PRD_002237
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | C11 | sing | 1.53Å | 1.50Å | |
| C28 | C29 | sing | 1.53Å | 1.57Å | |
| C28 | C27 | sing | 1.53Å | 1.56Å | |
| C30 | C29 | sing | 1.53Å | 1.57Å | |
| C32 | C27 | sing | 1.53Å | 1.54Å | |
| C32 | C33 | sing | 1.51Å | 1.43Å | |
| C34 | C33 | doub | 1.38Å | 1.42Å | Aromatic |
| C34 | C35 | sing | 1.38Å | 1.42Å | Aromatic |
| C26 | S1 | sing | 1.71Å | 1.76Å | Aromatic |
| C26 | C24 | doub | 1.35Å | 1.35Å | Aromatic |
| S1 | C23 | sing | 1.71Å | 1.68Å | Aromatic |
| C29 | C31 | sing | 1.51Å | 1.60Å | |
| O4 | C21 | doub | 1.21Å | 1.24Å | |
| N5 | C27 | sing | 1.46Å | 1.48Å | |
| N5 | C25 | sing | 1.35Å | 1.36Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C12 | C10 | sing | 1.53Å | 1.52Å | |
| C33 | C38 | sing | 1.38Å | 1.40Å | Aromatic |
| C35 | C36 | doub | 1.38Å | 1.41Å | Aromatic |
| C10 | C8 | sing | 1.53Å | 1.48Å | |
| C24 | C25 | sing | 1.47Å | 1.34Å | |
| C24 | N4 | sing | 1.34Å | 1.35Å | Aromatic |
| C21 | C22 | sing | 1.51Å | 1.57Å | |
| C21 | O3 | sing | 1.34Å | 1.43Å | |
| C25 | O5 | doub | 1.22Å | 1.25Å | |
| C23 | N4 | doub | 1.29Å | 1.34Å | Aromatic |
| C23 | C20 | sing | 1.51Å | 1.51Å | |
| C31 | O7 | doub | 1.21Å | 1.26Å | |
| C31 | O6 | sing | 1.34Å | 1.28Å | |
| C38 | C37 | doub | 1.38Å | 1.41Å | Aromatic |
| C36 | C37 | sing | 1.38Å | 1.41Å | Aromatic |
| C20 | O3 | sing | 1.45Å | 1.47Å | |
| C20 | C19 | sing | 1.53Å | 1.55Å | |
| C8 | N2 | sing | 1.47Å | 1.49Å | |
| C8 | C9 | sing | 1.51Å | 1.55Å | |
| N2 | C3 | sing | 1.35Å | 1.33Å | |
| C14 | N3 | sing | 1.46Å | 1.46Å | |
| C9 | N3 | sing | 1.35Å | 1.40Å | |
| C9 | O2 | doub | 1.21Å | 1.25Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C2 | sing | 1.53Å | 1.56Å | |
| O1 | C3 | doub | 1.21Å | 1.23Å | |
| C3 | C2 | sing | 1.51Å | 1.57Å | |
| N3 | C15 | sing | 1.46Å | 1.47Å | |
| C19 | C15 | sing | 1.53Å | 1.54Å | |
| C5 | C6 | sing | 1.53Å | 1.58Å | |
| C2 | N1 | sing | 1.47Å | 1.52Å | |
| C15 | C16 | sing | 1.53Å | 1.57Å | |
| C6 | C7 | sing | 1.53Å | 1.53Å | |
| N1 | C7 | sing | 1.47Å | 1.52Å | |
| N1 | C1 | sing | 1.47Å | 1.48Å | |
| C16 | C17 | sing | 1.53Å | 1.51Å | |
| C16 | C18 | sing | 1.53Å | 1.49Å | |
| C1 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| N2 | H13 | sing | 0.97Å | 1.00Å | |
| C8 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C13 | H21 | sing | 1.09Å | 1.10Å | |
| C13 | H22 | sing | 1.09Å | 1.10Å | |
| C13 | H23 | sing | 1.09Å | 1.10Å | |
| C14 | H24 | sing | 1.09Å | 1.10Å | |
| C14 | H25 | sing | 1.09Å | 1.10Å | |
| C14 | H26 | sing | 1.09Å | 1.10Å | |
| C15 | H27 | sing | 1.09Å | 1.10Å | |
| C16 | H28 | sing | 1.09Å | 1.10Å | |
| C17 | H29 | sing | 1.09Å | 1.10Å | |
| C17 | H30 | sing | 1.09Å | 1.10Å | |
| C17 | H31 | sing | 1.09Å | 1.10Å | |
| C18 | H32 | sing | 1.09Å | 1.10Å | |
| C18 | H33 | sing | 1.09Å | 1.10Å | |
| C18 | H34 | sing | 1.09Å | 1.10Å | |
| C19 | H35 | sing | 1.09Å | 1.10Å | |
| C19 | H36 | sing | 1.09Å | 1.10Å | |
| C20 | H37 | sing | 1.09Å | 1.10Å | |
| C22 | H38 | sing | 1.09Å | 1.10Å | |
| C22 | H39 | sing | 1.09Å | 1.10Å | |
| C22 | H40 | sing | 1.09Å | 1.10Å | |
| C26 | H41 | sing | 1.08Å | 1.08Å | |
