PRD_000227
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | doub | 1.33Å | 1.39Å | Aromatic |
| N1 | C6 | sing | 1.31Å | 1.34Å | Aromatic |
| C1 | C2 | sing | 1.48Å | 1.52Å | |
| C1 | C3 | sing | 1.40Å | 1.44Å | Aromatic |
| C2 | O1 | doub | 1.22Å | 1.24Å | |
| C3 | O2 | sing | 1.36Å | 1.34Å | |
| C3 | C4 | doub | 1.39Å | 1.42Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | C6 | doub | 1.39Å | 1.41Å | Aromatic |
| C6 | H1 | sing | 1.08Å | 1.08Å | |
| O2 | H2 | sing | 0.97Å | 0.95Å | |
| C4 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| N2 | C7 | sing | 1.46Å | 1.43Å | |
| N2 | H5 | sing | 0.97Å | 1.00Å | |
| C7 | C8 | sing | 1.51Å | 1.57Å | |
| C7 | C9 | sing | 1.53Å | 1.53Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | O3 | doub | 1.21Å | 1.21Å | |
| C9 | O4 | sing | 1.45Å | 1.46Å | |
| C9 | C10 | sing | 1.53Å | 1.55Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| N3 | C11 | sing | 1.48Å | 1.48Å | |
| C11 | C12 | sing | 1.51Å | 1.56Å | |
| C11 | C13 | sing | 1.53Å | 1.52Å | |
| C12 | O5 | doub | 1.21Å | 1.25Å | |
| C13 | C14 | sing | 1.53Å | 1.50Å | |
| N3 | H11 | sing | 0.97Å | 1.00Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| N4 | C15 | sing | 1.46Å | 1.49Å | |
| N4 | C19 | sing | 1.46Å | 1.47Å | |
| C15 | C16 | sing | 1.51Å | 1.56Å | |
| C15 | C17 | sing | 1.53Å | 1.52Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | O6 | doub | 1.21Å | 1.26Å | |
| C17 | C18 | sing | 1.54Å | 1.50Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | N5 | sing | 1.46Å | 1.50Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| N5 | C21 | sing | 1.48Å | 1.51Å | |
| C21 | C22 | sing | 1.51Å | 1.53Å | |
| C21 | C23 | sing | 1.53Å | 1.58Å | |
| C21 | H28 | sing | 1.09Å | 1.10Å | |
| C22 | O7 | doub | 1.21Å | 1.25Å | |
| C23 | C24 | sing | 1.51Å | 1.52Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C23 | H30 | sing | 1.09Å | 1.10Å | |
| C24 | C25 | doub | 1.38Å | 1.43Å | Aromatic |
| C24 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C25 | H31 | sing | 1.08Å | 1.08Å | |
| C26 | C27 | doub | 1.38Å | 1.41Å | Aromatic |
| C26 | H32 | sing | 1.08Å | 1.08Å | |
| C27 | C28 | sing | 1.38Å | 1.43Å | Aromatic |
| C27 | H33 | sing | 1.08Å | 1.08Å | |
| C28 | C29 | doub | 1.38Å | 1.44Å | Aromatic |
| C28 | H34 | sing | 1.08Å | 1.08Å | |
| C29 | H35 | sing | 1.08Å | 1.08Å | |
| N6 | C30 | sing | 1.46Å | 1.53Å | |
| N6 | C35 | sing | 1.46Å | 1.48Å | |
| C30 | C31 | sing | 1.51Å | 1.57Å | |
| C30 | C32 | sing | 1.52Å | 1.54Å | |
| C31 | O8 | doub | 1.21Å | 1.23Å | |
| C32 | C33 | sing | 1.50Å | 1.54Å | |
| C33 | O9 | doub | 1.21Å | 1.22Å | |
| C33 | C34 | sing | 1.51Å | 1.50Å | |
| C34 | C35 | sing | 1.53Å | 1.54Å | |
| C30 | H36 | sing | 1.10Å | 1.10Å | |
| C35 | H37 | sing | 1.09Å | 1.10Å | |
| C35 | H38 | sing | 1.09Å | 1.10Å | |
| C32 | H39 | sing | 1.09Å | 1.10Å | |
| C32 | H40 | sing | 1.09Å | 1.10Å | |
| C34 | H41 | sing | 1.09Å | 1.10Å | |
| C34 | H42 | sing | 1.09Å | 1.10Å | |
| C36 | O10 | doub | 1.21Å | 1.22Å | |
| N7 | H43 | sing | 0.97Å | 1.00Å | |
| C37 | C36 | sing | 1.51Å | 1.52Å | |
| C37 | N7 | sing | 1.49Å | 1.46Å | |
| C37 | C38 | sing | 1.51Å | 1.57Å | |
| C37 | H44 | sing | 1.09Å | 1.10Å | |
| C38 | C42 | sing | 1.38Å | 1.40Å | Aromatic |
| C39 | C40 | sing | 1.38Å | 1.39Å | Aromatic |
| C39 | H45 | sing | 1.08Å | 1.08Å | |
| C40 | H46 | sing | 1.08Å | 1.08Å | |
| C41 | C39 | doub | 1.38Å | 1.36Å | Aromatic |
| C41 | H47 | sing | 1.08Å | 1.08Å | |
| C42 | C40 | doub | 1.38Å | 1.40Å | Aromatic |
| C42 | H48 | sing | 1.08Å | 1.08Å | |
| C43 | C38 | doub | 1.38Å | 1.38Å | Aromatic |
