CF6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N7 | N8 | sing | 1.29Å | 1.42Å | Aromatic |
| N7 | C32 | doub | 1.31Å | 1.36Å | Aromatic |
| N8 | C34 | doub | 1.30Å | 1.35Å | Aromatic |
| C33 | C32 | sing | 1.51Å | 1.50Å | |
| C32 | N6 | sing | 1.35Å | 1.35Å | Aromatic |
| C34 | N6 | sing | 1.36Å | 1.35Å | Aromatic |
| C34 | C24 | sing | 1.51Å | 1.48Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C23 | C22 | sing | 1.51Å | 1.52Å | |
| N6 | C27 | sing | 1.40Å | 1.36Å | |
| C24 | N5 | sing | 1.46Å | 1.45Å | |
| C22 | O1 | doub | 1.21Å | 1.23Å | |
| C22 | N4 | sing | 1.35Å | 1.33Å | |
| C27 | S1 | sing | 1.71Å | 1.73Å | Aromatic |
| C27 | C26 | doub | 1.38Å | 1.48Å | Aromatic |
| S1 | C28 | sing | 1.75Å | 1.73Å | Aromatic |
| N4 | C21 | sing | 1.46Å | 1.46Å | |
| N5 | C25 | doub | 1.29Å | 1.26Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C26 | C25 | sing | 1.48Å | 1.49Å | |
| C26 | C30 | sing | 1.45Å | 1.51Å | Aromatic |
| C25 | C35 | sing | 1.48Å | 1.50Å | |
| C28 | C29 | sing | 1.51Å | 1.51Å | |
| C28 | C30 | doub | 1.32Å | 1.49Å | Aromatic |
| C30 | C31 | sing | 1.51Å | 1.51Å | |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| C35 | C36 | doub | 1.40Å | 1.39Å | Aromatic |
| C35 | C40 | sing | 1.39Å | 1.40Å | Aromatic |
| C19 | C18 | sing | 1.53Å | 1.53Å | |
| C36 | C37 | sing | 1.38Å | 1.39Å | Aromatic |
| C40 | C39 | doub | 1.38Å | 1.38Å | Aromatic |
| CL1 | C45 | sing | 1.74Å | 1.78Å | |
| C37 | C38 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C39 | C38 | sing | 1.39Å | 1.38Å | Aromatic |
| C38 | CL | sing | 1.74Å | 1.77Å | |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| C45 | C44 | doub | 1.39Å | 1.38Å | Aromatic |
| C45 | C46 | sing | 1.38Å | 1.39Å | Aromatic |
| C44 | C43 | sing | 1.38Å | 1.38Å | Aromatic |
| C46 | C47 | doub | 1.38Å | 1.39Å | Aromatic |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C43 | C42 | doub | 1.39Å | 1.40Å | Aromatic |
| C47 | C42 | sing | 1.39Å | 1.39Å | Aromatic |
| C3 | C2 | sing | 1.51Å | 1.51Å | |
| C42 | C41 | sing | 1.48Å | 1.50Å | |
| C14 | C13 | sing | 1.53Å | 1.52Å | |
| C2 | C1 | doub | 1.32Å | 1.48Å | Aromatic |
| C2 | C4 | sing | 1.45Å | 1.51Å | Aromatic |
| C | C1 | sing | 1.51Å | 1.51Å | |
| C41 | C4 | sing | 1.48Å | 1.49Å | |
| C41 | N9 | doub | 1.29Å | 1.26Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C1 | S | sing | 1.75Å | 1.74Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.49Å | Aromatic |
| N9 | C9 | sing | 1.46Å | 1.45Å | |
| C12 | N3 | sing | 1.46Å | 1.45Å | |
| O | C11 | doub | 1.21Å | 1.23Å | |
| C5 | S | sing | 1.71Å | 1.73Å | Aromatic |
| C5 | N | sing | 1.39Å | 1.36Å | |
| N3 | C11 | sing | 1.35Å | 1.33Å | |
| C11 | C10 | sing | 1.51Å | 1.52Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C9 | C8 | sing | 1.51Å | 1.48Å | |
| N | C8 | sing | 1.36Å | 1.34Å | Aromatic |
| N | C6 | sing | 1.35Å | 1.34Å | Aromatic |
| C8 | N2 | doub | 1.30Å | 1.35Å | Aromatic |
| C6 | C7 | sing | 1.51Å | 1.51Å | |
| C6 | N1 | doub | 1.31Å | 1.35Å | Aromatic |
| N2 | N1 | sing | 1.29Å | 1.41Å | Aromatic |
| C44 | H1 | sing | 1.08Å | 1.08Å | |
| C43 | H2 | sing | 1.08Å | 1.08Å | |
| C46 | H3 | sing | 1.08Å | 1.08Å | |
| C47 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C | H12 | sing | 1.09Å | 1.10Å | |
| C | H13 | sing | 1.09Å | 1.10Å | |
| C | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| N3 | H17 | sing | 0.97Å | 1.00Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C13 | H21 | sing | 1.09Å | 1.10Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| C14 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H25 | sing | 1.09Å | 1.10Å | |
| C16 | H26 | sing | 1.09Å | 1.10Å | |
| C16 | H27 | sing | 1.09Å | 1.10Å | |
| C17 | H28 | sing | 1.09Å | 1.10Å | |
| C17 | H29 | sing | 1.09Å | 1.10Å | |
| C18 | H30 | sing | 1.09Å | 1.10Å | |
| C18 | H31 | sing | 1.09Å | 1.10Å | |
