H26 | 120.0° | 120.0° |
| H28 | C36 | C37 | H30 | 60.1° | 60.0° |
| H28 | C36 | C37 | H31 | 179.9° | 180.0° |
| H28 | C36 | C37 | H32 | 60.0° | 60.0° |
| H29 | C36 | C37 | H30 | 60.0° | 180.0° |
| H29 | C36 | C37 | H31 | 60.0° | 60.0° |
| H29 | C36 | C37 | H32 | 179.9° | 60.0° |
| H30 | C37 | H31 | H32 | 120.0° | 120.0° |
| H33 | C40 | C41 | H34 | 0.5° | 0.0° |
| H34 | C41 | C42 | H35 | 0.6° | 0.0° |
| H35 | C42 | C43 | H36 | 0.4° | 0.1° |