| C43 | C41 | sing | 1.38Å | 1.43Å | Aromatic |
| C43 | H49 | sing | 1.08Å | 1.08Å | |
| C2 | N2 | sing | 1.35Å | 1.33Å | |
| C8 | N3 | sing | 1.37Å | 1.35Å | |
| O4 | C36 | sing | 1.34Å | 1.33Å | |
| C12 | N4 | sing | 1.35Å | 1.39Å | |
| C16 | N5 | sing | 1.37Å | 1.37Å | |
| C22 | N6 | sing | 1.35Å | 1.39Å | |
| C31 | N7 | sing | 1.37Å | 1.34Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N1 | C6 | 118.6° | 121.7° |
| N1 | C1 | C2 | 116.8° | 119.8° |
| N1 | C1 | C3 | 121.4° | 120.5° |
| N1 | C6 | C5 | 123.1° | 121.0° |
| N1 | C6 | H1 | 118.4° | 119.5° |
| C2 | C1 | C3 | 121.8° | 119.7° |
| C1 | C2 | O1 | 121.6° | 120.0° |
| C1 | C2 | N2 | 117.1° | 120.0° |
| C1 | C3 | O2 | 123.7° | 120.6° |
| C1 | C3 | C4 | 117.5° | 118.9° |
| O1 | C2 | N2 | 121.3° | 120.0° |
| O2 | C3 | C4 | 118.8° | 120.5° |
| C3 | O2 | H2 | 109.5° | 113.9° |
| C3 | C4 | C5 | 119.8° | 118.4° |
| C3 | C4 | H3 | 120.1° | 120.8° |
| C4 | C5 | C6 | 119.6° | 119.5° |
| C5 | C4 | H3 | 120.1° | 120.8° |
| C4 | C5 | H4 | 120.2° | 120.2° |
| C5 | C6 | H1 | 118.4° | 119.5° |
| C6 | C5 | H4 | 120.2° | 120.3° |
| C7 | N2 | H5 | 116.2° | 120.0° |
| N2 | C7 | C8 | 112.9° | 109.4° |
| N2 | C7 | C9 | 107.5° | 109.4° |
| N2 | C7 | H6 | 109.6° | 109.5° |
| C7 | N2 | C2 | 127.7° | 120.0° |
| H5 | N2 | C2 | 116.2° | 120.0° |
| C8 | C7 | C9 | 110.7° | 109.7° |
| C8 | C7 | H6 | 107.8° | 109.4° |
| C7 | C8 | O3 | 119.6° | 120.5° |
| C7 | C8 | N3 | 117.0° | 119.0° |
| C9 | C7 | H6 | 108.3° | 109.4° |
| C7 | C9 | O4 | 106.1° | 109.8° |
| C7 | C9 | C10 | 112.2° | 109.4° |
| C7 | C9 | H7 | 108.1° | 109.4° |
| O3 | C8 | N3 | 123.4° | 120.5° |
| O4 | C9 | C10 | 113.3° | 109.4° |
| O4 | C9 | H7 | 109.0° | 109.4° |
| C9 | O4 | C36 | 116.6° | 116.9° |
| C10 | C9 | H7 | 107.9° | 109.4° |
| C9 | C10 | H8 | 109.5° | 109.5° |
| C9 | C10 | H9 | 109.5° | 109.5° |
| C9 | C10 | H10 | 109.5° | 109.5° |
| H8 | C10 | H9 | 109.5° | 109.4° |
| H8 | C10 | H10 | 109.5° | 109.5° |
| H9 | C10 | H10 | 109.5° | 109.4° |
| N3 | C11 | C12 | 107.5° | 108.9° |
| N3 | C11 | C13 | 110.5° | 109.6° |
| C11 | N3 | H11 | 118.8° | 122.5° |
| N3 | C11 | H12 | 109.3° | 109.6° |
| C11 | N3 | C8 | 122.4° | 114.9° |
| C12 | C11 | C13 | 112.4° | 109.6° |
| C11 | C12 | O5 | 118.8° | 120.2° |
| C12 | C11 | H12 | 108.3° | 109.6° |
| C11 | C12 | N4 | 119.0° | 119.6° |
| C11 | C13 | C14 | 113.2° | 109.4° |
| C13 | C11 | H12 | 108.7° | 109.6° |
| C11 | C13 | H13 | 108.5° | 109.5° |
| C11 | C13 | H14 | 108.6° | 109.5° |
| O5 | C12 | N4 | 122.2° | 120.2° |
| C14 | C13 | H13 | 108.5° | 109.5° |
| C14 | C13 | H14 | 108.5° | 109.5° |
| C13 | C14 | H15 | 109.5° | 109.5° |
| C13 | C14 | H16 | 109.5° | 109.5° |
| C13 | C14 | H17 | 109.5° | 109.4° |
| H11 | N3 | C8 | 118.8° | 122.6° |
| H13 | C13 | H14 | 109.5° | 109.4° |
| H15 | C14 | H16 | 109.5° | 109.5° |
| H15 | C14 | H17 | 109.5° | 109.5° |
| H16 | C14 | H17 | 109.5° | 109.5° |
| C15 | N4 | C19 | 109.1° | 109.5° |
| N4 | C15 | C16 | 110.2° | 110.6° |
| N4 | C15 | C17 | 104.8° | 108.1° |
| N4 | C15 | H18 | 111.3° | 109.6° |
| C15 | N4 | C12 | 122.8° | 125.7° |
| N4 | C19 | C18 | 104.2° | 108.8° |
| N4 | C19 | H23 | 110.8° | 109.7° |
| N4 | C19 | H24 | 110.8° | 109.6° |
| C19 | N4 | C12 | 128.1° | 124.8° |
| C16 | C15 | C17 | 109.6° | 109.7° |
| C16 | C15 | H18 | 110.2° | 109.3° |
| C15 | C16 | O6 | 117.8° | 120.9° |
| C15 | C16 | N5 | 120.7° | 118.2° |
| C17 | C15 | H18 | 110.7° | 109.5° |
| C15 | C17 | C18 | 105.6° | 105.7° |
| C15 | C17 | H19 | 110.4° | 110.3° |
| C15 | C17 | H20 | 110.5° | 110.2° |
| O6 | C16 | N5 | 121.5° | 120.9° |
| C18 | C17 | H19 | 110.4° | 110.2° |