| C19 | H32 | sing | 1.09Å | 1.10Å | |
| C19 | H33 | sing | 1.09Å | 1.10Å | |
| C20 | H34 | sing | 1.09Å | 1.10Å | |
| C20 | H35 | sing | 1.09Å | 1.10Å | |
| C21 | H36 | sing | 1.09Å | 1.10Å | |
| C21 | H37 | sing | 1.09Å | 1.10Å | |
| N4 | H38 | sing | 0.97Å | 1.00Å | |
| C23 | H39 | sing | 1.09Å | 1.10Å | |
| C23 | H40 | sing | 1.09Å | 1.10Å | |
| C24 | H41 | sing | 1.09Å | 1.10Å | |
| C33 | H42 | sing | 1.09Å | 1.10Å | |
| C33 | H43 | sing | 1.09Å | 1.10Å | |
| C33 | H44 | sing | 1.09Å | 1.10Å | |
| C31 | H45 | sing | 1.09Å | 1.10Å | |
| C31 | H46 | sing | 1.09Å | 1.10Å | |
| C31 | H47 | sing | 1.09Å | 1.10Å | |
| C29 | H48 | sing | 1.09Å | 1.10Å | |
| C29 | H49 | sing | 1.09Å | 1.10Å | |
| C29 | H50 | sing | 1.09Å | 1.10Å | |
| C40 | H51 | sing | 1.08Å | 1.08Å | |
| C39 | H52 | sing | 1.08Å | 1.08Å | |
| C37 | H53 | sing | 1.08Å | 1.08Å | |
| C36 | H54 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N8 | N7 | C32 | 108.7° | 109.9° |
| N7 | N8 | C34 | 107.2° | 109.7° |
| N7 | C32 | C33 | 125.0° | 126.6° |
| N7 | C32 | N6 | 104.8° | 106.8° |
| N8 | C34 | N6 | 106.0° | 107.1° |
| N8 | C34 | C24 | 128.0° | 127.9° |
| C33 | C32 | N6 | 130.1° | 126.6° |
| C32 | C33 | H42 | 109.5° | 109.5° |
| C32 | C33 | H43 | 109.5° | 109.5° |
| C32 | C33 | H44 | 109.5° | 109.4° |
| C32 | N6 | C34 | 113.2° | 106.5° |
| C32 | N6 | C27 | 128.6° | 129.0° |
| N6 | C34 | C24 | 126.0° | 125.1° |
| C34 | N6 | C27 | 117.9° | 124.5° |
| C34 | C24 | C23 | 113.9° | 109.5° |
| C34 | C24 | N5 | 106.3° | 109.2° |
| C34 | C24 | H41 | 110.7° | 109.5° |
| C24 | C23 | C22 | 107.0° | 109.5° |
| C23 | C24 | N5 | 104.5° | 109.5° |
| C24 | C23 | H39 | 110.1° | 109.5° |
| C24 | C23 | H40 | 110.1° | 109.5° |
| C23 | C24 | H41 | 110.1° | 109.6° |
| C23 | C22 | O1 | 119.9° | 120.0° |
| C23 | C22 | N4 | 117.0° | 120.0° |
| C22 | C23 | H39 | 110.1° | 109.5° |
| C22 | C23 | H40 | 110.1° | 109.5° |
| N6 | C27 | S1 | 126.4° | 124.9° |
| N6 | C27 | C26 | 123.2° | 124.1° |
| C24 | N5 | C25 | 119.0° | 122.4° |
| N5 | C24 | H41 | 111.1° | 109.5° |
| O1 | C22 | N4 | 123.0° | 120.0° |
| C22 | N4 | C21 | 121.9° | 120.0° |
| C22 | N4 | H38 | 119.0° | 120.0° |
| S1 | C27 | C26 | 110.1° | 111.0° |
| C27 | S1 | C28 | 96.4° | 92.6° |
| C27 | C26 | C25 | 122.5° | 124.8° |
| C27 | C26 | C30 | 112.2° | 111.7° |
| S1 | C28 | C29 | 118.5° | 124.7° |
| S1 | C28 | C30 | 111.0° | 110.7° |
| N4 | C21 | C20 | 112.9° | 109.5° |
| N4 | C21 | H36 | 108.6° | 109.5° |
| N4 | C21 | H37 | 108.6° | 109.5° |
| C21 | N4 | H38 | 119.0° | 120.0° |
| N5 | C25 | C26 | 121.4° | 126.0° |
| N5 | C25 | C35 | 119.8° | 117.0° |
| C21 | C20 | C19 | 114.1° | 109.5° |
| C21 | C20 | H34 | 108.3° | 109.5° |
| C21 | C20 | H35 | 108.3° | 109.5° |
| C20 | C21 | H36 | 108.6° | 109.4° |
| C20 | C21 | H37 | 108.6° | 109.5° |
| C25 | C26 | C30 | 125.2° | 123.5° |
| C26 | C25 | C35 | 118.6° | 117.1° |
| C26 | C30 | C28 | 110.2° | 113.9° |
| C26 | C30 | C31 | 127.9° | 123.1° |
| C25 | C35 | C36 | 119.5° | 120.1° |
| C25 | C35 | C40 | 120.6° | 120.2° |
| C29 | C28 | C30 | 130.4° | 124.7° |
| C28 | C29 | H48 | 109.5° | 109.5° |
| C28 | C29 | H49 | 109.5° | 109.5° |
| C28 | C29 | H50 | 109.5° | 109.5° |
| C28 | C30 | C31 | 121.8° | 123.0° |
| C30 | C31 | H45 | 109.5° | 109.5° |
| C30 | C31 | H46 | 109.5° | 109.4° |
| C30 | C31 | H47 | 109.5° | 109.4° |
| C20 | C19 | C18 | 107.9° | 109.5° |
| C20 | C19 | H32 | 109.9° | 109.5° |
| C20 | C19 | H33 | 109.8° | 109.5° |
| C19 | C20 | H34 | 108.3° | 109.4° |
| C19 | C20 | H35 | 108.3° | 109.5° |
| C36 | C35 | C40 | 119.9° | 119.7° |
| C35 | C36 | C37 | 118.8° | 119.9° |
| C35 | C36 | H54 | 120.6° | 120.1° |
| C35 | C40 | C39 | 121.7° | 119.9° |
| C35 | C40 | H51 | 119.1° | 120.0° |
| C19 | C18 | C17 | 114.3° | 109.5° |
| C19 | C18 | H30 | 108.3° | 109.5° |
| C19 | C18 | H31 | 108.2° | 109.5° |
| C18 | C19 | H32 | 109.8° | 109.5° |
| C18 | C19 | H33 | 109.9° | 109.5° |
