R6S
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C39 | C02 | sing | 1.53Å | 1.50Å | |
| C01 | C02 | sing | 1.53Å | 1.52Å | |
| C02 | C03 | sing | 1.53Å | 1.51Å | |
| C02 | S04 | sing | 1.81Å | 1.84Å | |
| O38 | S04 | doub | 1.42Å | 1.48Å | |
| S04 | N05 | sing | 1.66Å | 1.69Å | |
| S04 | O37 | doub | 1.42Å | 1.47Å | |
| C07 | C06 | sing | 1.54Å | 1.50Å | |
| C07 | C08 | sing | 1.51Å | 1.54Å | |
| C06 | N05 | sing | 1.47Å | 1.47Å | |
| N05 | C36 | sing | 1.40Å | 1.47Å | |
| C08 | C36 | doub | 1.39Å | 1.39Å | Aromatic |
| C08 | C09 | sing | 1.38Å | 1.38Å | Aromatic |
| C32 | N29 | sing | 1.47Å | 1.21Å | |
| C28 | N29 | sing | 1.47Å | 1.40Å | |
| C28 | C27 | sing | 1.53Å | 1.53Å | |
| C36 | C35 | sing | 1.40Å | 1.38Å | Aromatic |
| C09 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| N29 | C30 | sing | 1.47Å | 1.40Å | |
| C35 | C11 | doub | 1.38Å | 1.36Å | Aromatic |
| C27 | C26 | sing | 1.53Å | 1.49Å | |
| C10 | C11 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | N12 | sing | 1.40Å | 1.44Å | |
| F24 | C23 | sing | 1.35Å | 1.37Å | |
| N12 | C13 | sing | 1.39Å | 1.45Å | |
| C30 | C31 | sing | 1.53Å | 1.54Å | |
| C26 | C31 | sing | 1.53Å | 1.49Å | |
| C26 | C22 | sing | 1.51Å | 1.56Å | |
| C23 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
| C23 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | N33 | doub | 1.33Å | 1.33Å | Aromatic |
| C13 | C14 | sing | 1.40Å | 1.40Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C25 | C19 | doub | 1.39Å | 1.38Å | Aromatic |
| N33 | C17 | sing | 1.32Å | 1.32Å | Aromatic |
| C34 | C14 | sing | 1.51Å | 1.51Å | |
| C14 | C15 | doub | 1.38Å | 1.37Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | C20 | sing | 1.39Å | 1.40Å | Aromatic |
| C19 | N18 | sing | 1.40Å | 1.47Å | |
| C17 | N18 | sing | 1.39Å | 1.44Å | |
| C17 | N16 | doub | 1.33Å | 1.31Å | Aromatic |
| C15 | N16 | sing | 1.33Å | 1.32Å | Aromatic |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| N12 | H2 | sing | 0.97Å | 1.00Å | |
| C15 | H3 | sing | 1.08Å | 1.08Å | |
| C20 | H4 | sing | 1.08Å | 1.08Å | |
| C21 | H5 | sing | 1.08Å | 1.08Å | |
| C26 | H6 | sing | 1.09Å | 1.10Å | |
| C28 | H7 | sing | 1.09Å | 1.10Å | |
| C28 | H8 | sing | 1.09Å | 1.10Å | |
| C01 | H9 | sing | 1.09Å | 1.10Å | |
| C01 | H10 | sing | 1.09Å | 1.10Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C03 | H12 | sing | 1.09Å | 1.10Å | |
| C03 | H13 | sing | 1.09Å | 1.10Å | |
| C03 | H14 | sing | 1.09Å | 1.10Å | |
| C06 | H15 | sing | 1.09Å | 1.10Å | |
| C06 | H16 | sing | 1.09Å | 1.10Å | |
| C07 | H17 | sing | 1.09Å | 1.10Å | |
| C07 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.08Å | 1.08Å | |
