7P7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | S1 | doub | 1.42Å | 1.44Å | |
| O | C | doub | 1.22Å | 1.25Å | |
| O2 | S1 | doub | 1.42Å | 1.43Å | |
| S1 | C8 | sing | 1.82Å | 1.66Å | |
| S1 | C7 | sing | 1.82Å | 1.66Å | |
| C41 | N5 | sing | 1.47Å | 1.46Å | |
| C8 | C9 | sing | 1.53Å | 1.52Å | |
| C9 | C5 | sing | 1.53Å | 1.53Å | |
| C | N5 | sing | 1.34Å | 1.41Å | |
| C | C1 | sing | 1.47Å | 1.48Å | |
| N5 | C40 | sing | 1.36Å | 1.35Å | |
| C10 | C1 | sing | 1.40Å | 1.45Å | Aromatic |
| C10 | C3 | doub | 1.34Å | 1.40Å | Aromatic |
| C7 | C6 | sing | 1.53Å | 1.52Å | |
| C1 | C2 | doub | 1.40Å | 1.47Å | Aromatic |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C5 | N | sing | 1.47Å | 1.45Å | |
| N | C4 | sing | 1.38Å | 1.33Å | |
| C40 | C11 | doub | 1.36Å | 1.39Å | |
| C3 | C4 | sing | 1.47Å | 1.49Å | |
| C3 | S | sing | 1.76Å | 1.75Å | Aromatic |
| C4 | N1 | doub | 1.31Å | 1.26Å | |
| C2 | C11 | sing | 1.47Å | 1.49Å | |
| C2 | S | sing | 1.76Å | 1.68Å | Aromatic |
| C11 | C12 | sing | 1.48Å | 1.49Å | |
| C12 | C39 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C39 | C38 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C38 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C14 | C16 | sing | 1.39Å | 1.48Å | Aromatic |
| C14 | O3 | sing | 1.36Å | 1.36Å | |
| C16 | O4 | sing | 1.36Å | 1.37Å | |
| C15 | O3 | sing | 1.43Å | 1.42Å | |
| O4 | C17 | sing | 1.43Å | 1.43Å | |
| C17 | C18 | sing | 1.51Å | 1.51Å | |
| C18 | N2 | sing | 1.35Å | 1.33Å | |
| C18 | O10 | doub | 1.21Å | 1.22Å | |
| N2 | C19 | sing | 1.46Å | 1.45Å | |
| C19 | C20 | sing | 1.53Å | 1.52Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C22 | C23 | sing | 1.53Å | 1.52Å | |
| C24 | C23 | sing | 1.53Å | 1.52Å | |
| C24 | O5 | sing | 1.43Å | 1.42Å | |
| C26 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C26 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| C27 | C28 | sing | 1.39Å | 1.40Å | Aromatic |
| O5 | C25 | sing | 1.36Å | 1.37Å | |
| C25 | C36 | doub | 1.39Å | 1.48Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C36 | C29 | sing | 1.41Å | 1.47Å | Aromatic |
| C36 | C37 | sing | 1.47Å | 1.49Å | |
| C29 | C30 | sing | 1.48Å | 1.49Å | |
| C37 | O9 | doub | 1.22Å | 1.28Å | |
| C37 | N3 | sing | 1.35Å | 1.34Å | |
| O7 | C32 | doub | 1.21Å | 1.22Å | |
| C30 | N3 | sing | 1.35Å | 1.35Å | |
| C30 | O8 | doub | 1.21Å | 1.29Å | |
| N3 | C31 | sing | 1.46Å | 1.49Å | |
| C32 | C31 | sing | 1.51Å | 1.50Å | |
| C32 | N4 | sing | 1.34Å | 1.34Å | |
| C31 | C35 | sing | 1.53Å | 1.52Å | |
| N4 | C33 | sing | 1.34Å | 1.33Å | |
| C35 | C34 | sing | 1.53Å | 1.52Å | |
| C33 | C34 | sing | 1.51Å | 1.51Å | |
| C33 | O6 | doub | 1.21Å | 1.22Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C6 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| N1 | H4 | sing | 0.97Å | 1.00Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| N2 | H9 | sing | 0.97Å | 1.00Å | |
| N | H10 | sing | 0.97Å | 1.00Å | |
| C10 | H11 | sing | 1.08Å | 1.08Å | |
| C13 | H12 | sing | 1.08Å | 1.08Å | |
| C15 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C24 | H28 | sing | 1.09Å | 1.10Å | |
| C24 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.08Å | 1.08Å | |
| C27 | H31 | sing | 1.08Å | 1.08Å | |
| C28 | H32 | sing | 1.08Å | 1.08Å | |
| C31 | H33 | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H36 | sing | 1.09Å | 1.10Å | |
| C35 | H37 | sing | 1.09Å | 1.10Å | |
| C38 | H38 | sing | 1.08Å | 1.08Å | |
| C39 | H39 | sing | 1.08Å | 1.08Å | |