| C36 | C37 | C38 | 120.0° | 120.2° |
| C36 | C37 | H53 | 120.0° | 119.9° |
| C37 | C36 | H54 | 120.6° | 120.1° |
| C40 | C39 | C38 | 117.3° | 120.1° |
| C39 | C40 | H51 | 119.1° | 120.0° |
| C40 | C39 | H52 | 121.3° | 120.0° |
| CL1 | C45 | C44 | 118.9° | 119.8° |
| CL1 | C45 | C46 | 119.8° | 119.9° |
| C37 | C38 | C39 | 122.2° | 120.2° |
| C37 | C38 | CL | 120.3° | 119.9° |
| C38 | C37 | H53 | 120.0° | 119.9° |
| C18 | C17 | C16 | 108.8° | 109.5° |
| C18 | C17 | H28 | 109.6° | 109.5° |
| C18 | C17 | H29 | 109.6° | 109.5° |
| C17 | C18 | H30 | 108.3° | 109.4° |
| C17 | C18 | H31 | 108.3° | 109.5° |
| C39 | C38 | CL | 117.5° | 119.8° |
| C38 | C39 | H52 | 121.3° | 119.9° |
| C17 | C16 | C15 | 113.9° | 109.5° |
| C17 | C16 | H26 | 108.4° | 109.6° |
| C17 | C16 | H27 | 108.3° | 109.5° |
| C16 | C17 | H28 | 109.6° | 109.5° |
| C16 | C17 | H29 | 109.6° | 109.4° |
| C44 | C45 | C46 | 121.3° | 120.3° |
| C45 | C44 | C43 | 119.0° | 120.1° |
| C45 | C44 | H1 | 120.5° | 120.0° |
| C45 | C46 | C47 | 119.8° | 120.1° |
| C45 | C46 | H3 | 120.1° | 120.0° |
| C44 | C43 | C42 | 120.3° | 119.9° |
| C43 | C44 | H1 | 120.5° | 119.9° |
| C44 | C43 | H2 | 119.9° | 120.1° |
| C46 | C47 | C42 | 119.1° | 119.9° |
| C47 | C46 | H3 | 120.1° | 119.9° |
| C46 | C47 | H4 | 120.5° | 120.0° |
| C16 | C15 | C14 | 110.1° | 109.5° |
| C16 | C15 | H24 | 109.3° | 109.5° |
| C16 | C15 | H25 | 109.3° | 109.5° |
| C15 | C16 | H26 | 108.3° | 109.5° |
| C15 | C16 | H27 | 108.3° | 109.4° |
| C15 | C14 | C13 | 111.4° | 109.4° |
| C15 | C14 | H22 | 109.0° | 109.5° |
| C15 | C14 | H23 | 109.0° | 109.5° |
| C14 | C15 | H24 | 109.3° | 109.4° |
| C14 | C15 | H25 | 109.3° | 109.5° |
| C43 | C42 | C47 | 120.5° | 119.8° |
| C43 | C42 | C41 | 119.7° | 120.1° |
| C42 | C43 | H2 | 119.9° | 120.1° |
| C47 | C42 | C41 | 119.9° | 120.1° |
| C42 | C47 | H4 | 120.4° | 120.1° |
| C3 | C2 | C1 | 121.5° | 123.0° |
| C3 | C2 | C4 | 128.0° | 123.0° |
| C2 | C3 | H5 | 109.5° | 109.4° |
| C2 | C3 | H6 | 109.4° | 109.5° |
| C2 | C3 | H7 | 109.5° | 109.5° |
| C42 | C41 | C4 | 118.0° | 117.0° |
| C42 | C41 | N9 | 119.9° | 117.0° |
| C14 | C13 | C12 | 111.7° | 109.5° |
| C14 | C13 | H20 | 108.9° | 109.5° |
| C14 | C13 | H21 | 108.9° | 109.5° |
| C13 | C14 | H22 | 109.0° | 109.5° |
| C13 | C14 | H23 | 109.0° | 109.5° |
| C1 | C2 | C4 | 110.5° | 114.0° |
| C2 | C1 | C | 130.7° | 124.7° |
| C2 | C1 | S | 110.7° | 110.6° |
| C2 | C4 | C41 | 124.5° | 123.5° |
| C2 | C4 | C5 | 112.3° | 111.7° |
| C | C1 | S | 118.7° | 124.7° |
| C1 | C | H12 | 109.5° | 109.4° |
| C1 | C | H13 | 109.5° | 109.5° |
| C1 | C | H14 | 109.5° | 109.5° |
| C4 | C41 | N9 | 122.0° | 126.0° |
| C41 | C4 | C5 | 123.1° | 124.7° |
| C41 | N9 | C9 | 119.6° | 122.4° |
| C13 | C12 | N3 | 112.5° | 109.5° |
| C13 | C12 | H18 | 108.7° | 109.5° |
| C13 | C12 | H19 | 108.7° | 109.5° |
| C12 | C13 | H20 | 108.9° | 109.5° |
| C12 | C13 | H21 | 108.9° | 109.5° |
| C1 | S | C5 | 96.9° | 92.6° |
| C4 | C5 | S | 109.6° | 111.0° |
| C4 | C5 | N | 123.7° | 124.2° |
| N9 | C9 | C10 | 106.9° | 109.5° |
| N9 | C9 | C8 | 107.2° | 109.1° |
| N9 | C9 | H8 | 110.5° | 109.5° |
| C12 | N3 | C11 | 121.2° | 120.0° |
| C12 | N3 | H17 | 119.4° | 120.0° |
| N3 | C12 | H18 | 108.7° | 109.5° |
| N3 | C12 | H19 | 108.7° | 109.5° |
| O | C11 | N3 | 122.3° | 120.0° |
| O | C11 | C10 | 120.8° | 120.0° |
| S | C5 | N | 126.5° | 124.8° |
| C5 | N | C8 | 118.6° | 124.6° |
| C5 | N | C6 | 127.8° | 128.8° |
| N3 | C11 | C10 | 116.9° | 120.0° |
| C11 | N3 | H17 | 119.4° | 120.0° |
| C11 | C10 | C9 | 108.6° | 109.5° |
| C11 | C10 | H15 | 109.7° | 109.4° |
| C11 | C10 | H16 | 109.7° | 109.4° |
| C10 | C9 | C8 | 112.7° | 109.5° |
| C10 | C9 | H8 | 109.5° | 109.5° |
| C9 | C10 | H15 | 109.7° | 109.5° |
| C9 | C10 | H16 | 109.7° | 109.5° |
| C9 | C8 | N | 126.0° | 125.1° |
| C9 | C8 | N2 | 128.2° | 127.8° |
| C8 | C9 | H8 | 110.1° | 109.6° |
| C8 | N | C6 | 113.6° | 106.5° |