| C18 | C17 | H20 | 110.4° | 110.2° |
| C17 | C18 | C19 | 102.1° | 105.6° |
| C17 | C18 | H21 | 111.3° | 110.2° |
| C17 | C18 | H22 | 111.3° | 110.3° |
| H19 | C17 | H20 | 109.5° | 110.2° |
| C19 | C18 | H21 | 111.3° | 110.2° |
| C19 | C18 | H22 | 111.3° | 110.2° |
| C18 | C19 | H23 | 110.8° | 109.6° |
| C18 | C19 | H24 | 110.8° | 109.6° |
| H21 | C18 | H22 | 109.5° | 110.3° |
| H23 | C19 | H24 | 109.5° | 109.5° |
| N5 | C20 | H25 | 109.5° | 109.5° |
| N5 | C20 | H26 | 109.5° | 109.5° |
| N5 | C20 | H27 | 109.5° | 109.4° |
| C20 | N5 | C21 | 120.0° | 122.5° |
| C20 | N5 | C16 | 124.3° | 122.5° |
| H25 | C20 | H26 | 109.4° | 109.5° |
| H25 | C20 | H27 | 109.5° | 109.5° |
| H26 | C20 | H27 | 109.5° | 109.5° |
| N5 | C21 | C22 | 109.2° | 108.6° |
| N5 | C21 | C23 | 114.5° | 109.6° |
| N5 | C21 | H28 | 108.7° | 109.6° |
| C21 | N5 | C16 | 115.7° | 115.1° |
| C22 | C21 | C23 | 108.1° | 109.6° |
| C22 | C21 | H28 | 108.4° | 109.6° |
| C21 | C22 | O7 | 116.9° | 119.5° |
| C21 | C22 | N6 | 121.6° | 120.9° |
| C23 | C21 | H28 | 107.8° | 109.7° |
| C21 | C23 | C24 | 114.3° | 109.5° |
| C21 | C23 | H29 | 108.2° | 109.5° |
| C21 | C23 | H30 | 108.3° | 109.5° |
| O7 | C22 | N6 | 121.5° | 119.6° |
| C24 | C23 | H29 | 108.2° | 109.5° |
| C24 | C23 | H30 | 108.2° | 109.5° |
| C23 | C24 | C25 | 122.7° | 120.0° |
| C23 | C24 | C29 | 120.6° | 120.0° |
| H29 | C23 | H30 | 109.5° | 109.4° |
| C25 | C24 | C29 | 116.7° | 120.0° |
| C24 | C25 | C26 | 123.0° | 120.0° |
| C24 | C25 | H31 | 118.5° | 120.0° |
| C24 | C29 | C28 | 121.8° | 120.0° |
| C24 | C29 | H35 | 119.1° | 120.0° |
| C26 | C25 | H31 | 118.5° | 120.0° |
| C25 | C26 | C27 | 120.1° | 120.0° |
| C25 | C26 | H32 | 120.0° | 120.0° |
| C27 | C26 | H32 | 119.9° | 120.0° |
| C26 | C27 | C28 | 118.1° | 120.0° |
| C26 | C27 | H33 | 120.9° | 120.0° |
| C28 | C27 | H33 | 121.0° | 120.0° |
| C27 | C28 | C29 | 120.3° | 120.0° |
| C27 | C28 | H34 | 119.8° | 120.0° |
| C29 | C28 | H34 | 119.9° | 120.0° |
| C28 | C29 | H35 | 119.1° | 120.0° |
| C30 | N6 | C35 | 112.8° | 120.3° |
| N6 | C30 | C31 | 110.4° | 109.4° |
| N6 | C30 | C32 | 107.1° | 110.2° |
| N6 | C30 | H36 | 109.7° | 108.8° |
| C30 | N6 | C22 | 129.2° | 119.6° |
| N6 | C35 | C34 | 106.6° | 109.7° |
| N6 | C35 | H37 | 110.2° | 109.5° |
| N6 | C35 | H38 | 110.2° | 109.5° |
| C35 | N6 | C22 | 118.0° | 120.1° |
| C31 | C30 | C32 | 111.0° | 110.6° |
| C30 | C31 | O8 | 121.7° | 121.2° |
| C31 | C30 | H36 | 109.1° | 108.6° |
| C30 | C31 | N7 | 116.7° | 117.6° |
| C30 | C32 | C33 | 112.0° | 111.2° |
| C32 | C30 | H36 | 109.5° | 109.2° |
| C30 | C32 | H39 | 108.8° | 109.2° |
| C30 | C32 | H40 | 108.8° | 109.2° |
| O8 | C31 | N7 | 121.6° | 121.2° |
| C32 | C33 | O9 | 120.2° | 120.2° |
| C32 | C33 | C34 | 118.6° | 119.6° |
| C33 | C32 | H39 | 108.8° | 109.1° |
| C33 | C32 | H40 | 108.8° | 109.1° |
| O9 | C33 | C34 | 121.2° | 120.2° |
| C33 | C34 | C35 | 114.8° | 108.7° |
| C33 | C34 | H41 | 108.1° | 109.6° |
| C33 | C34 | H42 | 108.1° | 109.6° |
| C34 | C35 | H37 | 110.2° | 109.4° |
| C34 | C35 | H38 | 110.2° | 109.4° |
| C35 | C34 | H41 | 108.1° | 109.6° |
| C35 | C34 | H42 | 108.1° | 109.6° |
| H37 | C35 | H38 | 109.4° | 109.4° |
| H39 | C32 | H40 | 109.5° | 109.1° |
| H41 | C34 | H42 | 109.5° | 109.7° |
| O10 | C36 | C37 | 120.2° | 119.8° |
| O10 | C36 | O4 | 123.5° | 119.8° |
| H43 | N7 | C37 | 118.2° | 122.8° |
| H43 | N7 | C31 | 118.2° | 122.8° |
| C36 | C37 | N7 | 121.2° | 108.0° |
| C36 | C37 | C38 | 112.1° | 109.8° |
| C36 | C37 | H44 | 105.1° | 109.7° |
| C37 | C36 | O4 | 116.3° | 120.4° |
| N7 | C37 | C38 | 106.8° | 109.8° |