| N5 | H42 | sing | 0.97Å | 1.00Å | |
| C27 | H43 | sing | 1.09Å | 1.10Å | |
| C28 | H44 | sing | 1.09Å | 1.10Å | |
| C28 | H45 | sing | 1.09Å | 1.10Å | |
| C29 | H46 | sing | 1.09Å | 1.10Å | |
| C30 | H47 | sing | 1.09Å | 1.10Å | |
| C30 | H48 | sing | 1.09Å | 1.10Å | |
| C30 | H49 | sing | 1.09Å | 1.10Å | |
| O6 | H50 | sing | 0.97Å | 0.95Å | |
| C32 | H51 | sing | 1.09Å | 1.10Å | |
| C32 | H52 | sing | 1.09Å | 1.10Å | |
| C34 | H53 | sing | 1.08Å | 1.08Å | |
| C35 | H54 | sing | 1.08Å | 1.08Å | |
| C36 | H55 | sing | 1.08Å | 1.08Å | |
| C37 | H56 | sing | 1.08Å | 1.08Å | |
| C38 | H57 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C11 | C10 | 112.0° | 109.5° |
| C13 | C11 | H16 | 108.9° | 109.4° |
| C13 | C11 | H17 | 108.9° | 109.4° |
| C11 | C13 | H21 | 109.5° | 109.4° |
| C11 | C13 | H22 | 109.5° | 109.5° |
| C11 | C13 | H23 | 109.5° | 109.4° |
| C29 | C28 | C27 | 116.8° | 109.4° |
| C28 | C29 | C30 | 113.6° | 109.5° |
| C28 | C29 | C31 | 118.4° | 109.4° |
| C29 | C28 | H44 | 107.6° | 109.5° |
| C29 | C28 | H45 | 107.6° | 109.5° |
| C28 | C29 | H46 | 103.7° | 109.5° |
| C28 | C27 | C32 | 113.3° | 109.4° |
| C28 | C27 | N5 | 111.5° | 109.5° |
| C28 | C27 | H43 | 108.1° | 109.4° |
| C27 | C28 | H44 | 107.6° | 109.5° |
| C27 | C28 | H45 | 107.6° | 109.4° |
| C30 | C29 | C31 | 111.7° | 109.4° |
| C30 | C29 | H46 | 103.8° | 109.5° |
| C29 | C30 | H47 | 109.5° | 109.5° |
| C29 | C30 | H48 | 109.5° | 109.5° |
| C29 | C30 | H49 | 109.5° | 109.5° |
| C27 | C32 | C33 | 109.4° | 109.5° |
| C32 | C27 | N5 | 106.5° | 109.5° |
| C32 | C27 | H43 | 108.3° | 109.5° |
| C27 | C32 | H51 | 109.5° | 109.4° |
| C27 | C32 | H52 | 109.5° | 109.5° |
| C32 | C33 | C34 | 122.3° | 120.0° |
| C32 | C33 | C38 | 121.8° | 120.0° |
| C33 | C32 | H51 | 109.5° | 109.4° |
| C33 | C32 | H52 | 109.5° | 109.5° |
| C33 | C34 | C35 | 124.7° | 120.0° |
| C34 | C33 | C38 | 115.9° | 120.0° |
| C33 | C34 | H53 | 117.6° | 120.0° |
| C34 | C35 | C36 | 118.2° | 120.0° |
| C35 | C34 | H53 | 117.6° | 120.0° |
| C34 | C35 | H54 | 120.9° | 120.0° |
| S1 | C26 | C24 | 107.3° | 108.9° |
| C26 | S1 | C23 | 91.8° | 91.1° |
| S1 | C26 | H41 | 126.4° | 125.6° |
| C26 | C24 | C25 | 121.6° | 123.2° |
| C26 | C24 | N4 | 115.9° | 113.7° |
| C24 | C26 | H41 | 126.4° | 125.6° |
| S1 | C23 | N4 | 111.6° | 110.6° |
| S1 | C23 | C20 | 122.6° | 124.7° |
| C29 | C31 | O7 | 113.3° | 120.0° |
| C29 | C31 | O6 | 121.8° | 120.0° |
| C31 | C29 | H46 | 103.5° | 109.5° |
| O4 | C21 | C22 | 117.7° | 120.0° |
| O4 | C21 | O3 | 126.0° | 120.0° |
| C27 | N5 | C25 | 123.4° | 120.0° |
| C27 | N5 | H42 | 118.3° | 120.0° |
| N5 | C27 | H43 | 109.1° | 109.5° |
| N5 | C25 | C24 | 113.8° | 120.0° |
| N5 | C25 | O5 | 125.2° | 120.0° |
| C25 | N5 | H42 | 118.3° | 120.0° |
| C11 | C10 | C12 | 110.5° | 109.5° |
| C11 | C10 | C8 | 100.7° | 109.5° |
| C11 | C10 | H15 | 111.4° | 109.5° |
| C10 | C11 | H16 | 108.8° | 109.5° |
| C10 | C11 | H17 | 108.8° | 109.5° |
| C12 | C10 | C8 | 110.1° | 109.4° |
| C12 | C10 | H15 | 111.5° | 109.5° |
| C10 | C12 | H18 | 109.5° | 109.5° |
| C10 | C12 | H19 | 109.5° | 109.5° |
| C10 | C12 | H20 | 109.4° | 109.5° |
| C33 | C38 | C37 | 120.3° | 120.0° |
| C33 | C38 | H57 | 119.9° | 120.0° |