| N | C8 | N2 | 105.8° | 107.1° |
| N | C6 | C7 | 130.8° | 126.7° |
| N | C6 | N1 | 104.5° | 106.7° |
| C8 | N2 | N1 | 107.4° | 109.7° |
| C7 | C6 | N1 | 124.7° | 126.6° |
| C6 | C7 | H9 | 109.5° | 109.5° |
| C6 | C7 | H10 | 109.5° | 109.5° |
| C6 | C7 | H11 | 109.5° | 109.5° |
| C6 | N1 | N2 | 108.7° | 110.0° |
| H5 | C3 | H6 | 109.5° | 109.5° |
| H5 | C3 | H7 | 109.5° | 109.5° |
| H6 | C3 | H7 | 109.5° | 109.5° |
| H9 | C7 | H10 | 109.5° | 109.4° |
| H9 | C7 | H11 | 109.5° | 109.5° |
| H10 | C7 | H11 | 109.5° | 109.5° |
| H12 | C | H13 | 109.5° | 109.5° |
| H12 | C | H14 | 109.4° | 109.5° |
| H13 | C | H14 | 109.5° | 109.5° |
| H15 | C10 | H16 | 109.5° | 109.5° |
| H18 | C12 | H19 | 109.5° | 109.5° |
| H20 | C13 | H21 | 109.4° | 109.4° |
| H22 | C14 | H23 | 109.4° | 109.5° |
| H24 | C15 | H25 | 109.5° | 109.5° |
| H26 | C16 | H27 | 109.5° | 109.4° |
| H28 | C17 | H29 | 109.5° | 109.5° |
| H30 | C18 | H31 | 109.5° | 109.5° |
| H32 | C19 | H33 | 109.5° | 109.4° |
| H34 | C20 | H35 | 109.5° | 109.4° |
| H36 | C21 | H37 | 109.5° | 109.5° |
| H39 | C23 | H40 | 109.5° | 109.4° |
| H42 | C33 | H43 | 109.5° | 109.5° |
| H42 | C33 | H44 | 109.5° | 109.4° |
| H43 | C33 | H44 | 109.5° | 109.5° |
| H45 | C31 | H46 | 109.5° | 109.5° |
| H45 | C31 | H47 | 109.4° | 109.5° |
| H46 | C31 | H47 | 109.4° | 109.4° |
| H48 | C29 | H49 | 109.5° | 109.4° |
| H48 | C29 | H50 | 109.5° | 109.4° |
| H49 | C29 | H50 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N8 | N7 | C32 | C33 | 179.8° | 179.8° |
| N8 | N7 | C32 | N6 | 1.9° | 0.2° |
| N7 | N8 | C34 | N6 | 1.6° | 0.4° |
| N7 | N8 | C34 | C24 | 179.1° | 179.3° |
| C32 | N7 | N8 | C34 | 0.2° | 0.1° |
| N7 | C32 | C33 | N6 | 177.3° | 179.9° |
| N7 | C32 | N6 | C34 | 3.1° | 0.5° |
| N7 | C32 | N6 | C27 | 176.7° | 179.1° |
| N7 | C32 | C33 | H42 | 0.0° | 90.0° |
| N7 | C32 | C33 | H43 | 120.0° | 150.0° |
| N7 | C32 | C33 | H44 | 120.0° | 30.0° |
| N8 | C34 | N6 | C32 | 3.0° | 0.5° |
| N8 | C34 | N6 | C24 | 177.5° | 179.7° |
| N8 | C34 | C24 | C23 | 5.9° | 120.0° |
| N8 | C34 | N6 | C27 | 177.4° | 179.0° |
| N8 | C34 | C24 | N5 | 108.6° | 120.1° |
| N8 | C34 | C24 | H41 | 130.6° | 0.2° |
| C33 | C32 | N6 | C34 | 179.1° | 179.6° |
| C33 | C32 | N6 | C27 | 5.6° | 0.8° |
| C32 | C33 | H42 | H43 | 120.0° | 120.0° |
| C32 | C33 | H42 | H44 | 120.0° | 119.9° |
| C32 | C33 | H43 | H44 | 120.0° | 120.0° |
| C32 | N6 | C34 | C27 | 174.3° | 179.6° |
| C32 | N6 | C34 | C24 | 179.5° | 179.2° |
| C32 | N6 | C27 | S1 | 39.2° | 33.2° |
| C32 | N6 | C27 | C26 | 147.4° | 146.8° |
| N6 | C32 | C33 | H42 | 177.3° | 90.0° |
| N6 | C32 | C33 | H43 | 57.3° | 30.0° |
| N6 | C32 | C33 | H44 | 62.7° | 150.1° |
| N6 | C34 | C24 | C23 | 177.1° | 60.3° |
| N6 | C34 | C24 | N5 | 68.3° | 59.6° |
| C34 | N6 | C27 | S1 | 134.1° | 146.3° |
| C34 | N6 | C27 | C26 | 39.3° | 33.7° |
| N6 | C34 | C24 | H41 | 52.4° | 179.5° |
| C34 | C24 | C23 | N5 | 115.6° | 119.7° |
| C34 | C24 | C23 | H41 | 125.0° | 120.2° |
| C34 | C24 | C23 | C22 | 173.9° | 175.3° |
| C24 | C34 | N6 | C27 | 5.2° | 1.2° |
| C34 | C24 | N5 | H41 | 120.5° | 119.9° |
| C34 | C24 | N5 | C25 | 72.0° | 62.4° |
| C34 | C24 | C23 | H39 | 66.5° | 55.3° |
| C34 | C24 | C23 | H40 | 54.2° | 64.7° |
| C24 | C23 | C22 | H39 | 119.6° | 120.0° |
| C24 | C23 | C22 | H40 | 119.6° | 120.1° |
| C23 | C24 | N5 | H41 | 118.7° | 120.2° |
| C24 | C23 | C22 | O1 | 51.4° | 0.0° |
| C24 | C23 | C22 | N4 | 129.3° | 180.0° |
| C23 | C24 | N5 | C25 | 167.2° | 57.5° |
| C24 | C23 | H39 | H40 | 121.1° | 120.0° |
| C22 | C23 | C24 | N5 | 70.5° | 65.0° |
| C23 | C22 | O1 | N4 | 179.3° | 179.9° |
| C23 | C22 | N4 | C21 | 177.2° | 180.0° |
| C23 | C22 | N4 | H38 | 2.7° | 0.1° |
| C22 | C23 | H39 | H40 | 121.2° | 120.0° |
| C22 | C23 | C24 | H41 | 48.9° | 55.1° |
| N6 | C27 | S1 | C26 | 174.1° | 180.0° |
| N6 | C27 | S1 | C28 | 175.5° | 177.5° |
| N6 | C27 | C26 | C25 | 6.6° | 3.9° |