| N7 | C37 | H44 | 105.8° | 109.8° |
| C37 | N7 | C31 | 123.6° | 114.4° |
| C38 | C37 | H44 | 104.6° | 109.8° |
| C37 | C38 | C42 | 118.3° | 120.0° |
| C37 | C38 | C43 | 125.3° | 120.0° |
| C38 | C42 | C40 | 122.7° | 120.0° |
| C38 | C42 | H48 | 118.6° | 120.0° |
| C42 | C38 | C43 | 116.3° | 120.0° |
| C40 | C39 | H45 | 120.8° | 120.0° |
| C39 | C40 | H46 | 119.9° | 120.0° |
| C40 | C39 | C41 | 118.3° | 120.0° |
| C39 | C40 | C42 | 120.2° | 120.0° |
| H45 | C39 | C41 | 120.8° | 120.0° |
| H46 | C40 | C42 | 119.9° | 120.0° |
| C39 | C41 | H47 | 119.3° | 120.0° |
| C39 | C41 | C43 | 121.3° | 120.1° |
| H47 | C41 | C43 | 119.3° | 119.9° |
| C40 | C42 | H48 | 118.6° | 120.0° |
| C38 | C43 | C41 | 121.1° | 120.0° |
| C38 | C43 | H49 | 119.5° | 120.0° |
| C41 | C43 | H49 | 119.5° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C1 | C2 | C3 | 179.6° | 179.9° |
| N1 | C1 | C2 | O1 | 179.6° | 180.0° |
| N1 | C1 | C3 | O2 | 179.9° | 180.0° |
| N1 | C1 | C3 | C4 | 0.3° | 0.1° |
| C1 | N1 | C6 | C5 | 0.1° | 0.0° |
| C1 | N1 | C6 | H1 | 179.9° | 180.0° |
| N1 | C1 | C2 | N2 | 0.1° | 0.0° |
| C6 | N1 | C1 | C2 | 179.9° | 180.0° |
| C6 | N1 | C1 | C3 | 0.3° | 0.1° |
| N1 | C6 | C5 | C4 | 0.0° | 0.0° |
| N1 | C6 | C5 | H1 | 180.0° | 180.0° |
| N1 | C6 | C5 | H4 | 180.0° | 180.0° |
| C1 | C2 | O1 | N2 | 179.5° | 180.0° |
| C2 | C1 | C3 | O2 | 0.3° | 0.0° |
| C2 | C1 | C3 | C4 | 179.9° | 180.0° |
| C1 | C2 | N2 | C7 | 178.3° | 180.0° |
| C1 | C2 | N2 | H5 | 1.7° | 0.1° |
| C3 | C1 | C2 | O1 | 0.1° | 0.0° |
| C1 | C3 | O2 | C4 | 179.8° | 180.0° |
| C1 | C3 | C4 | C5 | 0.1° | 0.0° |
| C1 | C3 | O2 | H2 | 0.2° | 90.0° |
| C1 | C3 | C4 | H3 | 179.9° | 179.9° |
| C3 | C1 | C2 | N2 | 179.4° | 180.0° |
| O1 | C2 | N2 | C7 | 1.2° | 0.0° |
| O1 | C2 | N2 | H5 | 178.8° | 179.9° |
| O2 | C3 | C4 | C5 | 180.0° | 180.0° |
| O2 | C3 | C4 | H3 | 0.0° | 0.0° |
| C3 | C4 | C5 | H3 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.0° | 0.0° |
| C4 | C3 | O2 | H2 | 180.0° | 90.0° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C4 | C5 | C6 | H4 | 180.0° | 180.0° |
| C4 | C5 | C6 | H1 | 180.0° | 180.0° |
| C6 | C5 | C4 | H3 | 180.0° | 180.0° |
| H1 | C6 | C5 | H4 | 0.0° | 0.0° |
| H3 | C4 | C5 | H4 | 0.0° | 0.1° |
| C7 | N2 | H5 | C2 | 180.0° | 179.9° |
| N2 | C7 | C8 | C9 | 120.6° | 120.1° |
| N2 | C7 | C8 | H6 | 121.2° | 119.9° |
| N2 | C7 | C9 | H6 | 118.3° | 119.9° |
| N2 | C7 | C8 | O3 | 163.2° | 154.9° |
| N2 | C7 | C9 | O4 | 70.1° | 175.4° |
| N2 | C7 | C9 | C10 | 54.1° | 64.4° |
| N2 | C7 | C9 | H7 | 173.1° | 55.3° |
| N2 | C7 | C8 | N3 | 16.6° | 25.1° |
| H5 | N2 | C7 | C8 | 61.7° | 94.9° |
| H5 | N2 | C7 | C9 | 60.6° | 25.3° |
| H5 | N2 | C7 | H6 | 178.1° | 145.2° |
| C8 | C7 | C9 | H6 | 118.0° | 120.0° |
| C7 | C8 | O3 | N3 | 179.8° | 180.0° |
| C8 | C7 | C9 | O4 | 53.6° | 64.5° |
| C8 | C7 | C9 | C10 | 177.8° | 55.6° |
| C8 | C7 | C9 | H7 | 63.3° | 175.4° |
| C7 | C8 | N3 | C11 | 180.0° | 178.7° |
| C7 | C8 | N3 | H11 | 0.1° | 1.4° |
| C8 | C7 | N2 | C2 | 118.3° | 85.0° |
| C9 | C7 | C8 | O3 | 42.6° | 85.0° |
| C7 | C9 | O4 | C10 | 123.5° | 120.1° |
| C7 | C9 | O4 | H7 | 116.3° | 120.1° |
| C7 | C9 | C10 | H7 | 119.1° | 119.8° |
| C7 | C9 | C10 | H8 | 180.0° | 60.1° |
| C7 | C9 | C10 | H9 | 60.0° | 180.0° |
| C7 | C9 | C10 | H10 | 60.0° | 60.0° |
| C9 | C7 | N2 | C2 | 119.4° | 154.7° |
| C9 | C7 | C8 | N3 | 137.2° | 95.0° |
| C7 | C9 | O4 | C36 | 158.6° | 146.2° |
| H6 | C7 | C8 | O3 | 75.6° | 35.0° |
| H6 | C7 | C9 | O4 | 171.6° | 55.5° |
| H6 | C7 | C9 | C10 | 64.2° | 175.7° |
| H6 | C7 | C9 | H7 | 54.7° | 64.6° |
| H6 | C7 | N2 | C2 | 1.9° | 34.9° |