| C25 | H20 | sing | 1.08Å | 1.08Å | |
| C27 | H21 | sing | 1.09Å | 1.10Å | |
| C27 | H22 | sing | 1.09Å | 1.10Å | |
| C30 | H23 | sing | 1.09Å | 1.10Å | |
| C30 | H24 | sing | 1.09Å | 1.10Å | |
| C31 | H25 | sing | 1.09Å | 1.10Å | |
| C31 | H26 | sing | 1.09Å | 1.10Å | |
| C32 | H27 | sing | 1.09Å | 1.10Å | |
| C32 | H28 | sing | 1.09Å | 1.10Å | |
| C32 | H29 | sing | 1.09Å | 1.10Å | |
| C34 | H30 | sing | 1.09Å | 1.10Å | |
| C34 | H31 | sing | 1.09Å | 1.10Å | |
| C34 | H32 | sing | 1.09Å | 1.10Å | |
| C35 | H33 | sing | 1.08Å | 1.08Å | |
| C39 | H34 | sing | 1.09Å | 1.10Å | |
| C39 | H35 | sing | 1.09Å | 1.10Å | |
| C39 | H36 | sing | 1.09Å | 1.10Å | |
| N18 | H37 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C39 | C02 | C01 | 113.5° | 109.5° |
| C39 | C02 | C03 | 103.3° | 109.4° |
| C39 | C02 | S04 | 107.9° | 109.5° |
| C02 | C39 | H34 | 109.5° | 109.5° |
| C02 | C39 | H35 | 109.5° | 109.5° |
| C02 | C39 | H36 | 109.4° | 109.5° |
| C01 | C02 | C03 | 103.1° | 109.5° |
| C01 | C02 | S04 | 111.5° | 109.4° |
| C02 | C01 | H9 | 109.5° | 109.5° |
| C02 | C01 | H10 | 109.5° | 109.5° |
| C02 | C01 | H11 | 109.5° | 109.4° |
| C03 | C02 | S04 | 117.4° | 109.5° |
| C02 | C03 | H12 | 109.5° | 109.5° |
| C02 | C03 | H13 | 109.5° | 109.4° |
| C02 | C03 | H14 | 109.5° | 109.4° |
| C02 | S04 | O38 | 114.1° | 110.5° |
| C02 | S04 | N05 | 113.8° | 104.4° |
| C02 | S04 | O37 | 113.4° | 110.5° |
| O38 | S04 | N05 | 108.8° | 104.3° |
| O38 | S04 | O37 | 104.6° | 121.1° |
| N05 | S04 | O37 | 101.0° | 104.3° |
| S04 | N05 | C06 | 131.1° | 124.9° |
| S04 | N05 | C36 | 115.7° | 125.0° |
| C06 | C07 | C08 | 103.9° | 104.5° |
| C07 | C06 | N05 | 103.1° | 105.2° |
| C07 | C06 | H15 | 111.0° | 110.3° |
| C07 | C06 | H16 | 111.1° | 110.4° |
| C06 | C07 | H17 | 110.9° | 110.4° |
| C06 | C07 | H18 | 110.8° | 110.5° |
| C07 | C08 | C36 | 110.0° | 108.5° |
| C07 | C08 | C09 | 132.8° | 130.9° |
| C08 | C07 | H17 | 110.9° | 110.3° |
| C08 | C07 | H18 | 110.9° | 110.4° |
| C06 | N05 | C36 | 109.9° | 110.1° |
| N05 | C06 | H15 | 111.1° | 110.3° |
| N05 | C06 | H16 | 111.0° | 110.3° |
| N05 | C36 | C08 | 105.9° | 111.7° |
| N05 | C36 | C35 | 128.8° | 129.3° |
| C36 | C08 | C09 | 117.2° | 120.6° |
| C08 | C36 | C35 | 125.1° | 119.0° |
| C08 | C09 | C10 | 118.3° | 120.3° |
| C08 | C09 | H19 | 120.9° | 119.9° |
| C32 | N29 | C28 | 110.9° | 111.0° |
| C32 | N29 | C30 | 110.2° | 111.0° |
| N29 | C32 | H27 | 109.5° | 109.4° |
| N29 | C32 | H28 | 109.5° | 109.5° |
| N29 | C32 | H29 | 109.5° | 109.4° |
| N29 | C28 | C27 | 110.5° | 109.5° |
| C28 | N29 | C30 | 108.2° | 111.2° |
| N29 | C28 | H7 | 109.2° | 109.4° |
| N29 | C28 | H8 | 109.2° | 109.4° |