| C40 | H40 | sing | 1.08Å | 1.08Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| C41 | H42 | sing | 1.09Å | 1.10Å | |
| C41 | H43 | sing | 1.09Å | 1.10Å | |
| C9 | H44 | sing | 1.09Å | 1.10Å | |
| C9 | H45 | sing | 1.09Å | 1.10Å | |
| N4 | H46 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | S1 | O2 | 109.8° | 119.3° |
| O1 | S1 | C8 | 110.2° | 108.7° |
| O1 | S1 | C7 | 109.9° | 108.7° |
| O | C | N5 | 120.1° | 119.9° |
| O | C | C1 | 119.6° | 119.8° |
| O2 | S1 | C8 | 110.2° | 108.6° |
| O2 | S1 | C7 | 110.0° | 108.7° |
| C8 | S1 | C7 | 106.6° | 101.3° |
| S1 | C8 | C9 | 108.4° | 109.0° |
| S1 | C8 | H7 | 109.7° | 109.5° |
| S1 | C8 | H8 | 109.7° | 109.7° |
| S1 | C7 | C6 | 108.2° | 109.0° |
| S1 | C7 | H5 | 109.8° | 109.6° |
| S1 | C7 | H6 | 109.8° | 109.6° |
| C41 | N5 | C | 118.3° | 118.8° |
| C41 | N5 | C40 | 119.2° | 118.9° |
| N5 | C41 | H41 | 109.5° | 109.5° |
| N5 | C41 | H42 | 109.5° | 109.5° |
| N5 | C41 | H43 | 109.5° | 109.4° |
| C8 | C9 | C5 | 113.7° | 110.0° |
| C9 | C8 | H7 | 109.7° | 109.5° |
| C9 | C8 | H8 | 109.7° | 109.6° |
| C8 | C9 | H44 | 108.4° | 109.4° |
| C8 | C9 | H45 | 108.4° | 109.5° |
| C9 | C5 | C6 | 111.8° | 110.6° |
| C9 | C5 | N | 107.8° | 109.2° |
| C9 | C5 | H1 | 110.1° | 109.2° |
| C5 | C9 | H44 | 108.4° | 109.4° |
| C5 | C9 | H45 | 108.4° | 109.4° |
| N5 | C | C1 | 120.3° | 120.3° |
| C | N5 | C40 | 122.5° | 122.3° |
| C | C1 | C10 | 130.9° | 129.8° |
| C | C1 | C2 | 115.8° | 117.5° |
| N5 | C40 | C11 | 123.0° | 121.5° |
| N5 | C40 | H40 | 118.5° | 119.3° |
| C1 | C10 | C3 | 110.4° | 115.6° |
| C10 | C1 | C2 | 113.3° | 112.7° |
| C1 | C10 | H11 | 124.8° | 122.1° |
| C10 | C3 | C4 | 129.3° | 124.7° |
| C10 | C3 | S | 112.3° | 110.6° |
| C3 | C10 | H11 | 124.8° | 122.2° |
| C7 | C6 | C5 | 114.6° | 110.0° |
| C7 | C6 | H2 | 108.2° | 109.4° |
| C7 | C6 | H3 | 108.2° | 109.3° |
| C6 | C7 | H5 | 109.8° | 109.6° |
| C6 | C7 | H6 | 109.8° | 109.5° |
| C1 | C2 | C11 | 120.1° | 118.8° |
| C1 | C2 | S | 109.9° | 109.7° |
| C6 | C5 | N | 105.7° | 109.3° |
| C6 | C5 | H1 | 110.1° | 109.3° |
| C5 | C6 | H2 | 108.2° | 109.4° |
| C5 | C6 | H3 | 108.2° | 109.4° |
| C5 | N | C4 | 127.8° | 120.0° |
| N | C5 | H1 | 111.3° | 109.2° |
| C5 | N | H10 | 116.1° | 120.0° |
| N | C4 | C3 | 115.2° | 120.0° |
| N | C4 | N1 | 121.9° | 120.0° |
| C4 | N | H10 | 116.1° | 120.0° |
| C40 | C11 | C2 | 118.3° | 119.7° |
| C40 | C11 | C12 | 119.3° | 120.2° |
| C11 | C40 | H40 | 118.5° | 119.2° |
| C4 | C3 | S | 118.4° | 124.7° |
| C3 | C4 | N1 | 122.9° | 120.0° |
| C3 | S | C2 | 94.1° | 91.5° |
| C4 | N1 | H4 | 112.0° | 120.0° |
| C11 | C2 | S | 129.9° | 131.5° |
| C2 | C11 | C12 | 122.4° | 120.1° |
| C11 | C12 | C39 | 119.4° | 120.1° |
| C11 | C12 | C13 | 119.9° | 120.0° |
| C39 | C12 | C13 | 120.7° | 119.9° |
| C12 | C39 | C38 | 121.6° | 120.1° |
| C12 | C39 | H39 | 119.2° | 120.0° |
| C12 | C13 | C14 | 119.9° | 119.8° |
| C12 | C13 | H12 | 120.1° | 120.1° |
| C39 | C38 | C16 | 119.6° | 120.1° |
| C39 | C38 | H38 | 120.2° | 120.0° |
| C38 | C39 | H39 | 119.2° | 120.0° |
| C13 | C14 | C16 | 119.7° | 120.0° |
| C13 | C14 | O3 | 118.9° | 120.0° |
| C14 | C13 | H12 | 120.0° | 120.1° |
| C38 | C16 | C14 | 118.5° | 120.1° |
| C38 | C16 | O4 | 121.3° | 120.0° |
| C16 | C38 | H38 | 120.2° | 119.9° |
| C16 | C14 | O3 | 121.4° | 120.0° |
| C14 | C16 | O4 | 120.2° | 120.0° |
| C14 | O3 | C15 | 116.7° | 117.0° |
| C16 | O4 | C17 | 119.4° | 117.0° |
| O3 | C15 | H13 | 109.5° | 109.5° |
| O3 | C15 | H14 | 109.5° | 109.4° |