| H6 | C7 | C8 | N3 | 104.5° | 145.0° |
| O3 | C8 | N3 | C11 | 0.2° | 1.3° |
| O3 | C8 | N3 | H11 | 179.7° | 178.6° |
| O4 | C9 | C10 | H7 | 120.8° | 119.8° |
| O4 | C9 | C10 | H8 | 59.9° | 60.3° |
| O4 | C9 | C10 | H9 | 179.9° | 59.6° |
| O4 | C9 | C10 | H10 | 60.1° | 179.6° |
| C9 | O4 | C36 | O10 | 0.7° | 2.5° |
| C9 | O4 | C36 | C37 | 178.1° | 177.4° |
| C9 | C10 | H8 | H9 | 120.0° | 120.0° |
| C9 | C10 | H8 | H10 | 120.0° | 120.1° |
| C9 | C10 | H9 | H10 | 120.0° | 120.0° |
| C10 | C9 | O4 | C36 | 77.8° | 93.7° |
| H7 | C9 | C10 | H8 | 60.9° | 179.9° |
| H7 | C9 | C10 | H9 | 59.0° | 60.2° |
| H7 | C9 | C10 | H10 | 179.0° | 59.8° |
| H7 | C9 | O4 | C36 | 42.4° | 26.1° |
| H8 | C10 | H9 | H10 | 120.0° | 120.0° |
| N3 | C11 | C12 | C13 | 121.8° | 119.8° |
| N3 | C11 | C12 | H12 | 118.0° | 119.8° |
| N3 | C11 | C13 | H12 | 120.0° | 120.3° |
| N3 | C11 | C12 | O5 | 66.3° | 12.1° |
| N3 | C11 | C13 | C14 | 78.2° | 67.8° |
| C11 | N3 | H11 | C8 | 180.0° | 179.9° |
| N3 | C11 | C13 | H13 | 161.3° | 52.2° |
| N3 | C11 | C13 | H14 | 42.4° | 172.2° |
| N3 | C11 | C12 | N4 | 114.2° | 167.9° |
| C12 | C11 | C13 | H12 | 119.9° | 120.3° |
| C11 | C12 | O5 | N4 | 179.6° | 180.0° |
| C12 | C11 | C13 | C14 | 161.7° | 51.6° |
| C12 | C11 | N3 | H11 | 60.1° | 101.5° |
| C12 | C11 | C13 | H13 | 41.2° | 171.6° |
| C12 | C11 | C13 | H14 | 77.7° | 68.5° |
| C11 | C12 | N4 | C15 | 179.7° | 178.4° |
| C11 | C12 | N4 | C19 | 0.0° | 0.8° |
| C12 | C11 | N3 | C8 | 119.9° | 78.4° |
| C13 | C11 | C12 | O5 | 55.5° | 132.0° |
| C11 | C13 | C14 | H13 | 120.5° | 120.0° |
| C11 | C13 | C14 | H14 | 120.6° | 120.0° |
| C13 | C11 | N3 | H11 | 62.9° | 18.3° |
| C11 | C13 | H13 | H14 | 118.3° | 120.0° |
| C11 | C13 | C14 | H15 | 180.0° | 59.9° |
| C11 | C13 | C14 | H16 | 60.0° | 180.0° |
| C11 | C13 | C14 | H17 | 60.0° | 60.0° |
| C13 | C11 | N3 | C8 | 117.1° | 161.7° |
| C13 | C11 | C12 | N4 | 124.0° | 48.0° |
| O5 | C12 | C11 | H12 | 175.7° | 107.7° |
| O5 | C12 | N4 | C15 | 0.2° | 1.6° |
| O5 | C12 | N4 | C19 | 179.6° | 179.2° |
| C14 | C13 | C11 | H12 | 41.8° | 171.9° |
| C14 | C13 | H13 | H14 | 118.3° | 120.0° |
| C13 | C14 | H15 | H16 | 120.0° | 120.0° |
| C13 | C14 | H15 | H17 | 120.0° | 119.9° |
| C13 | C14 | H16 | H17 | 120.0° | 119.9° |
| H11 | N3 | C11 | H12 | 177.4° | 138.7° |
| H12 | C11 | C13 | H13 | 78.7° | 68.1° |
| H12 | C11 | C13 | H14 | 162.3° | 51.8° |
| H12 | C11 | N3 | C8 | 2.6° | 41.4° |
| H12 | C11 | C12 | N4 | 3.8° | 72.3° |
| H13 | C13 | C14 | H15 | 59.5° | 60.0° |
| H13 | C13 | C14 | H16 | 179.5° | 60.0° |
| H13 | C13 | C14 | H17 | 60.5° | 180.0° |
| H14 | C13 | C14 | H15 | 59.4° | 180.0° |
| H14 | C13 | C14 | H16 | 60.6° | 59.9° |
| H14 | C13 | C14 | H17 | 179.4° | 60.0° |
| H15 | C14 | H16 | H17 | 120.0° | 120.1° |
| C15 | N4 | C19 | C12 | 179.8° | 179.3° |
| N4 | C15 | C16 | C17 | 114.8° | 119.2° |
| N4 | C15 | C16 | H18 | 123.2° | 120.8° |
| N4 | C15 | C17 | H18 | 120.0° | 119.3° |
| N4 | C15 | C16 | O6 | 16.7° | 48.0° |
| N4 | C15 | C17 | C18 | 22.1° | 15.6° |
| N4 | C15 | C17 | H19 | 97.3° | 103.5° |
| N4 | C15 | C17 | H20 | 141.5° | 134.6° |
| C15 | N4 | C19 | C18 | 23.6° | 2.4° |
| C15 | N4 | C19 | H23 | 142.7° | 117.5° |
| C15 | N4 | C19 | H24 | 95.6° | 122.2° |
| N4 | C15 | C16 | N5 | 164.2° | 132.0° |
| C19 | N4 | C15 | C16 | 116.5° | 131.5° |
| C19 | N4 | C15 | C17 | 1.3° | 11.3° |
| C19 | N4 | C15 | H18 | 121.0° | 107.9° |
| N4 | C19 | C18 | C17 | 36.4° | 7.3° |
| N4 | C19 | C18 | H23 | 119.2° | 119.9° |
| N4 | C19 | C18 | H24 | 119.1° | 119.8° |
| N4 | C19 | C18 | H21 | 155.2° | 126.3° |