| C28 | C27 | C26 | 115.5° | 109.2° |
| C27 | C28 | H7 | 109.2° | 109.5° |
| C27 | C28 | H8 | 109.2° | 109.5° |
| C28 | C27 | H21 | 107.9° | 109.5° |
| C28 | C27 | H22 | 107.9° | 109.5° |
| C36 | C35 | C11 | 116.2° | 120.3° |
| C36 | C35 | H33 | 121.9° | 119.9° |
| C09 | C10 | C11 | 122.6° | 119.7° |
| C09 | C10 | H1 | 118.7° | 120.2° |
| C10 | C09 | H19 | 120.9° | 119.9° |
| N29 | C30 | C31 | 114.7° | 109.5° |
| N29 | C30 | H23 | 108.1° | 109.5° |
| N29 | C30 | H24 | 108.1° | 109.5° |
| C35 | C11 | C10 | 120.3° | 120.0° |
| C35 | C11 | N12 | 119.5° | 120.0° |
| C11 | C35 | H33 | 121.9° | 119.8° |
| C27 | C26 | C31 | 116.4° | 109.2° |
| C27 | C26 | C22 | 122.0° | 109.5° |
| C27 | C26 | H6 | 107.4° | 109.6° |
| C26 | C27 | H21 | 107.9° | 109.5° |
| C26 | C27 | H22 | 108.0° | 109.5° |
| C10 | C11 | N12 | 120.1° | 119.9° |
| C11 | C10 | H1 | 118.7° | 120.1° |
| C11 | N12 | C13 | 119.8° | 120.0° |
| C11 | N12 | H2 | 120.1° | 120.0° |
| F24 | C23 | C22 | 119.1° | 120.0° |
| F24 | C23 | C25 | 119.2° | 120.0° |
| N12 | C13 | N33 | 121.1° | 120.5° |
| N12 | C13 | C14 | 118.8° | 120.5° |
| C13 | N12 | H2 | 120.1° | 120.0° |
| C30 | C31 | C26 | 114.3° | 109.2° |
| C31 | C30 | H23 | 108.1° | 109.4° |
| C31 | C30 | H24 | 108.1° | 109.4° |
| C30 | C31 | H25 | 108.3° | 109.5° |
| C30 | C31 | H26 | 108.3° | 109.5° |
| C31 | C26 | C22 | 95.9° | 109.5° |
| C31 | C26 | H6 | 107.4° | 109.6° |
| C26 | C31 | H25 | 108.3° | 109.5° |
| C26 | C31 | H26 | 108.3° | 109.5° |
| C26 | C22 | C23 | 117.2° | 119.9° |
| C26 | C22 | C21 | 124.4° | 120.0° |
| C22 | C26 | H6 | 106.6° | 109.5° |
| C22 | C23 | C25 | 121.7° | 120.0° |
| C23 | C22 | C21 | 118.5° | 120.1° |
| C23 | C25 | C19 | 119.6° | 119.9° |
| C23 | C25 | H20 | 120.2° | 120.1° |
| N33 | C13 | C14 | 120.1° | 119.0° |
| C13 | N33 | C17 | 118.1° | 120.6° |
| C13 | C14 | C34 | 122.4° | 120.8° |
| C13 | C14 | C15 | 119.5° | 118.5° |
| C22 | C21 | C20 | 119.7° | 120.1° |
| C22 | C21 | H5 | 120.2° | 119.9° |
| C25 | C19 | C20 | 119.8° | 119.8° |
| C25 | C19 | N18 | 122.6° | 120.1° |
| C19 | C25 | H20 | 120.2° | 120.0° |
| N33 | C17 | N18 | 121.9° | 119.2° |
| N33 | C17 | N16 | 122.7° | 121.7° |
| C34 | C14 | C15 | 118.1° | 120.7° |
| C14 | C34 | H30 | 109.5° | 109.5° |
| C14 | C34 | H31 | 109.5° | 109.5° |
| C14 | C34 | H32 | 109.5° | 109.4° |
| C14 | C15 | N16 | 116.6° | 119.3° |
| C14 | C15 | H3 | 121.7° | 120.4° |
| C21 | C20 | C19 | 120.7° | 120.0° |
| C21 | C20 | H4 | 119.6° | 120.0° |
| C20 | C21 | H5 | 120.1° | 119.9° |
| C20 | C19 | N18 | 117.6° | 120.1° |
| C19 | C20 | H4 | 119.7° | 120.0° |
| C19 | N18 | C17 | 128.6° | 120.0° |
| C19 | N18 | H37 | 115.7° | 120.0° |