| C35 | C36 | C37 | 117.7° | 120.0° |
| C36 | C35 | H54 | 120.9° | 120.0° |
| C35 | C36 | H55 | 121.1° | 120.0° |
| C10 | C8 | N2 | 115.6° | 109.5° |
| C10 | C8 | C9 | 115.5° | 109.5° |
| C10 | C8 | H14 | 99.4° | 109.5° |
| C8 | C10 | H15 | 112.1° | 109.4° |
| C25 | C24 | N4 | 122.3° | 123.1° |
| C24 | C25 | O5 | 120.4° | 119.9° |
| C24 | N4 | C23 | 113.3° | 115.8° |
| C22 | C21 | O3 | 116.3° | 120.0° |
| C21 | C22 | H38 | 109.5° | 109.4° |
| C21 | C22 | H39 | 109.5° | 109.5° |
| C21 | C22 | H40 | 109.5° | 109.5° |
| C21 | O3 | C20 | 125.6° | 117.0° |
| N4 | C23 | C20 | 125.5° | 124.7° |
| C23 | C20 | O3 | 106.1° | 109.5° |
| C23 | C20 | C19 | 117.1° | 109.5° |
| C23 | C20 | H37 | 107.7° | 109.4° |
| O7 | C31 | O6 | 124.3° | 120.0° |
| C31 | O6 | H50 | 109.5° | 117.0° |
| C38 | C37 | C36 | 123.1° | 120.0° |
| C38 | C37 | H56 | 118.4° | 120.0° |
| C37 | C38 | H57 | 119.8° | 120.0° |
| C37 | C36 | H55 | 121.1° | 120.1° |
| C36 | C37 | H56 | 118.4° | 120.0° |
| O3 | C20 | C19 | 110.1° | 109.5° |
| O3 | C20 | H37 | 108.3° | 109.5° |
| C20 | C19 | C15 | 105.0° | 109.5° |
| C20 | C19 | H35 | 110.5° | 109.5° |
| C20 | C19 | H36 | 110.6° | 109.5° |
| C19 | C20 | H37 | 107.2° | 109.5° |
| N2 | C8 | C9 | 121.2° | 109.5° |
| C8 | N2 | C3 | 131.4° | 120.0° |
| C8 | N2 | H13 | 114.3° | 119.9° |
| N2 | C8 | H14 | 99.4° | 109.4° |
| C8 | C9 | N3 | 126.8° | 120.0° |
| C8 | C9 | O2 | 110.9° | 120.0° |
| C9 | C8 | H14 | 99.1° | 109.5° |
| N2 | C3 | O1 | 123.6° | 120.0° |
| N2 | C3 | C2 | 115.3° | 120.0° |
| C3 | N2 | H13 | 114.3° | 120.0° |
| C14 | N3 | C9 | 124.2° | 120.0° |
| C14 | N3 | C15 | 118.5° | 120.0° |
| N3 | C14 | H24 | 109.5° | 109.5° |
| N3 | C14 | H25 | 109.5° | 109.5° |
| N3 | C14 | H26 | 109.5° | 109.4° |
| N3 | C9 | O2 | 122.2° | 120.0° |
| C9 | N3 | C15 | 117.2° | 120.0° |
| C5 | C4 | C2 | 111.9° | 109.3° |
| C4 | C5 | C6 | 116.0° | 109.2° |
| C4 | C5 | H5 | 107.8° | 109.5° |
| C4 | C5 | H4 | 107.8° | 109.5° |
| C5 | C4 | H2 | 108.9° | 109.5° |
| C5 | C4 | H3 | 108.9° | 109.5° |
| C4 | C2 | C3 | 109.9° | 109.4° |
| C4 | C2 | N1 | 112.6° | 109.5° |
| C2 | C4 | H2 | 108.9° | 109.5° |
| C2 | C4 | H3 | 108.9° | 109.5° |
| C4 | C2 | H1 | 104.2° | 109.5° |
| O1 | C3 | C2 | 120.9° | 120.0° |
| C3 | C2 | N1 | 119.7° | 109.5° |
| C3 | C2 | H1 | 104.1° | 109.4° |
| N3 | C15 | C19 | 112.1° | 109.5° |
| N3 | C15 | C16 | 116.4° | 109.5° |
| N3 | C15 | H27 | 102.6° | 109.5° |
| C19 | C15 | C16 | 118.6° | 109.5° |
| C19 | C15 | H27 | 102.1° | 109.5° |
| C15 | C19 | H35 | 110.6° | 109.5° |
| C15 | C19 | H36 | 110.6° | 109.4° |
| C5 | C6 | C7 | 113.3° | 109.3° |
| C5 | C6 | H6 | 108.5° | 109.5° |
| C5 | C6 | H7 | 108.5° | 109.5° |
| C6 | C5 | H5 | 107.8° | 109.6° |
| C6 | C5 | H4 | 107.8° | 109.5° |
| C2 | N1 | C7 | 114.7° | 111.2° |
| C2 | N1 | C1 | 112.2° | 110.9° |
| N1 | C2 | H1 | 104.6° | 109.5° |
| C15 | C16 | C17 | 116.6° | 109.5° |
| C15 | C16 | C18 | 112.9° | 109.5° |
| C16 | C15 | H27 | 101.8° | 109.5° |
| C15 | C16 | H28 | 104.3° | 109.5° |
| C6 | C7 | N1 | 114.6° | 109.5° |
| C6 | C7 | H8 | 108.2° | 109.5° |
| C6 | C7 | H9 | 108.2° | 109.5° |
| C7 | C6 | H6 | 108.5° | 109.5° |
| C7 | C6 | H7 | 108.5° | 109.5° |