| N4 | C19 | C18 | H22 | 82.5° | 111.7° |
| N4 | C19 | H23 | H24 | 122.4° | 120.3° |
| C16 | C15 | C17 | H18 | 121.7° | 120.0° |
| C15 | C16 | O6 | N5 | 179.0° | 180.0° |
| C16 | C15 | C17 | C18 | 140.3° | 136.3° |
| C16 | C15 | C17 | H19 | 20.9° | 17.2° |
| C16 | C15 | C17 | H20 | 100.3° | 104.7° |
| C15 | C16 | N5 | C20 | 0.6° | 10.3° |
| C15 | C16 | N5 | C21 | 178.6° | 169.6° |
| C16 | C15 | N4 | C12 | 63.7° | 49.2° |
| C17 | C15 | C16 | O6 | 98.1° | 71.2° |
| C15 | C17 | C18 | H19 | 119.4° | 119.1° |
| C15 | C17 | C18 | H20 | 119.4° | 119.1° |
| C15 | C17 | H19 | H20 | 121.8° | 121.9° |
| C15 | C17 | C18 | C19 | 35.9° | 13.7° |
| C15 | C17 | C18 | H21 | 154.7° | 132.7° |
| C15 | C17 | C18 | H22 | 82.9° | 105.3° |
| C17 | C15 | N4 | C12 | 178.5° | 169.4° |
| C17 | C15 | C16 | N5 | 80.9° | 108.8° |
| H18 | C15 | C16 | O6 | 139.9° | 168.8° |
| H18 | C15 | C17 | C18 | 98.0° | 103.7° |
| H18 | C15 | C17 | H19 | 142.6° | 137.2° |
| H18 | C15 | C17 | H20 | 21.4° | 15.3° |
| H18 | C15 | N4 | C12 | 58.8° | 71.4° |
| H18 | C15 | C16 | N5 | 41.1° | 11.2° |
| O6 | C16 | N5 | C20 | 179.6° | 169.7° |
| O6 | C16 | N5 | C21 | 0.4° | 10.4° |
| C18 | C17 | H19 | H20 | 121.8° | 121.8° |
| C17 | C18 | C19 | H21 | 118.8° | 119.0° |
| C17 | C18 | C19 | H22 | 118.8° | 119.1° |
| C17 | C18 | H21 | H22 | 123.5° | 122.0° |
| C17 | C18 | C19 | H23 | 155.5° | 127.2° |
| C17 | C18 | C19 | H24 | 82.8° | 112.5° |
| H19 | C17 | C18 | C19 | 83.5° | 105.4° |
| H19 | C17 | C18 | H21 | 35.3° | 13.6° |
| H19 | C17 | C18 | H22 | 157.7° | 135.6° |
| H20 | C17 | C18 | C19 | 155.3° | 132.8° |
| H20 | C17 | C18 | H21 | 85.9° | 108.2° |
| H20 | C17 | C18 | H22 | 36.5° | 13.7° |
| C19 | C18 | H21 | H22 | 123.4° | 121.9° |
| C18 | C19 | H23 | H24 | 122.5° | 120.3° |
| C18 | C19 | N4 | C12 | 156.2° | 178.3° |
| H21 | C18 | C19 | H23 | 85.7° | 113.8° |
| H21 | C18 | C19 | H24 | 36.0° | 6.5° |
| H22 | C18 | C19 | H23 | 36.7° | 8.2° |
| H22 | C18 | C19 | H24 | 158.4° | 128.4° |
| H23 | C19 | N4 | C12 | 37.1° | 61.8° |
| H24 | C19 | N4 | C12 | 84.6° | 58.4° |
| N5 | C20 | H25 | H26 | 120.0° | 120.0° |
| N5 | C20 | H25 | H27 | 120.0° | 119.9° |
| N5 | C20 | H26 | H27 | 120.0° | 119.9° |
| C20 | N5 | C21 | C16 | 179.2° | 179.9° |
| C20 | N5 | C21 | C22 | 97.9° | 51.9° |
| C20 | N5 | C21 | C23 | 23.5° | 171.6° |
| C20 | N5 | C21 | H28 | 144.0° | 67.9° |
| H25 | C20 | H26 | H27 | 120.0° | 120.0° |
| H25 | C20 | N5 | C21 | 180.0° | 115.6° |
| H25 | C20 | N5 | C16 | 0.8° | 64.2° |
| H26 | C20 | N5 | C21 | 60.0° | 4.4° |
| H26 | C20 | N5 | C16 | 119.1° | 175.7° |
| H27 | C20 | N5 | C21 | 60.0° | 124.4° |
| H27 | C20 | N5 | C16 | 120.9° | 55.7° |
| N5 | C21 | C22 | C23 | 125.2° | 119.8° |
| N5 | C21 | C22 | H28 | 118.3° | 119.7° |
| N5 | C21 | C23 | H28 | 121.1° | 120.5° |
| N5 | C21 | C22 | O7 | 59.9° | 20.6° |
| N5 | C21 | C23 | C24 | 178.7° | 80.0° |
| N5 | C21 | C23 | H29 | 60.6° | 40.0° |
| N5 | C21 | C23 | H30 | 58.0° | 160.0° |
| N5 | C21 | C22 | N6 | 121.4° | 159.4° |
| C22 | C21 | C23 | H28 | 117.0° | 120.4° |
| C21 | C22 | O7 | N6 | 178.8° | 180.0° |
| C22 | C21 | C23 | C24 | 56.8° | 160.9° |
| C22 | C21 | C23 | H29 | 177.5° | 79.1° |
| C22 | C21 | C23 | H30 | 63.9° | 40.8° |
| C21 | C22 | N6 | C30 | 1.1° | 171.8° |
| C21 | C22 | N6 | C35 | 177.7° | 7.3° |
| C22 | C21 | N5 | C16 | 81.3° | 128.2° |
| C23 | C21 | C22 | O7 | 65.3° | 140.3° |
| C21 | C23 | C24 | H29 | 120.7° | 120.0° |
| C21 | C23 | C24 | H30 | 120.7° | 120.0° |
| C21 | C23 | H29 | H30 | 117.8° | 120.0° |
| C21 | C23 | C24 | C25 | 89.7° | 117.7° |
| C21 | C23 | C24 | C29 | 89.8° | 62.6° |
| C23 | C21 | N5 | C16 | 157.3° | 8.5° |