| N18 | C17 | N16 | 115.4° | 119.1° |
| C17 | N18 | H37 | 115.7° | 120.0° |
| C17 | N16 | C15 | 123.0° | 120.9° |
| N16 | C15 | H3 | 121.7° | 120.3° |
| H7 | C28 | H8 | 109.5° | 109.5° |
| H9 | C01 | H10 | 109.4° | 109.5° |
| H9 | C01 | H11 | 109.5° | 109.5° |
| H10 | C01 | H11 | 109.5° | 109.5° |
| H12 | C03 | H13 | 109.5° | 109.5° |
| H12 | C03 | H14 | 109.5° | 109.5° |
| H13 | C03 | H14 | 109.5° | 109.5° |
| H15 | C06 | H16 | 109.5° | 110.2° |
| H17 | C07 | H18 | 109.4° | 110.5° |
| H21 | C27 | H22 | 109.5° | 109.6° |
| H23 | C30 | H24 | 109.5° | 109.4° |
| H25 | C31 | H26 | 109.4° | 109.6° |
| H27 | C32 | H28 | 109.5° | 109.5° |
| H27 | C32 | H29 | 109.5° | 109.5° |
| H28 | C32 | H29 | 109.4° | 109.5° |
| H30 | C34 | H31 | 109.5° | 109.5° |
| H30 | C34 | H32 | 109.5° | 109.5° |
| H31 | C34 | H32 | 109.5° | 109.5° |
| H34 | C39 | H35 | 109.4° | 109.4° |
| H34 | C39 | H36 | 109.5° | 109.4° |
| H35 | C39 | H36 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C39 | C02 | C01 | C03 | 111.0° | 120.0° |
| C39 | C02 | C01 | S04 | 122.1° | 120.0° |
| C39 | C02 | C03 | S04 | 118.6° | 120.0° |
| C39 | C02 | S04 | O38 | 3.9° | 68.4° |
| C39 | C02 | S04 | N05 | 129.6° | 180.0° |
| C39 | C02 | S04 | O37 | 115.7° | 68.4° |
| C39 | C02 | C01 | H9 | 180.0° | 180.0° |
| C39 | C02 | C01 | H10 | 60.0° | 60.0° |
| C39 | C02 | C01 | H11 | 60.0° | 60.0° |
| C39 | C02 | C03 | H12 | 180.0° | 60.0° |
| C39 | C02 | C03 | H13 | 60.0° | 60.0° |
| C39 | C02 | C03 | H14 | 60.0° | 180.0° |
| C02 | C39 | H34 | H35 | 120.0° | 120.0° |
| C02 | C39 | H34 | H36 | 120.0° | 120.0° |
| C02 | C39 | H35 | H36 | 120.0° | 120.1° |
| C01 | C02 | C03 | S04 | 123.0° | 120.0° |
| C01 | C02 | S04 | O38 | 121.4° | 51.6° |
| C01 | C02 | S04 | N05 | 4.3° | 60.0° |
| C01 | C02 | S04 | O37 | 119.0° | 171.6° |
| C02 | C01 | H9 | H10 | 120.0° | 120.0° |
| C02 | C01 | H9 | H11 | 120.0° | 119.9° |
| C02 | C01 | H10 | H11 | 120.0° | 120.0° |
| C01 | C02 | C03 | H12 | 61.6° | 60.0° |
| C01 | C02 | C03 | H13 | 58.4° | 180.0° |
| C01 | C02 | C03 | H14 | 178.4° | 60.0° |
| C01 | C02 | C39 | H34 | 180.0° | 60.0° |
| C01 | C02 | C39 | H35 | 60.0° | 180.0° |
| C01 | C02 | C39 | H36 | 60.0° | 60.0° |
| C03 | C02 | S04 | O38 | 120.0° | 171.7° |
| C03 | C02 | S04 | N05 | 114.3° | 60.0° |
| C03 | C02 | S04 | O37 | 0.4° | 51.6° |
| C03 | C02 | C01 | H9 | 69.0° | 60.0° |
| C03 | C02 | C01 | H10 | 171.0° | 180.0° |
| C03 | C02 | C01 | H11 | 51.0° | 60.0° |
| C02 | C03 | H12 | H13 | 120.0° | 120.0° |
| C02 | C03 | H12 | H14 | 120.0° | 119.9° |
| C02 | C03 | H13 | H14 | 120.0° | 119.9° |
| C03 | C02 | C39 | H34 | 69.1° | 180.0° |
| C03 | C02 | C39 | H35 | 50.9° | 60.1° |