| C7 | N1 | C1 | 107.7° | 111.0° |
| N1 | C7 | H8 | 108.2° | 109.5° |
| N1 | C7 | H9 | 108.2° | 109.5° |
| N1 | C1 | H10 | 109.5° | 109.5° |
| N1 | C1 | H11 | 109.5° | 109.5° |
| N1 | C1 | H12 | 109.5° | 109.5° |
| C17 | C16 | C18 | 111.8° | 109.5° |
| C17 | C16 | H28 | 104.8° | 109.5° |
| C16 | C17 | H29 | 109.5° | 109.5° |
| C16 | C17 | H30 | 109.5° | 109.4° |
| C16 | C17 | H31 | 109.5° | 109.4° |
| C18 | C16 | H28 | 105.0° | 109.4° |
| C16 | C18 | H32 | 109.5° | 109.4° |
| C16 | C18 | H33 | 109.5° | 109.5° |
| C16 | C18 | H34 | 109.5° | 109.5° |
| H10 | C1 | H11 | 109.5° | 109.5° |
| H10 | C1 | H12 | 109.4° | 109.4° |
| H11 | C1 | H12 | 109.5° | 109.4° |
| H8 | C7 | H9 | 109.5° | 109.5° |
| H6 | C6 | H7 | 109.5° | 109.6° |
| H5 | C5 | H4 | 109.5° | 109.5° |
| H2 | C4 | H3 | 109.5° | 109.6° |
| H18 | C12 | H19 | 109.4° | 109.4° |
| H18 | C12 | H20 | 109.5° | 109.4° |
| H19 | C12 | H20 | 109.5° | 109.5° |
| H16 | C11 | H17 | 109.5° | 109.5° |
| H21 | C13 | H22 | 109.5° | 109.5° |
| H21 | C13 | H23 | 109.4° | 109.5° |
| H22 | C13 | H23 | 109.5° | 109.5° |
| H24 | C14 | H25 | 109.5° | 109.5° |
| H24 | C14 | H26 | 109.4° | 109.5° |
| H25 | C14 | H26 | 109.5° | 109.4° |
| H29 | C17 | H30 | 109.5° | 109.5° |
| H29 | C17 | H31 | 109.4° | 109.5° |
| H30 | C17 | H31 | 109.5° | 109.5° |
| H32 | C18 | H33 | 109.5° | 109.5° |
| H32 | C18 | H34 | 109.4° | 109.4° |
| H33 | C18 | H34 | 109.5° | 109.5° |
| H35 | C19 | H36 | 109.5° | 109.4° |
| H38 | C22 | H39 | 109.5° | 109.5° |
| H38 | C22 | H40 | 109.5° | 109.4° |
| H39 | C22 | H40 | 109.4° | 109.5° |
| H44 | C28 | H45 | 109.5° | 109.5° |
| H47 | C30 | H48 | 109.5° | 109.5° |
| H47 | C30 | H49 | 109.5° | 109.5° |
| H48 | C30 | H49 | 109.5° | 109.4° |
| H51 | C32 | H52 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C11 | C10 | H16 | 120.4° | 120.0° |
| C13 | C11 | C10 | H17 | 120.4° | 120.0° |
| C13 | C11 | C10 | C12 | 62.5° | 170.4° |
| C13 | C11 | C10 | C8 | 178.9° | 69.7° |
| C13 | C11 | C10 | H15 | 62.1° | 50.3° |
| C13 | C11 | H16 | H17 | 118.9° | 120.0° |
| C11 | C13 | H21 | H22 | 120.0° | 120.0° |
| C11 | C13 | H21 | H23 | 120.0° | 119.9° |
| C11 | C13 | H22 | H23 | 120.0° | 120.0° |
| C29 | C28 | C27 | H44 | 121.1° | 120.1° |
| C29 | C28 | C27 | H45 | 121.1° | 120.0° |
| C28 | C29 | C30 | C31 | 137.1° | 119.9° |
| C28 | C29 | C30 | H46 | 112.0° | 120.1° |
| C29 | C28 | C27 | C32 | 131.0° | 175.0° |
| C28 | C29 | C31 | H46 | 114.1° | 120.0° |
| C29 | C28 | C27 | N5 | 108.8° | 64.9° |
| C28 | C29 | C31 | O7 | 83.9° | 0.1° |
| C28 | C29 | C31 | O6 | 104.3° | 180.0° |
| C29 | C28 | C27 | H43 | 11.1° | 55.1° |
| C29 | C28 | H44 | H45 | 116.7° | 120.1° |
| C28 | C29 | C30 | H47 | 180.0° | 180.0° |
| C28 | C29 | C30 | H48 | 60.0° | 60.0° |
| C28 | C29 | C30 | H49 | 60.0° | 59.9° |
| C27 | C28 | C29 | C30 | 139.0° | 65.1° |
| C28 | C27 | C32 | N5 | 122.9° | 120.0° |
| C28 | C27 | C32 | H43 | 119.8° | 119.9° |
| C28 | C27 | C32 | C33 | 169.5° | 175.0° |
| C27 | C28 | C29 | C31 | 4.9° | 175.0° |
| C28 | C27 | N5 | H43 | 119.2° | 120.0° |
| C28 | C27 | N5 | C25 | 108.4° | 85.0° |
| C28 | C27 | N5 | H42 | 71.6° | 95.0° |
| C27 | C28 | H44 | H45 | 116.7° | 119.9° |