| C23 | C21 | C22 | N6 | 113.5° | 39.7° |
| H28 | C21 | C22 | O7 | 178.1° | 99.2° |
| H28 | C21 | C23 | C24 | 60.2° | 40.5° |
| H28 | C21 | C23 | H29 | 60.5° | 160.5° |
| H28 | C21 | C23 | H30 | 179.1° | 79.6° |
| H28 | C21 | N5 | C16 | 36.8° | 112.0° |
| H28 | C21 | C22 | N6 | 3.1° | 80.8° |
| O7 | C22 | N6 | C30 | 179.8° | 8.2° |
| O7 | C22 | N6 | C35 | 1.0° | 172.7° |
| C24 | C23 | H29 | H30 | 117.8° | 120.0° |
| C23 | C24 | C25 | C29 | 179.5° | 179.7° |
| C23 | C24 | C25 | C26 | 179.3° | 180.0° |
| C23 | C24 | C25 | H31 | 0.7° | 0.1° |
| C23 | C24 | C29 | C28 | 179.4° | 179.8° |
| C23 | C24 | C29 | H35 | 0.6° | 0.1° |
| H29 | C23 | C24 | C25 | 149.7° | 2.3° |
| H29 | C23 | C24 | C29 | 30.9° | 177.4° |
| H30 | C23 | C24 | C25 | 31.1° | 122.3° |
| H30 | C23 | C24 | C29 | 149.5° | 57.4° |
| C24 | C25 | C26 | H31 | 180.0° | 179.9° |
| C24 | C25 | C26 | C27 | 0.1° | 0.0° |
| C24 | C25 | C26 | H32 | 179.9° | 180.0° |
| C25 | C24 | C29 | C28 | 0.0° | 0.5° |
| C25 | C24 | C29 | H35 | 180.0° | 179.8° |
| C29 | C24 | C25 | C26 | 0.1° | 0.3° |
| C29 | C24 | C25 | H31 | 179.9° | 179.8° |
| C24 | C29 | C28 | C27 | 0.1° | 0.5° |
| C24 | C29 | C28 | H35 | 180.0° | 179.7° |
| C24 | C29 | C28 | H34 | 179.9° | 179.7° |
| C25 | C26 | C27 | H32 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 0.1° | 0.0° |
| C25 | C26 | C27 | H33 | 179.9° | 180.0° |
| H31 | C25 | C26 | C27 | 179.9° | 179.9° |
| H31 | C25 | C26 | H32 | 0.0° | 0.1° |
| C26 | C27 | C28 | H33 | 180.0° | 180.0° |
| C26 | C27 | C28 | C29 | 0.2° | 0.2° |
| C26 | C27 | C28 | H34 | 179.9° | 180.0° |
| H32 | C26 | C27 | C28 | 179.9° | 180.0° |
| H32 | C26 | C27 | H33 | 0.1° | 0.0° |
| C27 | C28 | C29 | H34 | 180.0° | 179.9° |
| C27 | C28 | C29 | H35 | 179.9° | 179.8° |
| H33 | C27 | C28 | C29 | 179.8° | 179.8° |
| H33 | C27 | C28 | H34 | 0.1° | 0.1° |
| H34 | C28 | C29 | H35 | 0.1° | 0.0° |
| C30 | N6 | C35 | C22 | 179.0° | 179.1° |
| N6 | C30 | C31 | C32 | 118.6° | 121.5° |
| N6 | C30 | C31 | H36 | 120.7° | 118.7° |
| N6 | C30 | C32 | H36 | 118.9° | 119.5° |
| N6 | C30 | C31 | O8 | 118.3° | 62.8° |
| N6 | C30 | C32 | C33 | 48.6° | 42.7° |
| C30 | N6 | C35 | C34 | 66.4° | 55.7° |
| C30 | N6 | C35 | H37 | 174.0° | 175.8° |
| C30 | N6 | C35 | H38 | 53.1° | 64.3° |
| N6 | C30 | C32 | H39 | 169.0° | 163.1° |
| N6 | C30 | C32 | H40 | 71.8° | 77.7° |
| N6 | C30 | C31 | N7 | 60.0° | 117.2° |
| C35 | N6 | C30 | C31 | 52.6° | 69.6° |
| C35 | N6 | C30 | C32 | 68.3° | 52.2° |
| N6 | C35 | C34 | C33 | 47.8° | 48.6° |
| N6 | C35 | C34 | H37 | 119.6° | 120.1° |
| N6 | C35 | C34 | H38 | 119.6° | 120.1° |
| C35 | N6 | C30 | H36 | 172.9° | 171.9° |
| N6 | C35 | H37 | H38 | 121.3° | 119.9° |
| N6 | C35 | C34 | H41 | 168.7° | 168.3° |
| N6 | C35 | C34 | H42 | 72.9° | 71.2° |
| C31 | C30 | C32 | H36 | 120.5° | 119.5° |
| C30 | C31 | O8 | N7 | 178.2° | 179.9° |
| C31 | C30 | C32 | C33 | 72.0° | 78.3° |
| C31 | C30 | C32 | H39 | 48.4° | 42.1° |
| C31 | C30 | C32 | H40 | 167.6° | 161.2° |
| C30 | C31 | N7 | H43 | 3.4° | 24.1° |
| C30 | C31 | N7 | C37 | 176.6° | 156.0° |
| C31 | C30 | N6 | C22 | 128.5° | 109.5° |
| C32 | C30 | C31 | O8 | 0.3° | 58.8° |
| C30 | C32 | C33 | H39 | 120.4° | 120.4° |
| C30 | C32 | C33 | H40 | 120.4° | 120.5° |
| C30 | C32 | C33 | O9 | 142.7° | 133.3° |
| C30 | C32 | C33 | C34 | 36.2° | 46.7° |
| C30 | C32 | H39 | H40 | 118.8° | 119.2° |
| C32 | C30 | N6 | C22 | 110.6° | 128.7° |
| C32 | C30 | C31 | N7 | 178.5° | 121.3° |
| O8 | C31 | C30 | H36 | 121.0° | 178.6° |
| O8 | C31 | N7 | H43 | 178.3° | 156.0° |
| O8 | C31 | N7 | C37 | 1.7° | 23.9° |