| O3 | C15 | H15 | 109.5° | 109.4° |
| O4 | C17 | C18 | 110.3° | 109.5° |
| O4 | C17 | H16 | 109.3° | 109.5° |
| O4 | C17 | H17 | 109.3° | 109.5° |
| C17 | C18 | N2 | 116.8° | 120.0° |
| C17 | C18 | O10 | 120.5° | 120.0° |
| C18 | C17 | H16 | 109.3° | 109.5° |
| C18 | C17 | H17 | 109.3° | 109.5° |
| N2 | C18 | O10 | 122.8° | 120.0° |
| C18 | N2 | C19 | 120.6° | 120.0° |
| C18 | N2 | H9 | 119.6° | 119.9° |
| N2 | C19 | C20 | 112.6° | 109.5° |
| C19 | N2 | H9 | 119.7° | 120.0° |
| N2 | C19 | H18 | 108.7° | 109.5° |
| N2 | C19 | H19 | 108.7° | 109.5° |
| C19 | C20 | C21 | 111.1° | 109.5° |
| C20 | C19 | H18 | 108.7° | 109.4° |
| C20 | C19 | H19 | 108.7° | 109.5° |
| C19 | C20 | H20 | 109.0° | 109.5° |
| C19 | C20 | H21 | 109.1° | 109.5° |
| C20 | C21 | C22 | 110.2° | 109.5° |
| C21 | C20 | H20 | 109.0° | 109.4° |
| C21 | C20 | H21 | 109.0° | 109.5° |
| C20 | C21 | H22 | 109.3° | 109.5° |
| C20 | C21 | H23 | 109.3° | 109.5° |
| C21 | C22 | C23 | 111.1° | 109.5° |
| C22 | C21 | H22 | 109.3° | 109.4° |
| C22 | C21 | H23 | 109.3° | 109.5° |
| C21 | C22 | H24 | 109.0° | 109.4° |
| C21 | C22 | H25 | 109.1° | 109.5° |
| C22 | C23 | C24 | 110.0° | 109.5° |
| C23 | C22 | H24 | 109.1° | 109.5° |
| C23 | C22 | H25 | 109.1° | 109.5° |
| C22 | C23 | H26 | 109.3° | 109.4° |
| C22 | C23 | H27 | 109.3° | 109.5° |
| C23 | C24 | O5 | 108.4° | 109.5° |
| C24 | C23 | H26 | 109.3° | 109.5° |
| C24 | C23 | H27 | 109.3° | 109.5° |
| C23 | C24 | H28 | 109.7° | 109.5° |
| C23 | C24 | H29 | 109.7° | 109.5° |
| C24 | O5 | C25 | 120.1° | 117.0° |
| O5 | C24 | H28 | 109.7° | 109.4° |
| O5 | C24 | H29 | 109.8° | 109.5° |
| C27 | C26 | C25 | 121.6° | 120.4° |
| C26 | C27 | C28 | 123.0° | 120.5° |
| C27 | C26 | H30 | 119.2° | 119.8° |
| C26 | C27 | H31 | 118.5° | 119.8° |
| C26 | C25 | O5 | 121.8° | 120.2° |
| C26 | C25 | C36 | 117.4° | 119.6° |
| C25 | C26 | H30 | 119.2° | 119.8° |
| C27 | C28 | C29 | 118.3° | 119.9° |
| C28 | C27 | H31 | 118.5° | 119.7° |
| C27 | C28 | H32 | 120.9° | 120.0° |
| O5 | C25 | C36 | 120.8° | 120.2° |
| C25 | C36 | C29 | 118.6° | 119.7° |
| C25 | C36 | C37 | 138.9° | 134.4° |
| C28 | C29 | C36 | 121.2° | 119.9° |
| C28 | C29 | C30 | 135.5° | 134.3° |
| C29 | C28 | H32 | 120.8° | 120.1° |
| C29 | C36 | C37 | 102.5° | 105.9° |
| C36 | C29 | C30 | 103.3° | 105.8° |
| C36 | C37 | O9 | 122.4° | 125.6° |
| C36 | C37 | N3 | 115.2° | 108.7° |
| C29 | C30 | N3 | 114.3° | 108.5° |
| C29 | C30 | O8 | 122.3° | 125.8° |
| O9 | C37 | N3 | 122.4° | 125.7° |
| C37 | N3 | C30 | 104.7° | 111.0° |
| C37 | N3 | C31 | 126.2° | 124.5° |
| O7 | C32 | C31 | 118.7° | 119.3° |
| O7 | C32 | N4 | 121.5° | 119.4° |
| N3 | C30 | O8 | 123.4° | 125.7° |
| C30 | N3 | C31 | 129.1° | 124.5° |
| N3 | C31 | C32 | 109.3° | 109.6° |
| N3 | C31 | C35 | 110.6° | 109.5° |
| N3 | C31 | H33 | 108.9° | 109.5° |
| C31 | C32 | N4 | 119.8° | 121.3° |
| C32 | C31 | C35 | 110.9° | 109.2° |
| C32 | C31 | H33 | 108.6° | 109.5° |
| C32 | N4 | C33 | 124.8° | 122.6° |
| C32 | N4 | H46 | 117.6° | 118.7° |
| C31 | C35 | C34 | 108.2° | 108.6° |
| C35 | C31 | H33 | 108.4° | 109.5° |
| C31 | C35 | H36 | 109.8° | 109.6° |
| C31 | C35 | H37 | 109.8° | 109.6° |
| N4 | C33 | C34 | 117.8° | 121.3° |
| N4 | C33 | O6 | 122.3° | 119.4° |
| C33 | N4 | H46 | 117.6° | 118.7° |
| C35 | C34 | C33 | 107.4° | 109.2° |
| C35 | C34 | H34 | 110.0° | 109.5° |
| C35 | C34 | H35 | 110.0° | 109.6° |
| C34 | C35 | H36 | 109.8° | 109.6° |
| C34 | C35 | H37 | 109.8° | 109.7° |