| C27 | C28 | C29 | H46 | 109.0° | 55.0° |
| C28 | C27 | C32 | H51 | 49.5° | 65.1° |
| C28 | C27 | C32 | H52 | 70.5° | 54.9° |
| C30 | C29 | C31 | H46 | 111.1° | 120.0° |
| C30 | C29 | C31 | O7 | 141.3° | 120.0° |
| C30 | C29 | C31 | O6 | 30.5° | 60.1° |
| C30 | C29 | C28 | H44 | 17.9° | 55.0° |
| C30 | C29 | C28 | H45 | 99.9° | 175.0° |
| C29 | C30 | H47 | H48 | 120.0° | 120.0° |
| C29 | C30 | H47 | H49 | 120.0° | 120.1° |
| C29 | C30 | H48 | H49 | 120.0° | 120.0° |
| C27 | C32 | C33 | H51 | 120.0° | 119.9° |
| C27 | C32 | C33 | H52 | 120.0° | 120.1° |
| C27 | C32 | C33 | C34 | 103.5° | 89.7° |
| C32 | C27 | N5 | H43 | 116.7° | 120.0° |
| C32 | C27 | N5 | C25 | 127.5° | 155.0° |
| C27 | C32 | C33 | C38 | 77.5° | 89.9° |
| C32 | C27 | N5 | H42 | 52.5° | 25.0° |
| C32 | C27 | C28 | H44 | 107.9° | 54.9° |
| C32 | C27 | C28 | H45 | 10.0° | 65.0° |
| C27 | C32 | H51 | H52 | 120.1° | 120.0° |
| C32 | C33 | C34 | C38 | 179.0° | 179.7° |
| C32 | C33 | C34 | C35 | 178.8° | 180.0° |
| C33 | C32 | C27 | N5 | 46.6° | 65.0° |
| C32 | C33 | C38 | C37 | 179.4° | 179.8° |
| C33 | C32 | C27 | H43 | 70.6° | 55.1° |
| C33 | C32 | H51 | H52 | 120.0° | 120.0° |
| C32 | C33 | C34 | H53 | 1.2° | 0.1° |
| C32 | C33 | C38 | H57 | 0.6° | 0.0° |
| C33 | C34 | C35 | H53 | 180.0° | 180.0° |
| C33 | C34 | C35 | C36 | 1.3° | 0.0° |
| C34 | C33 | C38 | C37 | 1.5° | 0.5° |
| C34 | C33 | C32 | H51 | 16.5° | 150.3° |
| C34 | C33 | C32 | H52 | 136.5° | 30.3° |
| C33 | C34 | C35 | H54 | 178.7° | 180.0° |
| C34 | C33 | C38 | H57 | 178.5° | 179.7° |
| C35 | C34 | C33 | C38 | 2.1° | 0.3° |
| C34 | C35 | C36 | H54 | 180.0° | 179.9° |
| C34 | C35 | C36 | C37 | 0.2° | 0.1° |
| C34 | C35 | C36 | H55 | 179.8° | 180.0° |
| S1 | C26 | C24 | H41 | 180.0° | 179.7° |
| S1 | C26 | C24 | C25 | 176.1° | 179.8° |
| S1 | C26 | C24 | N4 | 0.4° | 0.3° |
| C26 | S1 | C23 | N4 | 1.5° | 0.3° |
| C26 | S1 | C23 | C20 | 175.8° | 180.0° |
| C24 | C26 | S1 | C23 | 1.1° | 0.3° |
| C26 | C24 | C25 | N5 | 12.0° | 180.0° |
| C26 | C24 | C25 | N4 | 175.4° | 180.0° |
| C26 | C24 | C25 | O5 | 159.7° | 0.0° |
| C26 | C24 | N4 | C23 | 0.7° | 0.0° |
| S1 | C23 | N4 | C24 | 1.6° | 0.2° |
| S1 | C23 | N4 | C20 | 174.1° | 179.7° |
| S1 | C23 | C20 | O3 | 120.2° | 44.7° |
| S1 | C23 | C20 | C19 | 116.4° | 75.3° |
| S1 | C23 | C20 | H37 | 4.4° | 164.7° |
| C23 | S1 | C26 | H41 | 178.9° | 180.0° |
| C29 | C31 | O7 | O6 | 171.6° | 179.9° |
| C31 | C29 | C28 | H44 | 116.1° | 65.0° |
| C31 | C29 | C28 | H45 | 126.0° | 55.1° |
| C31 | C29 | C30 | H47 | 42.9° | 60.0° |
| C31 | C29 | C30 | H48 | 162.8° | 180.0° |
| C31 | C29 | C30 | H49 | 77.2° | 60.0° |
| C29 | C31 | O6 | H50 | 170.9° | 180.0° |
| O4 | C21 | C22 | O3 | 177.6° | 180.0° |
| O4 | C21 | O3 | C20 | 14.6° | 2.3° |
| O4 | C21 | C22 | H38 | 0.0° | 90.1° |
| O4 | C21 | C22 | H39 | 120.0° | 30.0° |
| O4 | C21 | C22 | H40 | 120.0° | 150.0° |
| C27 | N5 | C25 | H42 | 180.0° | 180.0° |
| C27 | N5 | C25 | C24 | 176.5° | 180.0° |
| C27 | N5 | C25 | O5 | 5.2° | 0.1° |
| N5 | C27 | C28 | H44 | 12.3° | 175.0° |
| N5 | C27 | C28 | H45 | 130.1° | 55.0° |
| N5 | C27 | C32 | H51 | 73.4° | 55.0° |
| N5 | C27 | C32 | H52 | 166.5° | 175.0° |
| N5 | C25 | C24 | O5 | 171.7° | 180.0° |