| N6 | C27 | C26 | C30 | 175.7° | 176.9° |
| C24 | N5 | C25 | C26 | 3.5° | 4.6° |
| C24 | N5 | C25 | C35 | 178.8° | 175.3° |
| N5 | C24 | C23 | H39 | 49.1° | 175.0° |
| N5 | C24 | C23 | H40 | 169.9° | 55.0° |
| O1 | C22 | N4 | C21 | 3.5° | 0.0° |
| O1 | C22 | N4 | H38 | 176.5° | 180.0° |
| O1 | C22 | C23 | H39 | 171.0° | 120.0° |
| O1 | C22 | C23 | H40 | 68.2° | 120.0° |
| C22 | N4 | C21 | H38 | 180.0° | 180.0° |
| C22 | N4 | C21 | C20 | 78.5° | 180.0° |
| C22 | N4 | C21 | H36 | 161.1° | 60.1° |
| C22 | N4 | C21 | H37 | 42.0° | 60.0° |
| N4 | C22 | C23 | H39 | 9.7° | 60.1° |
| N4 | C22 | C23 | H40 | 111.1° | 59.9° |
| S1 | C27 | C26 | C25 | 179.0° | 176.1° |
| S1 | C27 | C26 | C30 | 1.3° | 3.2° |
| C27 | S1 | C28 | C29 | 179.3° | 178.7° |
| C27 | S1 | C28 | C30 | 1.0° | 1.2° |
| C26 | C27 | S1 | C28 | 1.3° | 2.5° |
| C27 | C26 | C25 | N5 | 46.9° | 37.8° |
| C27 | C26 | C25 | C30 | 177.4° | 179.1° |
| C27 | C26 | C25 | C35 | 128.4° | 142.3° |
| C27 | C26 | C30 | C28 | 0.6° | 2.3° |
| C27 | C26 | C30 | C31 | 179.1° | 177.7° |
| S1 | C28 | C30 | C26 | 0.3° | 0.4° |
| S1 | C28 | C29 | C30 | 179.7° | 179.9° |
| S1 | C28 | C30 | C31 | 179.9° | 179.7° |
| S1 | C28 | C29 | H48 | 0.0° | 90.1° |
| S1 | C28 | C29 | H49 | 120.0° | 29.9° |
| S1 | C28 | C29 | H50 | 120.0° | 150.0° |
| N4 | C21 | C20 | H36 | 120.5° | 120.0° |
| N4 | C21 | C20 | H37 | 120.5° | 120.0° |
| N4 | C21 | C20 | C19 | 73.5° | 180.0° |
| N4 | C21 | C20 | H34 | 165.8° | 60.0° |
| N4 | C21 | C20 | H35 | 47.2° | 60.0° |
| N4 | C21 | H36 | H37 | 118.5° | 120.0° |
| N5 | C25 | C26 | C35 | 175.3° | 180.0° |
| N5 | C25 | C26 | C30 | 135.7° | 143.1° |
| N5 | C25 | C35 | C36 | 16.9° | 147.6° |
| N5 | C25 | C35 | C40 | 160.4° | 32.0° |
| C25 | N5 | C24 | H41 | 48.5° | 177.7° |
| C21 | C20 | C19 | H34 | 120.7° | 120.0° |
| C21 | C20 | C19 | H35 | 120.7° | 120.0° |
| C21 | C20 | C19 | C18 | 178.3° | 180.0° |
| C21 | C20 | C19 | H32 | 58.6° | 60.0° |
| C21 | C20 | C19 | H33 | 61.9° | 60.0° |
| C21 | C20 | H34 | H35 | 117.9° | 120.0° |
| C20 | C21 | H36 | H37 | 118.4° | 120.0° |
| C20 | C21 | N4 | H38 | 101.5° | 0.0° |
| C25 | C26 | C30 | C28 | 178.2° | 176.9° |
| C25 | C26 | C30 | C31 | 1.5° | 3.0° |
| C26 | C25 | C35 | C36 | 167.7° | 32.4° |
| C26 | C25 | C35 | C40 | 14.9° | 147.9° |
| C30 | C26 | C25 | C35 | 49.0° | 36.9° |
| C26 | C30 | C28 | C29 | 179.9° | 179.7° |
| C26 | C30 | C28 | C31 | 179.8° | 179.9° |
| C26 | C30 | C31 | H45 | 90.1° | 95.2° |
| C26 | C30 | C31 | H46 | 149.8° | 144.8° |
| C26 | C30 | C31 | H47 | 29.9° | 24.9° |
| C25 | C35 | C36 | C40 | 177.3° | 179.7° |
| C25 | C35 | C36 | C37 | 179.3° | 179.7° |
| C25 | C35 | C40 | C39 | 179.9° | 180.0° |
| C25 | C35 | C40 | H51 | 0.1° | 0.1° |
| C25 | C35 | C36 | H54 | 0.6° | 0.1° |
| C29 | C28 | C30 | C31 | 0.2° | 0.2° |
| C28 | C29 | H48 | H49 | 120.0° | 120.0° |
| C28 | C29 | H48 | H50 | 120.0° | 120.0° |
| C28 | C29 | H49 | H50 | 120.0° | 120.0° |
| C28 | C30 | C31 | H45 | 90.1° | 84.8° |
| C28 | C30 | C31 | H46 | 29.9° | 35.2° |
| C28 | C30 | C31 | H47 | 149.9° | 155.2° |
| C30 | C28 | C29 | H48 | 179.7° | 90.0° |
| C30 | C28 | C29 | H49 | 60.3° | 150.0° |
| C30 | C28 | C29 | H50 | 59.7° | 29.9° |
| C30 | C31 | H45 | H46 | 120.0° | 120.0° |
| C30 | C31 | H45 | H47 | 120.0° | 120.0° |
| C30 | C31 | H46 | H47 | 120.0° | 119.9° |
| C20 | C19 | C18 | H32 | 119.7° | 120.1° |
| C20 | C19 | C18 | H33 | 119.7° | 120.0° |
| C20 | C19 | C18 | C17 | 178.4° | 180.0° |
| C20 | C19 | C18 | H30 | 57.7° | 60.0° |
| C20 | C19 | C18 | H31 | 60.9° | 60.0° |
| C20 | C19 | H32 | H33 | 120.7° | 120.0° |
| C19 | C20 | H34 | H35 | 117.9° | 120.0° |
| C19 | C20 | C21 | H36 | 47.0° | 60.0° |
| C19 | C20 | C21 | H37 | 166.0° | 60.0° |
| C35 | C36 | C37 | H54 | 180.0° | 179.6° |
| C36 | C35 | C40 | C39 | 2.8° | 0.3° |
| C35 | C36 | C37 | C38 | 0.5° | 0.6° |
| C36 | C35 | C40 | H51 | 177.2° | 179.8° |