| C34 | C33 | O6 | 119.9° | 119.3° |
| C33 | C34 | H34 | 110.0° | 109.5° |
| C33 | C34 | H35 | 110.0° | 109.6° |
| H2 | C6 | H3 | 109.5° | 109.4° |
| H5 | C7 | H6 | 109.5° | 109.6° |
| H7 | C8 | H8 | 109.5° | 109.5° |
| H13 | C15 | H14 | 109.4° | 109.5° |
| H13 | C15 | H15 | 109.5° | 109.5° |
| H14 | C15 | H15 | 109.5° | 109.5° |
| H16 | C17 | H17 | 109.4° | 109.4° |
| H18 | C19 | H19 | 109.5° | 109.4° |
| H20 | C20 | H21 | 109.5° | 109.4° |
| H22 | C21 | H23 | 109.5° | 109.5° |
| H24 | C22 | H25 | 109.5° | 109.4° |
| H26 | C23 | H27 | 109.5° | 109.5° |
| H28 | C24 | H29 | 109.4° | 109.5° |
| H34 | C34 | H35 | 109.5° | 109.5° |
| H36 | C35 | H37 | 109.5° | 109.7° |
| H41 | C41 | H42 | 109.5° | 109.5° |
| H41 | C41 | H43 | 109.5° | 109.5° |
| H42 | C41 | H43 | 109.5° | 109.5° |
| H44 | C9 | H45 | 109.5° | 109.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | S1 | O2 | C8 | 121.6° | 125.2° |
| O1 | S1 | O2 | C7 | 121.1° | 125.3° |
| O1 | S1 | C8 | C7 | 119.2° | 114.3° |
| O1 | S1 | C8 | C9 | 59.8° | 60.0° |
| O1 | S1 | C7 | C6 | 61.1° | 60.0° |
| O1 | S1 | C7 | H5 | 58.7° | 179.9° |
| O1 | S1 | C7 | H6 | 179.1° | 59.8° |
| O1 | S1 | C8 | H7 | 179.6° | 59.8° |
| O1 | S1 | C8 | H8 | 60.0° | 180.0° |
| O | C | N5 | C41 | 0.0° | 0.0° |
| O | C | N5 | C1 | 179.9° | 180.0° |
| O | C | N5 | C40 | 179.8° | 180.0° |
| O | C | C1 | C10 | 0.0° | 0.3° |
| O | C | C1 | C2 | 180.0° | 180.0° |
| O2 | S1 | C8 | C7 | 119.4° | 114.4° |
| O2 | S1 | C8 | C9 | 178.8° | 168.7° |
| O2 | S1 | C7 | C6 | 177.9° | 168.7° |
| O2 | S1 | C7 | H5 | 62.3° | 48.8° |
| O2 | S1 | C7 | H6 | 58.1° | 71.5° |
| O2 | S1 | C8 | H7 | 59.0° | 71.5° |
| O2 | S1 | C8 | H8 | 61.4° | 48.8° |
| S1 | C8 | C9 | H7 | 119.8° | 119.8° |
| S1 | C8 | C9 | H8 | 119.8° | 120.0° |
| S1 | C8 | C9 | C5 | 58.7° | 63.7° |
| C8 | S1 | C7 | C6 | 58.4° | 54.3° |
| C8 | S1 | C7 | H5 | 178.1° | 65.6° |
| C8 | S1 | C7 | H6 | 61.4° | 174.2° |
| S1 | C8 | H7 | H8 | 120.5° | 120.3° |
| S1 | C8 | C9 | H44 | 179.4° | 56.5° |
| S1 | C8 | C9 | H45 | 61.9° | 176.2° |
| C7 | S1 | C8 | C9 | 59.4° | 54.3° |
| S1 | C7 | C6 | H5 | 119.8° | 119.9° |
| S1 | C7 | C6 | H6 | 119.8° | 119.9° |
| S1 | C7 | C6 | C5 | 57.3° | 63.7° |
| S1 | C7 | C6 | H2 | 63.4° | 176.2° |
| S1 | C7 | C6 | H3 | 178.1° | 56.4° |
| S1 | C7 | H5 | H6 | 120.6° | 120.3° |
| C7 | S1 | C8 | H7 | 60.4° | 174.1° |
| C7 | S1 | C8 | H8 | 179.2° | 65.6° |
| C41 | N5 | C | C40 | 179.8° | 180.0° |
| C41 | N5 | C | C1 | 180.0° | 180.0° |
| C41 | N5 | C40 | C11 | 179.9° | 180.0° |
| C41 | N5 | C40 | H40 | 0.1° | 0.1° |
| N5 | C41 | H41 | H42 | 120.0° | 120.1° |
| N5 | C41 | H41 | H43 | 120.0° | 119.9° |
| N5 | C41 | H42 | H43 | 120.0° | 119.9° |
| C8 | C9 | C5 | H44 | 120.6° | 120.2° |
| C8 | C9 | C5 | H45 | 120.6° | 120.2° |
| C8 | C9 | C5 | C6 | 54.8° | 70.0° |
| C8 | C9 | C5 | N | 170.6° | 169.7° |
| C8 | C9 | C5 | H1 | 67.8° | 50.3° |
| C9 | C8 | H7 | H8 | 120.5° | 120.2° |
| C8 | C9 | H44 | H45 | 118.1° | 119.8° |
| C9 | C5 | C6 | C7 | 54.4° | 70.0° |
| C9 | C5 | C6 | N | 117.0° | 120.3° |
| C9 | C5 | C6 | H1 | 122.7° | 120.3° |
| C9 | C5 | N | H1 | 120.9° | 119.4° |
| C9 | C5 | N | C4 | 97.7° | 84.4° |
| C9 | C5 | C6 | H2 | 66.4° | 169.8° |
| C9 | C5 | C6 | H3 | 175.1° | 50.1° |
| C5 | C9 | C8 | H7 | 61.1° | 176.5° |
| C5 | C9 | C8 | H8 | 178.5° | 56.4° |
| C9 | C5 | N | H10 | 82.3° | 95.6° |
| C5 | C9 | H44 | H45 | 118.1° | 119.7° |
| N5 | C | C1 | C10 | 179.9° | 179.7° |
| N5 | C | C1 | C2 | 0.0° | 0.0° |
| C | N5 | C40 | C11 | 0.3° | 0.0° |