| N5 | C25 | C24 | N4 | 172.5° | 0.0° |
| C25 | N5 | C27 | H43 | 10.9° | 35.0° |
| C11 | C10 | C12 | C8 | 110.3° | 120.0° |
| C11 | C10 | C12 | H15 | 124.5° | 120.0° |
| C11 | C10 | C8 | H15 | 118.5° | 120.0° |
| C11 | C10 | C8 | N2 | 54.7° | 172.7° |
| C11 | C10 | C8 | C9 | 155.4° | 67.2° |
| C11 | C10 | C8 | H14 | 50.6° | 52.8° |
| C11 | C10 | C12 | H18 | 180.0° | 176.7° |
| C11 | C10 | C12 | H19 | 60.0° | 63.3° |
| C11 | C10 | C12 | H20 | 60.0° | 56.7° |
| C10 | C11 | H16 | H17 | 118.8° | 120.0° |
| C10 | C11 | C13 | H21 | 180.0° | 64.8° |
| C10 | C11 | C13 | H22 | 60.0° | 175.2° |
| C10 | C11 | C13 | H23 | 60.0° | 55.2° |
| C12 | C10 | C8 | H15 | 124.8° | 120.0° |
| C12 | C10 | C8 | N2 | 171.3° | 67.2° |
| C12 | C10 | C8 | C9 | 38.8° | 52.8° |
| C12 | C10 | C8 | H14 | 66.1° | 172.8° |
| C10 | C12 | H18 | H19 | 120.0° | 120.0° |
| C10 | C12 | H18 | H20 | 120.0° | 120.0° |
| C10 | C12 | H19 | H20 | 120.0° | 120.0° |
| C12 | C10 | C11 | H16 | 57.9° | 69.7° |
| C12 | C10 | C11 | H17 | 177.1° | 50.4° |
| C33 | C38 | C37 | H57 | 180.0° | 179.8° |
| C33 | C38 | C37 | C36 | 0.2° | 0.4° |
| C38 | C33 | C32 | H51 | 162.5° | 30.0° |
| C38 | C33 | C32 | H52 | 42.5° | 150.0° |
| C38 | C33 | C34 | H53 | 177.9° | 179.8° |
| C33 | C38 | C37 | H56 | 179.8° | 179.7° |
| C35 | C36 | C37 | C38 | 0.7° | 0.1° |
| C35 | C36 | C37 | H55 | 180.0° | 179.9° |
| C36 | C35 | C34 | H53 | 178.7° | 180.0° |
| C35 | C36 | C37 | H56 | 179.3° | 180.0° |
| C10 | C8 | N2 | C9 | 148.0° | 120.0° |
| C10 | C8 | N2 | H14 | 105.3° | 120.0° |
| C10 | C8 | C9 | H14 | 105.1° | 120.0° |
| C10 | C8 | N2 | C3 | 78.5° | 81.4° |
| C10 | C8 | C9 | N3 | 63.4° | 113.6° |
| C10 | C8 | C9 | O2 | 113.9° | 66.4° |
| C10 | C8 | N2 | H13 | 101.6° | 98.5° |
| C8 | C10 | C12 | H18 | 69.7° | 56.7° |
| C8 | C10 | C12 | H19 | 170.3° | 176.7° |
| C8 | C10 | C12 | H20 | 50.3° | 63.3° |
| C8 | C10 | C11 | H16 | 58.4° | 50.3° |
| C8 | C10 | C11 | H17 | 60.8° | 170.4° |
| C25 | C24 | N4 | C23 | 174.9° | 180.0° |
| C25 | C24 | C26 | H41 | 3.9° | 0.0° |
| C24 | C25 | N5 | H42 | 3.5° | 0.0° |
| N4 | C24 | C25 | O5 | 15.8° | 179.9° |
| C24 | N4 | C23 | C20 | 175.7° | 179.9° |
| N4 | C24 | C26 | H41 | 179.6° | 180.0° |
| C22 | C21 | O3 | C20 | 168.0° | 177.8° |
| C21 | C22 | H38 | H39 | 120.0° | 120.0° |
| C21 | C22 | H38 | H40 | 120.0° | 120.0° |
| C21 | C22 | H39 | H40 | 120.0° | 120.0° |
| C21 | O3 | C20 | C23 | 43.7° | 139.3° |
| C21 | O3 | C20 | C19 | 171.4° | 100.7° |
| C21 | O3 | C20 | H37 | 71.7° | 19.3° |
| O3 | C21 | C22 | H38 | 177.6° | 90.0° |
| O3 | C21 | C22 | H39 | 62.4° | 150.0° |
| O3 | C21 | C22 | H40 | 57.6° | 30.0° |
| O5 | C25 | N5 | H42 | 174.8° | 180.0° |
| N4 | C23 | C20 | O3 | 53.3° | 134.9° |
| N4 | C23 | C20 | C19 | 70.0° | 105.0° |
| N4 | C23 | C20 | H37 | 169.1° | 15.0° |
| C23 | C20 | O3 | C19 | 127.6° | 120.0° |
| C23 | C20 | O3 | H37 | 115.4° | 120.0° |
| C23 | C20 | C19 | H37 | 121.1° | 119.9° |
| C23 | C20 | C19 | C15 | 164.9° | 173.3° |
| C23 | C20 | C19 | H35 | 75.8° | 66.7° |
| C23 | C20 | C19 | H36 | 45.6° | 53.3° |
| O7 | C31 | C29 | H46 | 30.2° | 120.0° |
| O7 | C31 | O6 | H50 | 0.0° | 0.1° |
| O6 | C31 | C29 | H46 | 141.6° | 60.0° |