| C03 | C02 | C39 | H36 | 170.9° | 60.0° |
| C02 | S04 | O38 | N05 | 128.3° | 111.7° |
| C02 | S04 | O38 | O37 | 124.4° | 131.5° |
| C02 | S04 | N05 | O37 | 121.8° | 116.0° |
| C02 | S04 | N05 | C06 | 95.5° | 90.1° |
| C02 | S04 | N05 | C36 | 61.8° | 90.1° |
| S04 | C02 | C01 | H9 | 57.9° | 60.0° |
| S04 | C02 | C01 | H10 | 62.1° | 60.0° |
| S04 | C02 | C01 | H11 | 177.9° | 180.0° |
| S04 | C02 | C03 | H12 | 61.4° | 180.0° |
| S04 | C02 | C03 | H13 | 178.6° | 60.0° |
| S04 | C02 | C03 | H14 | 58.6° | 60.0° |
| S04 | C02 | C39 | H34 | 55.9° | 60.0° |
| S04 | C02 | C39 | H35 | 175.9° | 60.0° |
| S04 | C02 | C39 | H36 | 64.1° | 179.9° |
| O38 | S04 | N05 | O37 | 109.7° | 127.9° |
| O38 | S04 | N05 | C06 | 33.0° | 153.9° |
| O38 | S04 | N05 | C36 | 169.8° | 26.0° |
| S04 | N05 | C06 | C07 | 131.0° | 179.9° |
| S04 | N05 | C06 | C36 | 158.3° | 179.9° |
| S04 | N05 | C36 | C08 | 143.3° | 180.0° |
| S04 | N05 | C36 | C35 | 31.9° | 1.1° |
| S04 | N05 | C06 | H15 | 12.1° | 61.0° |
| S04 | N05 | C06 | H16 | 110.0° | 61.0° |
| O37 | S04 | N05 | C06 | 142.7° | 26.0° |
| O37 | S04 | N05 | C36 | 60.1° | 153.9° |
| C06 | C07 | C08 | H17 | 119.1° | 118.7° |
| C06 | C07 | C08 | H18 | 119.1° | 118.8° |
| C07 | C06 | N05 | H15 | 119.0° | 118.9° |
| C07 | C06 | N05 | H16 | 119.0° | 119.1° |
| C07 | C06 | N05 | C36 | 27.2° | 0.0° |
| C06 | C07 | C08 | C36 | 14.4° | 0.0° |
| C06 | C07 | C08 | C09 | 165.0° | 180.0° |
| C07 | C06 | H15 | H16 | 123.0° | 122.1° |
| C06 | C07 | H17 | H18 | 122.6° | 122.5° |
| C08 | C07 | C06 | N05 | 24.3° | 0.0° |
| C07 | C08 | C36 | N05 | 2.0° | 0.1° |
| C07 | C08 | C36 | C09 | 179.5° | 180.0° |
| C07 | C08 | C36 | C35 | 177.4° | 179.2° |
| C07 | C08 | C09 | C10 | 179.7° | 179.5° |
| C08 | C07 | C06 | H15 | 143.2° | 119.0° |
| C08 | C07 | C06 | H16 | 94.7° | 119.0° |
| C08 | C07 | H17 | H18 | 122.6° | 122.4° |
| C07 | C08 | C09 | H19 | 0.3° | 0.6° |
| C06 | N05 | C36 | C08 | 18.6° | 0.1° |
| C06 | N05 | C36 | C35 | 166.2° | 179.0° |
| N05 | C06 | H15 | H16 | 123.0° | 122.0° |
| N05 | C06 | C07 | H17 | 143.4° | 118.7° |
| N05 | C06 | C07 | H18 | 94.9° | 118.8° |
| N05 | C36 | C08 | C35 | 175.4° | 179.1° |
| N05 | C36 | C08 | C09 | 178.5° | 179.9° |
| N05 | C36 | C35 | C11 | 179.9° | 179.5° |
| C36 | N05 | C06 | H15 | 146.2° | 118.9° |
| C36 | N05 | C06 | H16 | 91.8° | 119.1° |
| N05 | C36 | C35 | H33 | 0.1° | 0.5° |
| C36 | C08 | C09 | C10 | 0.3° | 0.5° |
| C08 | C36 | C35 | C11 | 5.5° | 0.6° |
| C36 | C08 | C07 | H17 | 133.5° | 118.8° |
| C36 | C08 | C07 | H18 | 104.7° | 118.8° |
| C36 | C08 | C09 | H19 | 179.7° | 179.4° |
| C08 | C36 | C35 | H33 | 174.5° | 179.4° |
| C09 | C08 | C36 | C35 | 3.0° | 0.8° |