| C | N5 | C40 | H40 | 179.7° | 179.9° |
| C | N5 | C41 | H41 | 180.0° | 0.1° |
| C | N5 | C41 | H42 | 60.0° | 120.0° |
| C | N5 | C41 | H43 | 60.0° | 120.0° |
| C1 | C | N5 | C40 | 0.3° | 0.0° |
| C | C1 | C10 | C2 | 179.9° | 179.7° |
| C | C1 | C10 | C3 | 179.8° | 179.8° |
| C | C1 | C2 | C11 | 0.2° | 0.0° |
| C | C1 | C2 | S | 180.0° | 180.0° |
| C | C1 | C10 | H11 | 0.2° | 0.4° |
| N5 | C40 | C11 | H40 | 180.0° | 179.9° |
| N5 | C40 | C11 | C2 | 0.1° | 0.0° |
| N5 | C40 | C11 | C12 | 179.3° | 180.0° |
| C40 | N5 | C41 | H41 | 0.2° | 179.9° |
| C40 | N5 | C41 | H42 | 120.3° | 60.0° |
| C40 | N5 | C41 | H43 | 119.8° | 60.0° |
| C1 | C10 | C3 | H11 | 180.0° | 179.5° |
| C1 | C10 | C3 | C4 | 178.9° | 179.9° |
| C1 | C10 | C3 | S | 0.3° | 0.5° |
| C10 | C1 | C2 | C11 | 179.9° | 179.7° |
| C10 | C1 | C2 | S | 0.1° | 0.2° |
| C3 | C10 | C1 | C2 | 0.2° | 0.5° |
| C10 | C3 | C4 | N | 40.5° | 179.7° |
| C10 | C3 | C4 | S | 178.5° | 179.6° |
| C10 | C3 | C4 | N1 | 139.7° | 0.4° |
| C10 | C3 | S | C2 | 0.3° | 0.3° |
| C7 | C6 | C5 | H2 | 120.7° | 120.1° |
| C7 | C6 | C5 | H3 | 120.7° | 120.1° |
| C7 | C6 | C5 | N | 171.4° | 169.7° |
| C7 | C6 | C5 | H1 | 68.3° | 50.3° |
| C7 | C6 | H2 | H3 | 117.7° | 119.7° |
| C6 | C7 | H5 | H6 | 120.6° | 120.2° |
| C1 | C2 | C11 | C40 | 0.1° | 0.1° |
| C1 | C2 | S | C3 | 0.2° | 0.0° |
| C1 | C2 | C11 | S | 179.8° | 179.9° |
| C1 | C2 | C11 | C12 | 179.5° | 180.0° |
| C2 | C1 | C10 | H11 | 179.8° | 179.9° |
| C6 | C5 | N | H1 | 119.5° | 119.5° |
| C6 | C5 | N | C4 | 142.7° | 154.4° |
| C5 | C6 | H2 | H3 | 117.7° | 119.8° |
| C5 | C6 | C7 | H5 | 177.1° | 56.2° |
| C5 | C6 | C7 | H6 | 62.5° | 176.4° |
| C6 | C5 | N | H10 | 37.3° | 25.6° |
| C6 | C5 | C9 | H44 | 175.4° | 50.2° |
| C6 | C5 | C9 | H45 | 65.8° | 169.8° |
| C5 | N | C4 | H10 | 180.0° | 180.0° |
| C5 | N | C4 | C3 | 168.4° | 180.0° |
| C5 | N | C4 | N1 | 11.8° | 0.0° |
| N | C5 | C6 | H2 | 50.7° | 49.6° |
| N | C5 | C6 | H3 | 67.8° | 70.2° |
| N | C5 | C9 | H44 | 68.8° | 70.1° |
| N | C5 | C9 | H45 | 50.0° | 49.5° |
| N | C4 | C3 | N1 | 179.7° | 179.9° |
| N | C4 | C3 | S | 138.0° | 0.1° |
| C4 | N | C5 | H1 | 23.2° | 35.0° |
| N | C4 | N1 | H4 | 179.7° | 180.0° |
| C40 | C11 | C2 | C12 | 179.4° | 179.9° |
| C40 | C11 | C2 | S | 179.9° | 179.9° |
| C40 | C11 | C12 | C39 | 46.1° | 115.0° |
| C40 | C11 | C12 | C13 | 133.0° | 64.7° |
| C4 | C3 | S | C2 | 179.1° | 180.0° |
| C3 | C4 | N1 | H4 | 0.0° | 0.1° |
| C3 | C4 | N | H10 | 11.6° | 0.0° |
| C4 | C3 | C10 | H11 | 1.1° | 0.4° |
| S | C3 | C4 | N1 | 41.7° | 180.0° |
| C3 | S | C2 | C11 | 180.0° | 179.9° |
| S | C3 | C10 | H11 | 179.7° | 179.9° |
| N1 | C4 | N | H10 | 168.2° | 180.0° |
| C2 | C11 | C12 | C39 | 133.3° | 65.0° |
| C2 | C11 | C12 | C13 | 47.6° | 115.4° |
| C2 | C11 | C40 | H40 | 179.9° | 179.9° |
| S | C2 | C11 | C12 | 0.7° | 0.1° |
| C11 | C12 | C39 | C13 | 179.1° | 179.7° |
| C11 | C12 | C39 | C38 | 180.0° | 179.8° |
| C11 | C12 | C13 | C14 | 179.7° | 180.0° |
| C11 | C12 | C13 | H12 | 0.2° | 0.1° |
| C11 | C12 | C39 | H39 | 0.0° | 0.1° |
| C12 | C11 | C40 | H40 | 0.7° | 0.1° |
| C12 | C39 | C38 | H39 | 180.0° | 179.7° |
| C39 | C12 | C13 | C14 | 1.1° | 0.3° |
| C12 | C39 | C38 | C16 | 0.6° | 0.6° |
| C39 | C12 | C13 | H12 | 178.9° | 179.7° |
| C12 | C39 | C38 | H38 | 179.3° | 179.7° |
| C13 | C12 | C39 | C38 | 0.9° | 0.6° |
| C12 | C13 | C14 | H12 | 180.0° | 180.0° |
| C12 | C13 | C14 | C16 | 1.1° | 0.0° |
| C12 | C13 | C14 | O3 | 179.8° | 180.0° |