| C35 | C36 | C37 | H53 | 179.5° | 179.7° |
| C40 | C35 | C36 | C37 | 2.0° | 0.6° |
| C35 | C40 | C39 | H51 | 180.0° | 179.9° |
| C35 | C40 | C39 | C38 | 1.9° | 0.0° |
| C35 | C40 | C39 | H52 | 178.1° | 179.9° |
| C40 | C35 | C36 | H54 | 178.0° | 179.8° |
| C19 | C18 | C17 | H30 | 120.7° | 120.0° |
| C19 | C18 | C17 | H31 | 120.7° | 120.0° |
| C19 | C18 | C17 | C16 | 170.5° | 180.0° |
| C19 | C18 | C17 | H28 | 50.6° | 60.0° |
| C19 | C18 | C17 | H29 | 69.6° | 60.0° |
| C19 | C18 | H30 | H31 | 117.8° | 120.0° |
| C18 | C19 | H32 | H33 | 120.7° | 120.0° |
| C18 | C19 | C20 | H34 | 61.0° | 60.0° |
| C18 | C19 | C20 | H35 | 57.6° | 60.0° |
| C36 | C37 | C38 | H53 | 180.0° | 179.7° |
| C36 | C37 | C38 | C39 | 0.4° | 0.3° |
| C36 | C37 | C38 | CL | 179.8° | 179.7° |
| C40 | C39 | C38 | C37 | 0.3° | 0.0° |
| C40 | C39 | C38 | H52 | 180.0° | 180.0° |
| C40 | C39 | C38 | CL | 179.1° | 180.0° |
| CL1 | C45 | C44 | C46 | 179.6° | 179.7° |
| CL1 | C45 | C44 | C43 | 179.8° | 180.0° |
| CL1 | C45 | C46 | C47 | 179.8° | 179.9° |
| CL1 | C45 | C44 | H1 | 0.2° | 0.1° |
| CL1 | C45 | C46 | H3 | 0.2° | 0.0° |
| C37 | C38 | C39 | CL | 179.4° | 180.0° |
| C37 | C38 | C39 | H52 | 179.7° | 179.9° |
| C38 | C37 | C36 | H54 | 179.5° | 179.8° |
| C18 | C17 | C16 | H28 | 119.9° | 120.1° |
| C18 | C17 | C16 | H29 | 119.9° | 119.9° |
| C18 | C17 | C16 | C15 | 175.3° | 180.0° |
| C18 | C17 | C16 | H26 | 54.7° | 60.0° |
| C18 | C17 | C16 | H27 | 64.0° | 60.1° |
| C18 | C17 | H28 | H29 | 120.3° | 120.0° |
| C17 | C18 | H30 | H31 | 117.8° | 120.0° |
| C17 | C18 | C19 | H32 | 61.8° | 59.9° |
| C17 | C18 | C19 | H33 | 58.7° | 60.0° |
| C38 | C39 | C40 | H51 | 178.1° | 179.9° |
| C39 | C38 | C37 | H53 | 179.6° | 180.0° |
| CL | C38 | C39 | H52 | 0.9° | 0.0° |
| CL | C38 | C37 | H53 | 0.2° | 0.0° |
| C17 | C16 | C15 | H26 | 120.7° | 120.1° |
| C17 | C16 | C15 | H27 | 120.6° | 120.0° |
| C17 | C16 | C15 | C14 | 177.3° | 180.0° |
| C17 | C16 | C15 | H24 | 57.2° | 60.0° |
| C17 | C16 | C15 | H25 | 62.6° | 60.1° |
| C17 | C16 | H26 | H27 | 118.0° | 120.0° |
| C16 | C17 | H28 | H29 | 120.3° | 120.0° |
| C16 | C17 | C18 | H30 | 68.8° | 60.0° |
| C16 | C17 | C18 | H31 | 49.8° | 60.1° |
| C45 | C44 | C43 | H1 | 180.0° | 180.0° |
| C44 | C45 | C46 | C47 | 0.6° | 0.2° |
| C45 | C44 | C43 | C42 | 0.6° | 0.0° |
| C45 | C44 | C43 | H2 | 179.4° | 180.0° |
| C44 | C45 | C46 | H3 | 179.3° | 179.7° |
| C46 | C45 | C44 | C43 | 0.7° | 0.3° |
| C45 | C46 | C47 | H3 | 180.0° | 179.9° |
| C45 | C46 | C47 | C42 | 0.5° | 0.1° |
| C46 | C45 | C44 | H1 | 179.3° | 179.7° |
| C45 | C46 | C47 | H4 | 179.5° | 180.0° |
| C44 | C43 | C42 | H2 | 180.0° | 180.0° |
| C44 | C43 | C42 | C47 | 0.5° | 0.3° |
| C44 | C43 | C42 | C41 | 179.7° | 179.9° |
| C46 | C47 | C42 | C43 | 0.4° | 0.3° |
| C46 | C47 | C42 | H4 | 180.0° | 179.9° |
| C46 | C47 | C42 | C41 | 179.8° | 179.9° |
| C16 | C15 | C14 | H24 | 120.1° | 120.0° |
| C16 | C15 | C14 | H25 | 120.1° | 120.0° |
| C16 | C15 | C14 | C13 | 173.0° | 180.0° |
| C16 | C15 | C14 | H22 | 52.7° | 60.0° |
| C16 | C15 | C14 | H23 | 66.6° | 60.0° |
| C16 | C15 | H24 | H25 | 119.7° | 120.0° |
| C15 | C16 | H26 | H27 | 118.0° | 119.9° |
| C15 | C16 | C17 | H28 | 64.8° | 59.9° |
| C15 | C16 | C17 | H29 | 55.4° | 60.1° |
| C15 | C14 | C13 | H22 | 120.3° | 120.0° |
| C15 | C14 | C13 | H23 | 120.3° | 120.0° |
| C15 | C14 | C13 | C12 | 174.9° | 180.0° |
| C15 | C14 | C13 | H20 | 54.5° | 60.0° |
| C15 | C14 | C13 | H21 | 64.8° | 60.0° |
| C15 | C14 | H22 | H23 | 119.1° | 120.0° |
| C14 | C15 | H24 | H25 | 119.7° | 120.0° |
| C14 | C15 | C16 | H26 | 62.0° | 59.9° |
| C14 | C15 | C16 | H27 | 56.7° | 60.0° |
| C43 | C42 | C47 | C41 | 179.8° | 179.8° |
| C43 | C42 | C41 | C4 | 27.8° | 38.3° |
| C43 | C42 | C41 | N9 | 148.3° | 141.3° |
| C42 | C43 | C44 | H1 | 179.4° | 180.0° |
| C43 | C42 | C47 | H4 | 179.6° | 179.8° |
| C47 | C42 | C41 | C4 | 152.0° | 141.9° |