| C08 | C09 | C10 | H19 | 180.0° | 179.9° |
| C08 | C09 | C10 | C11 | 0.3° | 0.1° |
| C08 | C09 | C10 | H1 | 179.7° | 179.7° |
| C09 | C08 | C07 | H17 | 45.9° | 61.2° |
| C09 | C08 | C07 | H18 | 75.8° | 61.2° |
| C32 | N29 | C28 | C30 | 120.9° | 124.1° |
| C32 | N29 | C28 | C27 | 171.9° | 62.3° |
| C32 | N29 | C30 | C31 | 175.2° | 62.4° |
| C32 | N29 | C28 | H7 | 67.9° | 177.6° |
| C32 | N29 | C28 | H8 | 51.8° | 57.7° |
| C32 | N29 | C30 | H23 | 54.4° | 57.6° |
| C32 | N29 | C30 | H24 | 64.0° | 177.6° |
| N29 | C32 | H27 | H28 | 120.0° | 120.0° |
| N29 | C32 | H27 | H29 | 120.0° | 119.9° |
| N29 | C32 | H28 | H29 | 120.0° | 120.0° |
| N29 | C28 | C27 | H7 | 120.1° | 120.0° |
| N29 | C28 | C27 | H8 | 120.2° | 120.0° |
| N29 | C28 | C27 | C26 | 48.3° | 59.2° |
| C28 | N29 | C30 | C31 | 63.4° | 61.7° |
| N29 | C28 | H7 | H8 | 119.5° | 120.0° |
| N29 | C28 | C27 | H21 | 169.2° | 179.1° |
| N29 | C28 | C27 | H22 | 72.6° | 60.7° |
| C28 | N29 | C30 | H23 | 175.8° | 178.2° |
| C28 | N29 | C30 | H24 | 57.3° | 58.3° |
| C28 | N29 | C32 | H27 | 180.0° | 60.0° |
| C28 | N29 | C32 | H28 | 60.0° | 180.0° |
| C28 | N29 | C32 | H29 | 60.0° | 60.0° |
| C27 | C28 | N29 | C30 | 67.1° | 61.8° |
| C28 | C27 | C26 | H21 | 120.9° | 119.9° |
| C28 | C27 | C26 | H22 | 120.9° | 119.9° |
| C28 | C27 | C26 | C31 | 23.8° | 57.7° |
| C28 | C27 | C26 | C22 | 92.6° | 177.5° |
| C28 | C27 | C26 | H6 | 144.2° | 62.3° |
| C27 | C28 | H7 | H8 | 119.5° | 120.0° |
| C28 | C27 | H21 | H22 | 117.3° | 120.1° |
| C36 | C35 | C11 | H33 | 180.0° | 180.0° |
| C36 | C35 | C11 | C10 | 5.2° | 0.0° |
| C36 | C35 | C11 | N12 | 177.3° | 180.0° |
| C09 | C10 | C11 | C35 | 2.9° | 0.3° |
| C09 | C10 | C11 | H1 | 180.0° | 179.7° |
| C09 | C10 | C11 | N12 | 179.6° | 179.7° |
| N29 | C30 | C31 | H23 | 120.8° | 120.1° |
| N29 | C30 | C31 | H24 | 120.8° | 120.0° |
| N29 | C30 | C31 | C26 | 38.2° | 59.2° |
| C30 | N29 | C28 | H7 | 53.0° | 58.3° |
| C30 | N29 | C28 | H8 | 172.7° | 178.2° |
| N29 | C30 | H23 | H24 | 117.6° | 120.0° |
| N29 | C30 | C31 | H25 | 82.5° | 60.8° |
| N29 | C30 | C31 | H26 | 158.9° | 179.1° |
| C30 | N29 | C32 | H27 | 60.3° | 64.3° |
| C30 | N29 | C32 | H28 | 179.7° | 55.8° |
| C30 | N29 | C32 | H29 | 59.8° | 175.8° |
| C35 | C11 | C10 | N12 | 177.5° | 179.9° |
| C35 | C11 | N12 | C13 | 141.5° | 147.1° |
| C35 | C11 | C10 | H1 | 177.1° | 180.0° |
| C35 | C11 | N12 | H2 | 38.5° | 33.0° |
| C27 | C26 | C31 | C30 | 18.4° | 57.7° |
| C27 | C26 | C31 | C22 | 130.2° | 119.8° |
| C27 | C26 | C31 | H6 | 120.4° | 120.0° |
| C27 | C26 | C22 | H6 | 123.6° | 120.2° |
| C27 | C26 | C22 | C23 | 48.7° | 120.4° |
| C27 | C26 | C22 | C21 | 131.4° | 59.7° |
| C26 | C27 | C28 | H7 | 71.8° | 60.8° |