| C13 | C12 | C39 | H39 | 179.1° | 179.7° |
| C39 | C38 | C16 | H38 | 180.0° | 179.7° |
| C39 | C38 | C16 | C14 | 0.5° | 0.3° |
| C39 | C38 | C16 | O4 | 179.9° | 179.7° |
| C13 | C14 | C16 | C38 | 0.8° | 0.0° |
| C13 | C14 | C16 | O3 | 178.7° | 180.0° |
| C13 | C14 | C16 | O4 | 179.7° | 180.0° |
| C13 | C14 | O3 | C15 | 62.2° | 0.0° |
| C38 | C16 | C14 | O4 | 179.5° | 180.0° |
| C38 | C16 | C14 | O3 | 179.5° | 180.0° |
| C38 | C16 | O4 | C17 | 113.8° | 0.0° |
| C16 | C38 | C39 | H39 | 179.4° | 179.7° |
| C16 | C14 | O3 | C15 | 116.6° | 180.0° |
| C14 | C16 | O4 | C17 | 65.7° | 180.0° |
| C16 | C14 | C13 | H12 | 178.9° | 180.0° |
| C14 | C16 | C38 | H38 | 179.4° | 180.0° |
| O3 | C14 | C16 | O4 | 0.9° | 0.0° |
| O3 | C14 | C13 | H12 | 0.2° | 0.0° |
| C14 | O3 | C15 | H13 | 180.0° | 180.0° |
| C14 | O3 | C15 | H14 | 60.0° | 60.0° |
| C14 | O3 | C15 | H15 | 60.0° | 60.0° |
| C16 | O4 | C17 | C18 | 163.1° | 180.0° |
| C16 | O4 | C17 | H16 | 43.0° | 60.0° |
| C16 | O4 | C17 | H17 | 76.7° | 60.0° |
| O4 | C16 | C38 | H38 | 0.1° | 0.0° |
| O3 | C15 | H13 | H14 | 120.0° | 120.0° |
| O3 | C15 | H13 | H15 | 120.0° | 120.0° |
| O3 | C15 | H14 | H15 | 120.0° | 120.0° |
| O4 | C17 | C18 | H16 | 120.1° | 120.0° |
| O4 | C17 | C18 | H17 | 120.1° | 120.0° |
| O4 | C17 | C18 | N2 | 67.9° | 180.0° |
| O4 | C17 | C18 | O10 | 112.3° | 0.0° |
| O4 | C17 | H16 | H17 | 119.6° | 119.9° |
| C17 | C18 | N2 | O10 | 179.7° | 179.9° |
| C17 | C18 | N2 | C19 | 176.8° | 180.0° |
| C17 | C18 | N2 | H9 | 3.2° | 0.0° |
| C18 | C17 | H16 | H17 | 119.6° | 120.0° |
| C18 | N2 | C19 | H9 | 180.0° | 180.0° |
| C18 | N2 | C19 | C20 | 134.2° | 180.0° |
| N2 | C18 | C17 | H16 | 172.0° | 60.0° |
| N2 | C18 | C17 | H17 | 52.2° | 60.0° |
| C18 | N2 | C19 | H18 | 13.7° | 60.0° |
| C18 | N2 | C19 | H19 | 105.4° | 60.0° |
| O10 | C18 | N2 | C19 | 2.9° | 0.0° |
| O10 | C18 | N2 | H9 | 177.1° | 180.0° |
| O10 | C18 | C17 | H16 | 7.8° | 120.0° |
| O10 | C18 | C17 | H17 | 127.5° | 120.0° |
| N2 | C19 | C20 | H18 | 120.5° | 120.0° |
| N2 | C19 | C20 | H19 | 120.5° | 120.1° |
| N2 | C19 | C20 | C21 | 136.9° | 180.0° |
| N2 | C19 | H18 | H19 | 118.6° | 120.0° |
| N2 | C19 | C20 | H20 | 102.9° | 60.0° |
| N2 | C19 | C20 | H21 | 16.6° | 60.0° |
| C19 | C20 | C21 | H20 | 120.2° | 120.0° |
| C19 | C20 | C21 | H21 | 120.2° | 120.1° |
| C19 | C20 | C21 | C22 | 61.5° | NaN° |
| C20 | C19 | N2 | H9 | 45.8° | 0.0° |
| C20 | C19 | H18 | H19 | 118.6° | 119.9° |
| C19 | C20 | H20 | H21 | 119.2° | 120.0° |
| C19 | C20 | C21 | H22 | 58.6° | 60.1° |
| C19 | C20 | C21 | H23 | 178.3° | 59.9° |
| C20 | C21 | C22 | H22 | 120.1° | 120.0° |
| C20 | C21 | C22 | H23 | 120.1° | 120.1° |
| C20 | C21 | C22 | C23 | 162.6° | 180.0° |
| C21 | C20 | C19 | H18 | 16.4° | 60.0° |
| C21 | C20 | C19 | H19 | 102.7° | 59.9° |
| C21 | C20 | H20 | H21 | 119.2° | 120.0° |
| C20 | C21 | H22 | H23 | 119.7° | 120.0° |
| C20 | C21 | C22 | H24 | 42.3° | 60.0° |
| C20 | C21 | C22 | H25 | 77.2° | 59.9° |
| C21 | C22 | C23 | H24 | 120.2° | 120.0° |
| C21 | C22 | C23 | H25 | 120.2° | 120.0° |
| C21 | C22 | C23 | C24 | 53.5° | 180.0° |
| C22 | C21 | C20 | H20 | 178.2° | 60.0° |
| C22 | C21 | C20 | H21 | 58.7° | 59.9° |
| C22 | C21 | H22 | H23 | 119.7° | 120.0° |
| C21 | C22 | H24 | H25 | 119.2° | 119.9° |
| C21 | C22 | C23 | H26 | 173.5° | 60.0° |
| C21 | C22 | C23 | H27 | 66.6° | 59.9° |
| C22 | C23 | C24 | H26 | 120.1° | 120.0° |
| C22 | C23 | C24 | H27 | 120.1° | 120.0° |
| C22 | C23 | C24 | O5 | 137.6° | 180.0° |