| C47 | C42 | C41 | N9 | 31.9° | 38.4° |
| C47 | C42 | C43 | H2 | 179.6° | 179.7° |
| C42 | C47 | C46 | H3 | 179.5° | 180.0° |
| C3 | C2 | C1 | C4 | 179.4° | 180.0° |
| C3 | C2 | C1 | C | 0.9° | 0.1° |
| C3 | C2 | C4 | C41 | 2.0° | 1.7° |
| C3 | C2 | C1 | S | 179.6° | 179.8° |
| C3 | C2 | C4 | C5 | 179.8° | 178.7° |
| C2 | C3 | H5 | H6 | 120.0° | 120.0° |
| C2 | C3 | H5 | H7 | 120.0° | 120.0° |
| C2 | C3 | H6 | H7 | 120.0° | 120.0° |
| C42 | C41 | C4 | C2 | 45.1° | 37.4° |
| C42 | C41 | C4 | N9 | 176.0° | 179.6° |
| C42 | C41 | C4 | C5 | 132.5° | 142.2° |
| C42 | C41 | N9 | C9 | 179.5° | 175.4° |
| C41 | C42 | C43 | H2 | 0.2° | 0.1° |
| C41 | C42 | C47 | H4 | 0.2° | 0.0° |
| C14 | C13 | C12 | H20 | 120.4° | 120.0° |
| C14 | C13 | C12 | H21 | 120.3° | 120.0° |
| C14 | C13 | C12 | N3 | 62.2° | 180.0° |
| C14 | C13 | C12 | H18 | 58.2° | 60.0° |
| C14 | C13 | C12 | H19 | 177.3° | 60.0° |
| C14 | C13 | H20 | H21 | 119.0° | 120.0° |
| C13 | C14 | H22 | H23 | 119.1° | 120.0° |
| C13 | C14 | C15 | H24 | 66.9° | 60.0° |
| C13 | C14 | C15 | H25 | 52.9° | 60.0° |
| C2 | C1 | C | S | 179.5° | 179.9° |
| C1 | C2 | C4 | C41 | 178.7° | 178.2° |
| C1 | C2 | C4 | C5 | 0.9° | 1.4° |
| C2 | C1 | S | C5 | 0.3° | 0.7° |
| C1 | C2 | C3 | H5 | 90.3° | 95.4° |
| C1 | C2 | C3 | H6 | 149.7° | 144.6° |
| C1 | C2 | C3 | H7 | 29.7° | 24.6° |
| C2 | C1 | C | H12 | 179.5° | 90.1° |
| C2 | C1 | C | H13 | 59.5° | 150.0° |
| C2 | C1 | C | H14 | 60.5° | 30.0° |
| C4 | C2 | C1 | C | 179.8° | 179.8° |
| C2 | C4 | C41 | C5 | 177.6° | 179.6° |
| C2 | C4 | C41 | N9 | 139.0° | 143.0° |
| C4 | C2 | C1 | S | 0.2° | 0.3° |
| C2 | C4 | C5 | S | 1.1° | 1.8° |
| C2 | C4 | C5 | N | 177.9° | 176.4° |
| C4 | C2 | C3 | H5 | 90.4° | 84.6° |
| C4 | C2 | C3 | H6 | 29.6° | 35.4° |
| C4 | C2 | C3 | H7 | 149.6° | 155.4° |
| C | C1 | S | C5 | 179.3° | 179.2° |
| C1 | C | H12 | H13 | 120.0° | 120.0° |
| C1 | C | H12 | H14 | 120.0° | 120.0° |
| C1 | C | H13 | H14 | 120.0° | 120.0° |
| C4 | C41 | N9 | C9 | 3.6° | 5.0° |
| C41 | C4 | C5 | S | 178.9° | 177.8° |
| C41 | C4 | C5 | N | 4.2° | 4.0° |
| N9 | C41 | C4 | C5 | 43.4° | 37.4° |
| C41 | N9 | C9 | C10 | 168.4° | 57.5° |
| C41 | N9 | C9 | C8 | 70.6° | 62.4° |
| C41 | N9 | C9 | H8 | 49.4° | 177.6° |
| C13 | C12 | N3 | H18 | 120.4° | 120.0° |
| C13 | C12 | N3 | H19 | 120.4° | 120.0° |
| C13 | C12 | N3 | C11 | 120.1° | 180.0° |
| C13 | C12 | N3 | H17 | 59.9° | 0.0° |
| C13 | C12 | H18 | H19 | 118.6° | 120.0° |
| C12 | C13 | H20 | H21 | 119.0° | 120.0° |
| C12 | C13 | C14 | H22 | 64.8° | 60.0° |
| C12 | C13 | C14 | H23 | 54.5° | 60.0° |
| C1 | S | C5 | C4 | 0.8° | 1.5° |
| C1 | S | C5 | N | 177.6° | 176.8° |
| S | C1 | C | H12 | 0.0° | 90.1° |
| S | C1 | C | H13 | 120.0° | 29.9° |
| S | C1 | C | H14 | 120.0° | 149.9° |
| C4 | C5 | S | N | 176.7° | 178.2° |
| C4 | C5 | N | C8 | 37.4° | 33.4° |
| C4 | C5 | N | C6 | 144.3° | 146.9° |
| N9 | C9 | C10 | C11 | 64.8° | 65.0° |
| N9 | C9 | C10 | C8 | 117.5° | 119.6° |
| N9 | C9 | C10 | H8 | 119.7° | 120.2° |
| N9 | C9 | C8 | H8 | 120.2° | 119.9° |
| N9 | C9 | C8 | N | 70.2° | 59.6° |
| N9 | C9 | C8 | N2 | 108.9° | 120.3° |
| N9 | C9 | C10 | H15 | 175.3° | 55.0° |
| N9 | C9 | C10 | H16 | 55.1° | 175.0° |
| C12 | N3 | C11 | O | 4.4° | 0.1° |
| C12 | N3 | C11 | H17 | 180.0° | 180.0° |
| C12 | N3 | C11 | C10 | 175.9° | 180.0° |
| N3 | C12 | H18 | H19 | 118.6° | 120.0° |
| N3 | C12 | C13 | H20 | 177.4° | 60.0° |
| N3 | C12 | C13 | H21 | 58.1° | 60.0° |
| O | C11 | N3 | C10 | 179.8° | 179.9° |
| O | C11 | C10 | C9 | 29.3° | 0.0° |
| O | C11 | C10 | H15 | 90.6° | 120.0° |
| O | C11 | C10 | H16 | 149.1° | 120.1° |
| O | C11 | N3 | H17 | 175.7° | 180.0° |
| S | C5 | N | C8 | 138.9° | 144.7° |
| S | C5 | N | C6 | 39.4° | 35.1° |
| C5 | N | C8 | C9 | 1.0° | 0.9° |
| C5 | N | C8 | C6 | 178.5° | 179.8° |
| C5 | N | C8 | N2 | 179.8° | 179.2° |
| C5 | N | C6 | C7 | 1.9° | 0.8° |