| C26 | C27 | C28 | H8 | 168.5° | 179.2° |
| C26 | C27 | H21 | H22 | 117.3° | 120.1° |
| C27 | C26 | C31 | H25 | 102.4° | 62.2° |
| C27 | C26 | C31 | H26 | 139.1° | 177.6° |
| C10 | C11 | N12 | C13 | 41.0° | 32.9° |
| C10 | C11 | N12 | H2 | 139.0° | 147.1° |
| C11 | C10 | C09 | H19 | 179.7° | 180.0° |
| C10 | C11 | C35 | H33 | 174.8° | 180.0° |
| C11 | N12 | C13 | H2 | 180.0° | 180.0° |
| C11 | N12 | C13 | N33 | 12.9° | 5.3° |
| C11 | N12 | C13 | C14 | 168.1° | 174.4° |
| N12 | C11 | C10 | H1 | 0.4° | 0.1° |
| N12 | C11 | C35 | H33 | 2.7° | 0.1° |
| F24 | C23 | C22 | C26 | 0.5° | 0.1° |
| F24 | C23 | C22 | C25 | 179.7° | 179.8° |
| F24 | C23 | C22 | C21 | 179.4° | 180.0° |
| F24 | C23 | C25 | C19 | 180.0° | 180.0° |
| F24 | C23 | C25 | H20 | 0.0° | 0.3° |
| N12 | C13 | N33 | C14 | 179.0° | 179.7° |
| N12 | C13 | N33 | C17 | 179.4° | 180.0° |
| N12 | C13 | C14 | C34 | 2.0° | 0.0° |
| N12 | C13 | C14 | C15 | 178.7° | 180.0° |
| C30 | C31 | C26 | H25 | 120.7° | 119.9° |
| C30 | C31 | C26 | H26 | 120.7° | 119.9° |
| C30 | C31 | C26 | C22 | 111.8° | 177.5° |
| C30 | C31 | C26 | H6 | 138.7° | 62.3° |
| C31 | C30 | H23 | H24 | 117.6° | 119.9° |
| C30 | C31 | H25 | H26 | 117.8° | 120.1° |
| C31 | C26 | C22 | H6 | 110.1° | 120.2° |
| C31 | C26 | C22 | C23 | 175.0° | 120.0° |
| C31 | C26 | C22 | C21 | 5.2° | 59.9° |
| C31 | C26 | C27 | H21 | 144.7° | 177.6° |
| C31 | C26 | C27 | H22 | 97.1° | 62.2° |
| C26 | C31 | C30 | H23 | 159.0° | 179.3° |
| C26 | C31 | C30 | H24 | 82.5° | 60.8° |
| C26 | C31 | H25 | H26 | 117.8° | 120.1° |
| C26 | C22 | C23 | C21 | 179.9° | 179.9° |
| C26 | C22 | C23 | C25 | 179.8° | 179.7° |
| C26 | C22 | C21 | C20 | 179.8° | 180.0° |
| C26 | C22 | C21 | H5 | 0.2° | 0.1° |
| C22 | C26 | C27 | H21 | 28.3° | 62.5° |
| C22 | C26 | C27 | H22 | 146.5° | 57.6° |
| C22 | C26 | C31 | H25 | 127.4° | 57.6° |
| C22 | C26 | C31 | H26 | 8.9° | 62.6° |
| C22 | C23 | C25 | C19 | 0.3° | 0.2° |
| C23 | C22 | C21 | C20 | 0.1° | 0.1° |
| C23 | C22 | C21 | H5 | 179.9° | 180.0° |
| C23 | C22 | C26 | H6 | 74.9° | 0.2° |
| C22 | C23 | C25 | H20 | 179.7° | 179.9° |
| C25 | C23 | C22 | C21 | 0.3° | 0.2° |
| C23 | C25 | C19 | H20 | 180.0° | 179.7° |
| C23 | C25 | C19 | C20 | 1.4° | 0.0° |
| C23 | C25 | C19 | N18 | 178.8° | 180.0° |
| N33 | C13 | C14 | C34 | 179.1° | 179.7° |
| N33 | C13 | C14 | C15 | 0.3° | 0.2° |
| C13 | N33 | C17 | N18 | 178.7° | 179.7° |
| C13 | N33 | C17 | N16 | 1.0° | 0.0° |
| N33 | C13 | N12 | H2 | 167.1° | 174.7° |
| C14 | C13 | N33 | C17 | 0.4° | 0.2° |
| C13 | C14 | C34 | C15 | 179.3° | 180.0° |
| C13 | C14 | C15 | N16 | 0.3° | 0.0° |
| C14 | C13 | N12 | H2 | 11.9° | 5.6° |