| C23 | C22 | C21 | H22 | 77.4° | 60.0° |
| C23 | C22 | C21 | H23 | 42.4° | 60.0° |
| C23 | C22 | H24 | H25 | 119.3° | 120.0° |
| C22 | C23 | H26 | H27 | 119.8° | 119.9° |
| C22 | C23 | C24 | H28 | 17.8° | 60.1° |
| C22 | C23 | C24 | H29 | 102.5° | 60.0° |
| C23 | C24 | O5 | H28 | 119.9° | 119.9° |
| C23 | C24 | O5 | H29 | 119.8° | 120.1° |
| C23 | C24 | O5 | C25 | 159.6° | 180.0° |
| C24 | C23 | C22 | H24 | 66.8° | 60.0° |
| C24 | C23 | C22 | H25 | 173.7° | 60.0° |
| C24 | C23 | H26 | H27 | 119.8° | 120.1° |
| C23 | C24 | H28 | H29 | 120.5° | 120.0° |
| C24 | O5 | C25 | C26 | 21.0° | 0.2° |
| C24 | O5 | C25 | C36 | 159.6° | 180.0° |
| O5 | C24 | C23 | H26 | 102.3° | 60.1° |
| O5 | C24 | C23 | H27 | 17.6° | 59.9° |
| O5 | C24 | H28 | H29 | 120.5° | 120.0° |
| C27 | C26 | C25 | H30 | 180.0° | 179.9° |
| C26 | C27 | C28 | H31 | 180.0° | 179.9° |
| C27 | C26 | C25 | O5 | 179.7° | 179.8° |
| C27 | C26 | C25 | C36 | 0.4° | 0.1° |
| C26 | C27 | C28 | C29 | 0.0° | 0.1° |
| C26 | C27 | C28 | H32 | 180.0° | 179.9° |
| C25 | C26 | C27 | C28 | 0.3° | 0.1° |
| C26 | C25 | O5 | C36 | 179.3° | 179.8° |
| C26 | C25 | C36 | C29 | 0.2° | 0.1° |
| C26 | C25 | C36 | C37 | 179.8° | 180.0° |
| C25 | C26 | C27 | H31 | 179.7° | 180.0° |
| C27 | C28 | C29 | H32 | 180.0° | 180.0° |
| C27 | C28 | C29 | C36 | 0.1° | 0.0° |
| C27 | C28 | C29 | C30 | 179.9° | 179.9° |
| C28 | C27 | C26 | H30 | 179.7° | 180.0° |
| O5 | C25 | C36 | C29 | 179.6° | 179.8° |
| O5 | C25 | C36 | C37 | 0.4° | 0.2° |
| C25 | O5 | C24 | H28 | 39.7° | 60.1° |
| C25 | O5 | C24 | H29 | 80.6° | 59.9° |
| O5 | C25 | C26 | H30 | 0.3° | 0.2° |
| C25 | C36 | C29 | C28 | 0.0° | 0.0° |
| C25 | C36 | C29 | C37 | 180.0° | 180.0° |
| C25 | C36 | C29 | C30 | 180.0° | 180.0° |
| C25 | C36 | C37 | O9 | 0.1° | 0.0° |
| C25 | C36 | C37 | N3 | 180.0° | 179.9° |
| C36 | C25 | C26 | H30 | 179.6° | 180.0° |
| C28 | C29 | C36 | C30 | 180.0° | 180.0° |
| C28 | C29 | C36 | C37 | 180.0° | 180.0° |
| C28 | C29 | C30 | N3 | 179.9° | 180.0° |
| C28 | C29 | C30 | O8 | 0.2° | 0.1° |
| C29 | C28 | C27 | H31 | 180.0° | 180.0° |
| C29 | C36 | C37 | O9 | 179.9° | 180.0° |
| C29 | C36 | C37 | N3 | 0.0° | 0.0° |
| C36 | C29 | C30 | N3 | 0.0° | 0.0° |
| C36 | C29 | C30 | O8 | 179.8° | 179.9° |
| C36 | C29 | C28 | H32 | 179.9° | 180.0° |
| C37 | C36 | C29 | C30 | 0.0° | 0.0° |
| C36 | C37 | O9 | N3 | 179.9° | 179.9° |
| C36 | C37 | N3 | C30 | 0.0° | 0.0° |
| C36 | C37 | N3 | C31 | 179.7° | 180.0° |
| C29 | C30 | N3 | C37 | 0.1° | 0.0° |
| C29 | C30 | N3 | O8 | 179.8° | 179.9° |
| C29 | C30 | N3 | C31 | 179.7° | 180.0° |
| C30 | C29 | C28 | H32 | 0.1° | 0.1° |
| O9 | C37 | N3 | C30 | 179.9° | 179.9° |
| O9 | C37 | N3 | C31 | 0.4° | 0.0° |
| C37 | N3 | C30 | C31 | 179.8° | 180.0° |
| C37 | N3 | C30 | O8 | 179.8° | 179.9° |
| C37 | N3 | C31 | C32 | 133.1° | 45.0° |
| C37 | N3 | C31 | C35 | 104.5° | 74.7° |
| C37 | N3 | C31 | H33 | 14.5° | 165.2° |
| O7 | C32 | C31 | N3 | 35.3° | 89.2° |
| O7 | C32 | C31 | N4 | 179.7° | 180.0° |
| O7 | C32 | C31 | C35 | 157.5° | 150.9° |
| O7 | C32 | N4 | C33 | 177.8° | 179.4° |
| O7 | C32 | C31 | H33 | 83.4° | 31.0° |
| O7 | C32 | N4 | H46 | 2.1° | 0.6° |
| C30 | N3 | C31 | C32 | 46.7° | 135.0° |
| C30 | N3 | C31 | C35 | 75.8° | 105.3° |
| C30 | N3 | C31 | H33 | 165.2° | 14.9° |
| O8 | C30 | N3 | C31 | 0.1° | 0.1° |
| N3 | C31 | C32 | C35 | 122.2° | 120.0° |
| N3 | C31 | C32 | H33 | 118.7° | 120.2° |
| N3 | C31 | C32 | N4 | 145.0° | 90.8° |
| N3 | C31 | C35 | H33 | 119.3° | 120.1° |