| C32 | C33 | O9 | C34 | 178.9° | 180.0° |
| C32 | C33 | C34 | C35 | 35.6° | 49.2° |
| C33 | C32 | C30 | H36 | 167.5° | 162.2° |
| C33 | C32 | H39 | H40 | 118.8° | 119.1° |
| C32 | C33 | C34 | H41 | 156.4° | 169.0° |
| C32 | C33 | C34 | H42 | 85.1° | 70.6° |
| O9 | C33 | C34 | C35 | 143.3° | 130.7° |
| O9 | C33 | C32 | H39 | 22.3° | 12.9° |
| O9 | C33 | C32 | H40 | 96.9° | 106.2° |
| O9 | C33 | C34 | H41 | 22.5° | 11.0° |
| O9 | C33 | C34 | H42 | 96.0° | 109.5° |
| C33 | C34 | C35 | H41 | 120.8° | 119.7° |
| C33 | C34 | C35 | H42 | 120.8° | 119.7° |
| C33 | C34 | C35 | H37 | 167.4° | 168.7° |
| C33 | C34 | C35 | H38 | 71.7° | 71.5° |
| C34 | C33 | C32 | H39 | 156.6° | 167.1° |
| C34 | C33 | C32 | H40 | 84.2° | 73.8° |
| C33 | C34 | H41 | H42 | 117.5° | 120.3° |
| C34 | C35 | H37 | H38 | 121.3° | 119.8° |
| C35 | C34 | H41 | H42 | 117.6° | 120.4° |
| C34 | C35 | N6 | C22 | 112.6° | 125.2° |
| H36 | C30 | C32 | H39 | 72.1° | 77.4° |
| H36 | C30 | C32 | H40 | 47.1° | 41.8° |
| H36 | C30 | N6 | C22 | 8.2° | 9.0° |
| H36 | C30 | C31 | N7 | 60.7° | 1.5° |
| H37 | C35 | C34 | H41 | 71.8° | 71.6° |
| H37 | C35 | C34 | H42 | 46.6° | 48.9° |
| H37 | C35 | N6 | C22 | 7.0° | 5.1° |
| H38 | C35 | C34 | H41 | 49.1° | 48.2° |
| H38 | C35 | C34 | H42 | 167.5° | 168.7° |
| H38 | C35 | N6 | C22 | 127.9° | 114.7° |
| O10 | C36 | C37 | O4 | 178.8° | 179.9° |
| O10 | C36 | C37 | N7 | 155.1° | 76.4° |
| O10 | C36 | C37 | C38 | 77.3° | 164.0° |
| O10 | C36 | C37 | H44 | 35.7° | 43.3° |
| H43 | N7 | C37 | C36 | 97.6° | 31.0° |
| H43 | N7 | C37 | C31 | 180.0° | 179.9° |
| H43 | N7 | C37 | C38 | 32.3° | 150.7° |
| H43 | N7 | C37 | H44 | 143.3° | 88.5° |
| C36 | C37 | N7 | C38 | 129.9° | 119.6° |
| C36 | C37 | N7 | H44 | 119.1° | 119.6° |
| C36 | C37 | C38 | H44 | 113.3° | 120.7° |
| C36 | C37 | C38 | C42 | 169.0° | 108.6° |
| C36 | C37 | C38 | C43 | 11.1° | 71.7° |
| C36 | C37 | N7 | C31 | 82.4° | 149.0° |
| N7 | C37 | C38 | H44 | 111.8° | 120.8° |
| N7 | C37 | C38 | C42 | 34.1° | 132.9° |
| N7 | C37 | C38 | C43 | 146.0° | 46.8° |
| N7 | C37 | C36 | O4 | 26.0° | 103.5° |
| C37 | C38 | C42 | C43 | 179.9° | 179.7° |
| C37 | C38 | C42 | C40 | 179.9° | 180.0° |
| C37 | C38 | C42 | H48 | 0.1° | 0.0° |
| C37 | C38 | C43 | C41 | 179.9° | 180.0° |
| C37 | C38 | C43 | H49 | 0.1° | 0.0° |
| C38 | C37 | C36 | O4 | 101.5° | 16.1° |
| C38 | C37 | N7 | C31 | 147.7° | 29.4° |
| H44 | C37 | C38 | C42 | 77.7° | 12.1° |
| H44 | C37 | C38 | C43 | 102.2° | 167.6° |
| H44 | C37 | C36 | O4 | 145.5° | 136.9° |
| H44 | C37 | N7 | C31 | 36.7° | 91.4° |
| C38 | C42 | C40 | C39 | 0.0° | 0.1° |
| C38 | C42 | C40 | H46 | 180.0° | 179.8° |
| C38 | C42 | C40 | H48 | 180.0° | 180.0° |
| C42 | C38 | C43 | C41 | 0.0° | 0.3° |
| C42 | C38 | C43 | H49 | 180.0° | 179.7° |
| C40 | C39 | H45 | C41 | 180.0° | 180.0° |
| C39 | C40 | H46 | C42 | 180.0° | 179.8° |
| C40 | C39 | C41 | H47 | 180.0° | 180.0° |
| C39 | C40 | C42 | H48 | 180.0° | 180.0° |
| C40 | C39 | C41 | C43 | 0.0° | 0.2° |
| H45 | C39 | C40 | H46 | 0.0° | 0.1° |
| H45 | C39 | C41 | H47 | 0.0° | 0.0° |
| H45 | C39 | C40 | C42 | 180.0° | 179.8° |
| H45 | C39 | C41 | C43 | 180.0° | 179.7° |
| H46 | C40 | C39 | C41 | 180.0° | 180.0° |
| H46 | C40 | C42 | H48 | 0.0° | 0.2° |
| C39 | C41 | H47 | C43 | 180.0° | 179.8° |
| C41 | C39 | C40 | C42 | 0.0° | 0.2° |
| C39 | C41 | C43 | C38 | 0.0° | 0.0° |
| C39 | C41 | C43 | H49 | 180.0° | 180.0° |
| H47 | C41 | C43 | C38 | 179.9° | 179.7° |
| H47 | C41 | C43 | H49 | 0.0° | 0.2° |
| C40 | C42 | C38 | C43 | 0.0° | 0.3° |
| H48 | C42 | C38 | C43 | 180.0° | 179.7° |
| C38 | C43 | C41 | H49 | 180.0° | 180.0° |