| C38 | C37 | C36 | H56 | 180.0° | 179.9° |
| C38 | C37 | C36 | H55 | 179.3° | 179.8° |
| C37 | C36 | C35 | H54 | 179.8° | 180.0° |
| C36 | C37 | C38 | H57 | 179.8° | 179.8° |
| O3 | C20 | C19 | H37 | 117.6° | 120.0° |
| O3 | C20 | C19 | C15 | 43.6° | 66.7° |
| O3 | C20 | C19 | H35 | 162.9° | 53.3° |
| O3 | C20 | C19 | H36 | 75.7° | 173.3° |
| C20 | C19 | C15 | N3 | 67.7° | 54.0° |
| C20 | C19 | C15 | H35 | 119.3° | 120.0° |
| C20 | C19 | C15 | H36 | 119.3° | 120.0° |
| C20 | C19 | C15 | C16 | 152.2° | 173.9° |
| C20 | C19 | C15 | H27 | 41.4° | 66.0° |
| C20 | C19 | H35 | H36 | 122.0° | 120.0° |
| N2 | C8 | C9 | H14 | 106.9° | 120.0° |
| C8 | N2 | C3 | H13 | 180.0° | 179.9° |
| N2 | C8 | C9 | N3 | 84.7° | 126.4° |
| N2 | C8 | C9 | O2 | 98.0° | 53.6° |
| C8 | N2 | C3 | O1 | 7.2° | 5.0° |
| C8 | N2 | C3 | C2 | 177.6° | 175.0° |
| N2 | C8 | C10 | H15 | 63.8° | 52.7° |
| C9 | C8 | N2 | C3 | 69.6° | 158.6° |
| C8 | C9 | N3 | C14 | 2.6° | 2.7° |
| C8 | C9 | N3 | O2 | 177.0° | 180.0° |
| C8 | C9 | N3 | C15 | 172.7° | 177.4° |
| C9 | C8 | N2 | H13 | 110.4° | 21.5° |
| C9 | C8 | C10 | H15 | 86.1° | 172.7° |
| N2 | C3 | C2 | C4 | 35.2° | 80.0° |
| N2 | C3 | O1 | C2 | 175.0° | 180.0° |
| N2 | C3 | C2 | N1 | 97.5° | 160.0° |
| N2 | C3 | C2 | H1 | 146.3° | 40.0° |
| C3 | N2 | C8 | H14 | 176.2° | 38.6° |
| C14 | N3 | C9 | C15 | 175.2° | 180.0° |
| C14 | N3 | C9 | O2 | 179.6° | 177.4° |
| C14 | N3 | C15 | C19 | 39.9° | 150.1° |
| C14 | N3 | C15 | C16 | 101.2° | 89.9° |
| N3 | C14 | H24 | H25 | 120.0° | 120.0° |
| N3 | C14 | H24 | H26 | 120.0° | 120.0° |
| N3 | C14 | H25 | H26 | 120.0° | 119.9° |
| C14 | N3 | C15 | H27 | 148.6° | 30.1° |
| C9 | N3 | C15 | C19 | 135.6° | 29.9° |
| C9 | N3 | C15 | C16 | 83.3° | 90.0° |
| N3 | C9 | C8 | H14 | 168.5° | 6.5° |
| C9 | N3 | C14 | H24 | 180.0° | 88.5° |
| C9 | N3 | C14 | H25 | 60.0° | 151.5° |
| C9 | N3 | C14 | H26 | 60.0° | 31.6° |
| C9 | N3 | C15 | H27 | 26.9° | 149.9° |
| O2 | C9 | N3 | C15 | 4.3° | 2.6° |
| O2 | C9 | C8 | H14 | 8.8° | 173.5° |
| C5 | C4 | C2 | H2 | 120.4° | 119.9° |
| C5 | C4 | C2 | H3 | 120.4° | 119.9° |
| C5 | C4 | C2 | C3 | 176.4° | 179.2° |
| C4 | C5 | C6 | H5 | 120.9° | 119.9° |
| C4 | C5 | C6 | H4 | 120.9° | 119.9° |
| C5 | C4 | C2 | N1 | 47.4° | 59.2° |
| C4 | C5 | C6 | C7 | 45.0° | 57.7° |
| C4 | C5 | C6 | H6 | 165.6° | 62.3° |
| C4 | C5 | C6 | H7 | 75.6° | 177.6° |
| C4 | C5 | H5 | H4 | 117.0° | 120.2° |
| C5 | C4 | H2 | H3 | 118.9° | 120.1° |
| C5 | C4 | C2 | H1 | 65.3° | 60.9° |
| C4 | C2 | C3 | O1 | 140.2° | 100.1° |
| C4 | C2 | C3 | N1 | 132.6° | 120.0° |
| C4 | C2 | C3 | H1 | 111.1° | 119.9° |
| C2 | C4 | C5 | C6 | 1.9° | 57.7° |
| C4 | C2 | N1 | H1 | 112.5° | 120.0° |
| C4 | C2 | N1 | C7 | 55.7° | 61.8° |
| C4 | C2 | N1 | C1 | 178.9° | 174.2° |
| C2 | C4 | C5 | H5 | 119.1° | 62.3° |
| C2 | C4 | C5 | H4 | 122.8° | 177.6° |
| C2 | C4 | H2 | H3 | 118.9° | 120.2° |
| O1 | C3 | C2 | N1 | 87.1° | 20.0° |
| O1 | C3 | C2 | H1 | 29.1° | 140.0° |
| O1 | C3 | N2 | H13 | 172.9° | 175.0° |
| C3 | C2 | N1 | H1 | 116.0° | 120.0° |
| C3 | C2 | N1 | C7 | 172.8° | 178.2° |
| C3 | C2 | N1 | C1 | 49.6° | 54.2° |
| C3 | C2 | C4 | H2 | 56.0° | 59.3° |
| C3 | C2 | C4 | H3 | 63.3° | 60.9° |