| N3 | C31 | C35 | C34 | 173.8° | 64.4° |
| N3 | C31 | C35 | H36 | 66.4° | 175.9° |
| N3 | C31 | C35 | H37 | 53.9° | 55.4° |
| C32 | C31 | C35 | H33 | 119.2° | 119.9° |
| C31 | C32 | N4 | C33 | 2.5° | 0.6° |
| C32 | C31 | C35 | C34 | 52.3° | 55.6° |
| C32 | C31 | C35 | H36 | 172.1° | 64.1° |
| C32 | C31 | C35 | H37 | 67.5° | 175.4° |
| C31 | C32 | N4 | H46 | 177.5° | 179.4° |
| N4 | C32 | C31 | C35 | 22.8° | 29.1° |
| C32 | N4 | C33 | H46 | 180.0° | 180.0° |
| C32 | N4 | C33 | C34 | 13.5° | 0.5° |
| C32 | N4 | C33 | O6 | 166.4° | 179.4° |
| N4 | C32 | C31 | H33 | 96.2° | 149.0° |
| C31 | C35 | C34 | H36 | 119.8° | 119.7° |
| C31 | C35 | C34 | H37 | 119.8° | 119.8° |
| C31 | C35 | C34 | C33 | 61.5° | 55.6° |
| C31 | C35 | C34 | H34 | 58.1° | 64.3° |
| C31 | C35 | C34 | H35 | 178.8° | 175.6° |
| C31 | C35 | H36 | H37 | 120.6° | 120.4° |
| N4 | C33 | C34 | C35 | 43.2° | 29.0° |
| N4 | C33 | C34 | O6 | 179.9° | 179.9° |
| N4 | C33 | C34 | H34 | 76.4° | 90.8° |
| N4 | C33 | C34 | H35 | 162.9° | 149.1° |
| C35 | C34 | C33 | H34 | 119.7° | 119.9° |
| C35 | C34 | C33 | H35 | 119.6° | 120.0° |
| C35 | C34 | C33 | O6 | 136.6° | 150.9° |
| C34 | C35 | C31 | H33 | 66.9° | 175.5° |
| C35 | C34 | H34 | H35 | 121.0° | 120.1° |
| C34 | C35 | H36 | H37 | 120.6° | 120.5° |
| C33 | C34 | H34 | H35 | 121.0° | 120.2° |
| C33 | C34 | C35 | H36 | 178.7° | 64.2° |
| C33 | C34 | C35 | H37 | 58.2° | 175.3° |
| C34 | C33 | N4 | H46 | 166.5° | 179.5° |
| O6 | C33 | C34 | H34 | 103.7° | 89.2° |
| O6 | C33 | C34 | H35 | 17.0° | 30.8° |
| O6 | C33 | N4 | H46 | 13.6° | 0.6° |
| H1 | C5 | C6 | H2 | 170.9° | 69.9° |
| H1 | C5 | C6 | H3 | 52.4° | 170.4° |
| H1 | C5 | N | H10 | 156.8° | 145.0° |
| H1 | C5 | C9 | H44 | 52.8° | 170.5° |
| H1 | C5 | C9 | H45 | 171.5° | 69.9° |
| H2 | C6 | C7 | H5 | 56.3° | 63.9° |
| H2 | C6 | C7 | H6 | 176.8° | 56.3° |
| H3 | C6 | C7 | H5 | 62.2° | 176.3° |
| H3 | C6 | C7 | H6 | 58.3° | 63.5° |
| H7 | C8 | C9 | H44 | 59.5° | 63.3° |
| H7 | C8 | C9 | H45 | 178.3° | 56.4° |
| H8 | C8 | C9 | H44 | 60.8° | 176.5° |
| H8 | C8 | C9 | H45 | 57.9° | 63.8° |
| H9 | N2 | C19 | H18 | 166.3° | 120.0° |
| H9 | N2 | C19 | H19 | 74.6° | 120.0° |
| H13 | C15 | H14 | H15 | 120.0° | 120.1° |
| H18 | C19 | C20 | H20 | 136.6° | 180.0° |
| H18 | C19 | C20 | H21 | 103.8° | 60.0° |
| H19 | C19 | C20 | H20 | 17.6° | 60.0° |
| H19 | C19 | C20 | H21 | 137.1° | 180.0° |
| H20 | C20 | C21 | H22 | 61.7° | 179.9° |
| H20 | C20 | C21 | H23 | 58.1° | 60.1° |
| H21 | C20 | C21 | H22 | 178.8° | 60.0° |
| H21 | C20 | C21 | H23 | 61.4° | 180.0° |
| H22 | C21 | C22 | H24 | 162.4° | 180.0° |
| H22 | C21 | C22 | H25 | 42.9° | 60.0° |
| H23 | C21 | C22 | H24 | 77.8° | 60.1° |
| H23 | C21 | C22 | H25 | 162.7° | 180.0° |
| H24 | C22 | C23 | H26 | 53.3° | 180.0° |
| H24 | C22 | C23 | H27 | 173.2° | 60.1° |
| H25 | C22 | C23 | H26 | 66.2° | 60.0° |
| H25 | C22 | C23 | H27 | 53.6° | 180.0° |
| H26 | C23 | C24 | H28 | 137.8° | 180.0° |
| H26 | C23 | C24 | H29 | 17.5° | 60.0° |
| H27 | C23 | C24 | H28 | 102.3° | 60.0° |
| H27 | C23 | C24 | H29 | 137.4° | 180.0° |
| H30 | C26 | C27 | H31 | 0.3° | 0.1° |
| H31 | C27 | C28 | H32 | 0.0° | 0.0° |
| H33 | C31 | C35 | H36 | 52.9° | 55.8° |
| H33 | C31 | C35 | H37 | 173.2° | 64.7° |
| H34 | C34 | C35 | H36 | 61.7° | 175.9° |
| H34 | C34 | C35 | H37 | 177.9° | 55.4° |
| H35 | C34 | C35 | H36 | 59.0° | 55.9° |
| H35 | C34 | C35 | H37 | 61.4° | 64.7° |
| H38 | C38 | C39 | H39 | 0.6° | 0.0° |
| H41 | C41 | H42 | H43 | 120.0° | 120.0° |