| C13 | C14 | C15 | H3 | 179.6° | 179.8° |
| C13 | C14 | C34 | H30 | 89.6° | 89.9° |
| C13 | C14 | C34 | H31 | 150.4° | 150.0° |
| C13 | C14 | C34 | H32 | 30.4° | 30.0° |
| C22 | C21 | C20 | H5 | 180.0° | 179.9° |
| C22 | C21 | C20 | C19 | 1.1° | 0.3° |
| C22 | C21 | C20 | H4 | 178.9° | 180.0° |
| C21 | C22 | C26 | H6 | 105.0° | 179.9° |
| C25 | C19 | C20 | C21 | 1.8° | 0.3° |
| C25 | C19 | C20 | N18 | 179.9° | 180.0° |
| C25 | C19 | N18 | C17 | 8.0° | 33.9° |
| C25 | C19 | C20 | H4 | 178.2° | 180.0° |
| C25 | C19 | N18 | H37 | 172.0° | 146.1° |
| N33 | C17 | N18 | C19 | 2.4° | 175.1° |
| N33 | C17 | N18 | N16 | 179.7° | 179.7° |
| N33 | C17 | N16 | C15 | 1.0° | 0.3° |
| N33 | C17 | N18 | H37 | 177.6° | 4.9° |
| C34 | C14 | C15 | N16 | 179.0° | 180.0° |
| C34 | C14 | C15 | H3 | 1.0° | 0.2° |
| C14 | C34 | H30 | H31 | 120.0° | 120.1° |
| C14 | C34 | H30 | H32 | 120.0° | 120.0° |
| C14 | C34 | H31 | H32 | 120.0° | 120.0° |
| C14 | C15 | N16 | C17 | 0.2° | 0.3° |
| C14 | C15 | N16 | H3 | 180.0° | 179.8° |
| C15 | C14 | C34 | H30 | 89.7° | 90.0° |
| C15 | C14 | C34 | H31 | 30.3° | 30.0° |
| C15 | C14 | C34 | H32 | 150.3° | 150.0° |
| C21 | C20 | C19 | H4 | 180.0° | 179.7° |
| C21 | C20 | C19 | N18 | 178.3° | 179.7° |
| C20 | C19 | N18 | C17 | 172.1° | 146.1° |
| C19 | C20 | C21 | H5 | 178.9° | 179.8° |
| C20 | C19 | C25 | H20 | 178.7° | 179.7° |
| C20 | C19 | N18 | H37 | 7.9° | 33.9° |
| C19 | N18 | C17 | H37 | 180.0° | 180.0° |
| C19 | N18 | C17 | N16 | 177.4° | 5.1° |
| N18 | C19 | C20 | H4 | 1.7° | 0.0° |
| N18 | C19 | C25 | H20 | 1.2° | 0.3° |
| N18 | C17 | N16 | C15 | 178.8° | 180.0° |
| C17 | N16 | C15 | H3 | 179.8° | 179.9° |
| N16 | C17 | N18 | H37 | 2.7° | 174.8° |
| H1 | C10 | C09 | H19 | 0.3° | 0.4° |
| H4 | C20 | C21 | H5 | 1.1° | 0.0° |
| H6 | C26 | C27 | H21 | 95.0° | 57.6° |
| H6 | C26 | C27 | H22 | 23.3° | 177.8° |
| H6 | C26 | C31 | H25 | 18.0° | 177.7° |
| H6 | C26 | C31 | H26 | 100.6° | 57.6° |
| H7 | C28 | C27 | H21 | 49.1° | 59.1° |
| H7 | C28 | C27 | H22 | 167.3° | 179.3° |
| H8 | C28 | C27 | H21 | 70.6° | 60.9° |
| H8 | C28 | C27 | H22 | 47.6° | 59.3° |
| H9 | C01 | H10 | H11 | 120.0° | 120.0° |
| H12 | C03 | H13 | H14 | 120.0° | 120.0° |
| H15 | C06 | C07 | H17 | 97.6° | 122.3° |
| H15 | C06 | C07 | H18 | 24.1° | 0.2° |
| H16 | C06 | C07 | H17 | 24.4° | 0.3° |
| H16 | C06 | C07 | H18 | 146.2° | 122.2° |
| H23 | C30 | C31 | H25 | 38.2° | 59.3° |
| H23 | C30 | C31 | H26 | 80.3° | 60.8° |
| H24 | C30 | C31 | H25 | 156.7° | 179.2° |
| H24 | C30 | C31 | H26 | 38.2° | 59.1° |
| H27 | C32 | H28 | H29 | 120.0° | 120.0° |
| H30 | C34 | H31 | H32 | 120.0° | 120.0° |
| H34 | C39 | H35 | H36 | 120.0° | 120.0° |