| C5 | N | C6 | N1 | 179.5° | 179.3° |
| N3 | C11 | C10 | C9 | 150.5° | 180.0° |
| N3 | C11 | C10 | H15 | 89.6° | 60.0° |
| N3 | C11 | C10 | H16 | 30.7° | 60.0° |
| C11 | N3 | C12 | H18 | 0.3° | 60.0° |
| C11 | N3 | C12 | H19 | 119.5° | 60.0° |
| C11 | C10 | C9 | H15 | 119.9° | 120.0° |
| C11 | C10 | C9 | H16 | 119.9° | 120.0° |
| C11 | C10 | C9 | C8 | 177.7° | 175.4° |
| C11 | C10 | C9 | H8 | 54.9° | 55.1° |
| C11 | C10 | H15 | H16 | 120.4° | 119.9° |
| C10 | C11 | N3 | H17 | 4.1° | 0.0° |
| C10 | C9 | C8 | H8 | 122.5° | 120.2° |
| C10 | C9 | C8 | N | 172.5° | 60.3° |
| C10 | C9 | C8 | N2 | 8.4° | 119.8° |
| C9 | C10 | H15 | H16 | 120.4° | 120.1° |
| C9 | C8 | N | N2 | 179.2° | 179.9° |
| C9 | C8 | N | C6 | 179.5° | 179.3° |
| C9 | C8 | N2 | N1 | 180.0° | 179.4° |
| C8 | C9 | C10 | H15 | 57.8° | 64.7° |
| C8 | C9 | C10 | H16 | 62.4° | 55.4° |
| C8 | N | C6 | C7 | 179.8° | 179.4° |
| C8 | N | C6 | N1 | 1.1° | 0.5° |
| N | C8 | N2 | N1 | 0.9° | 0.5° |
| N | C8 | C9 | H8 | 50.0° | 179.5° |
| C6 | N | C8 | N2 | 1.2° | 0.6° |
| N | C6 | C7 | N1 | 178.5° | 180.0° |
| N | C6 | N1 | N2 | 0.5° | 0.2° |
| N | C6 | C7 | H9 | 178.5° | 90.0° |
| N | C6 | C7 | H10 | 58.5° | 29.9° |
| N | C6 | C7 | H11 | 61.5° | 149.9° |
| C8 | N2 | N1 | C6 | 0.2° | 0.2° |
| N2 | C8 | C9 | H8 | 130.9° | 0.4° |
| C7 | C6 | N1 | N2 | 179.3° | 179.7° |
| C6 | C7 | H9 | H10 | 120.0° | 119.9° |
| C6 | C7 | H9 | H11 | 120.0° | 120.1° |
| C6 | C7 | H10 | H11 | 120.0° | 120.0° |
| N1 | C6 | C7 | H9 | 0.0° | 90.0° |
| N1 | C6 | C7 | H10 | 120.0° | 150.0° |
| N1 | C6 | C7 | H11 | 120.0° | 30.0° |
| H1 | C44 | C43 | H2 | 0.5° | 0.0° |
| H3 | C46 | C47 | H4 | 0.5° | 0.1° |
| H5 | C3 | H6 | H7 | 120.0° | 120.1° |
| H8 | C9 | C10 | H15 | 65.0° | 175.1° |
| H8 | C9 | C10 | H16 | 174.7° | 64.8° |
| H9 | C7 | H10 | H11 | 120.0° | 120.0° |
| H12 | C | H13 | H14 | 120.0° | 120.0° |
| H17 | N3 | C12 | H18 | 179.6° | 120.0° |
| H17 | N3 | C12 | H19 | 60.5° | 120.0° |
| H18 | C12 | C13 | H20 | 62.1° | NaN° |
| H18 | C12 | C13 | H21 | 178.6° | 60.1° |
| H19 | C12 | C13 | H20 | 57.0° | 60.0° |
| H19 | C12 | C13 | H21 | 62.4° | 180.0° |
| H20 | C13 | C14 | H22 | 174.8° | 180.0° |
| H20 | C13 | C14 | H23 | 65.8° | 59.9° |
| H21 | C13 | C14 | H22 | 55.5° | 60.0° |
| H21 | C13 | C14 | H23 | 174.9° | 179.9° |
| H22 | C14 | C15 | H24 | 172.8° | 180.0° |
| H22 | C14 | C15 | H25 | 67.4° | 60.0° |
| H23 | C14 | C15 | H24 | 53.4° | 59.9° |
| H23 | C14 | C15 | H25 | 173.2° | 180.0° |
| H24 | C15 | C16 | H26 | 177.9° | 179.9° |
| H24 | C15 | C16 | H27 | 63.4° | 60.0° |
| H25 | C15 | C16 | H26 | 58.1° | 60.0° |
| H25 | C15 | C16 | H27 | 176.8° | 180.0° |
| H26 | C16 | C17 | H28 | 174.6° | 180.0° |
| H26 | C16 | C17 | H29 | 65.2° | 60.0° |
| H27 | C16 | C17 | H28 | 55.9° | 60.0° |
| H27 | C16 | C17 | H29 | 176.0° | 180.0° |
| H28 | C17 | C18 | H30 | 171.3° | 180.0° |
| H28 | C17 | C18 | H31 | 70.1° | 60.0° |
| H29 | C17 | C18 | H30 | 51.1° | 59.9° |
| H29 | C17 | C18 | H31 | 169.7° | 180.0° |
| H30 | C18 | C19 | H32 | 177.5° | 179.9° |
| H30 | C18 | C19 | H33 | 62.0° | 60.0° |
| H31 | C18 | C19 | H32 | 58.9° | 60.0° |
| H31 | C18 | C19 | H33 | 179.4° | 180.0° |
| H32 | C19 | C20 | H34 | 179.3° | 180.0° |
| H32 | C19 | C20 | H35 | 62.1° | 60.1° |
| H33 | C19 | C20 | H34 | 58.7° | 60.1° |
| H33 | C19 | C20 | H35 | 177.4° | NaN° |
| H34 | C20 | C21 | H36 | 73.7° | 180.0° |
| H34 | C20 | C21 | H37 | 45.3° | 60.0° |
| H35 | C20 | C21 | H36 | 167.7° | 60.0° |
| H35 | C20 | C21 | H37 | 73.3° | 180.0° |
| H36 | C21 | N4 | H38 | 19.0° | 120.0° |
| H37 | C21 | N4 | H38 | 138.0° | 120.0° |
| H39 | C23 | C24 | H41 | 168.5° | 64.9° |
| H40 | C23 | C24 | H41 | 70.7° | 175.2° |
| H42 | C33 | H43 | H44 | 120.0° | 120.0° |
| H45 | C31 | H46 | H47 | 120.0° | 120.1° |
| H48 | C29 | H49 | H50 | 120.0° | 120.0° |
| H51 | C40 | C39 | H52 | 1.9° | 0.0° |
| H53 | C37 | C36 | H54 | 0.5° | 0.1° |