| C2 | C3 | N2 | H13 | 2.4° | 4.9° |
| N3 | C15 | C19 | C16 | 140.1° | 120.0° |
| N3 | C15 | C19 | H27 | 109.1° | 120.0° |
| N3 | C15 | C16 | H27 | 110.7° | 120.0° |
| N3 | C15 | C16 | C17 | 5.4° | 61.3° |
| N3 | C15 | C16 | C18 | 137.0° | 58.7° |
| C15 | N3 | C14 | H24 | 4.8° | 91.5° |
| C15 | N3 | C14 | H25 | 124.8° | 28.5° |
| C15 | N3 | C14 | H26 | 115.2° | 148.5° |
| N3 | C15 | C16 | H28 | 109.6° | 178.7° |
| N3 | C15 | C19 | H35 | 51.5° | 174.0° |
| N3 | C15 | C19 | H36 | 173.0° | 66.1° |
| C19 | C15 | C16 | H27 | 110.9° | 120.0° |
| C19 | C15 | C16 | C17 | 133.0° | 178.7° |
| C19 | C15 | C16 | C18 | 1.4° | 61.3° |
| C19 | C15 | C16 | H28 | 112.0° | 58.7° |
| C15 | C19 | H35 | H36 | 122.1° | 119.9° |
| C15 | C19 | C20 | H37 | 74.0° | 53.3° |
| C5 | C6 | C7 | H6 | 120.6° | 119.9° |
| C5 | C6 | C7 | H7 | 120.6° | 119.9° |
| C5 | C6 | C7 | N1 | 37.9° | 59.2° |
| C5 | C6 | C7 | H8 | 82.9° | 60.8° |
| C5 | C6 | C7 | H9 | 158.6° | 179.2° |
| C5 | C6 | H6 | H7 | 118.2° | 120.1° |
| C6 | C5 | H5 | H4 | 117.0° | 120.1° |
| C6 | C5 | C4 | H2 | 118.5° | 62.2° |
| C6 | C5 | C4 | H3 | 122.2° | 177.6° |
| C2 | N1 | C7 | C6 | 10.8° | 61.8° |
| C2 | N1 | C7 | C1 | 125.7° | 124.0° |
| C2 | N1 | C1 | H10 | 180.0° | 60.3° |
| C2 | N1 | C1 | H11 | 60.0° | 59.8° |
| C2 | N1 | C1 | H12 | 60.0° | 179.8° |
| C2 | N1 | C7 | H8 | 131.6° | 58.2° |
| C2 | N1 | C7 | H9 | 109.9° | 178.2° |
| N1 | C2 | C4 | H2 | 167.8° | 60.7° |
| N1 | C2 | C4 | H3 | 72.9° | 179.1° |
| C15 | C16 | C17 | C18 | 132.0° | 120.0° |
| C15 | C16 | C17 | H28 | 114.7° | 120.0° |
| C15 | C16 | C18 | H28 | 113.0° | 120.0° |
| C15 | C16 | C17 | H29 | 180.0° | 174.1° |
| C15 | C16 | C17 | H30 | 60.0° | 54.1° |
| C15 | C16 | C17 | H31 | 60.0° | 65.9° |
| C15 | C16 | C18 | H32 | 180.0° | 55.8° |
| C15 | C16 | C18 | H33 | 60.0° | 175.8° |
| C15 | C16 | C18 | H34 | 60.0° | 64.2° |
| C16 | C15 | C19 | H35 | 88.6° | 66.0° |
| C16 | C15 | C19 | H36 | 32.9° | 53.9° |
| C6 | C7 | N1 | H8 | 120.7° | 120.0° |
| C6 | C7 | N1 | H9 | 120.8° | 120.0° |
| C6 | C7 | N1 | C1 | 136.5° | 174.2° |
| C6 | C7 | H8 | H9 | 117.7° | 120.0° |
| C7 | C6 | H6 | H7 | 118.2° | 120.1° |
| C7 | C6 | C5 | H5 | 75.9° | 62.2° |
| C7 | C6 | C5 | H4 | 165.9° | 177.6° |
| C7 | N1 | C1 | H10 | 52.9° | 63.9° |
| C7 | N1 | C1 | H11 | 67.2° | 176.0° |
| C7 | N1 | C1 | H12 | 172.9° | 56.1° |
| N1 | C7 | H8 | H9 | 117.7° | 120.0° |
| N1 | C7 | C6 | H6 | 158.5° | 60.7° |
| N1 | C7 | C6 | H7 | 82.7° | 179.1° |
| C7 | N1 | C2 | H1 | 56.8° | 58.2° |
| N1 | C1 | H10 | H11 | 120.0° | 120.1° |
| N1 | C1 | H10 | H12 | 120.0° | 120.0° |
| N1 | C1 | H11 | H12 | 120.0° | 120.0° |
| C1 | N1 | C7 | H8 | 102.8° | 65.8° |
| C1 | N1 | C7 | H9 | 15.7° | 54.2° |
| C1 | N1 | C2 | H1 | 66.4° | 65.8° |
| C17 | C16 | C18 | H28 | 113.1° | 120.0° |
| C17 | C16 | C15 | H27 | 116.1° | 58.7° |
| C16 | C17 | H29 | H30 | 120.0° | 120.0° |
| C16 | C17 | H29 | H31 | 120.0° | 120.0° |
| C16 | C17 | H30 | H31 | 120.0° | 120.0° |
| C17 | C16 | C18 | H32 | 46.1° | 175.8° |
| C17 | C16 | C18 | H33 | 73.9° | 64.2° |
| C17 | C16 | C18 | H34 | 166.1° | 55.9° |
| C18 | C16 | C15 | H27 | 112.3° | 178.7° |
| C18 | C16 | C17 | H29 | 47.9° | 65.8° |
| C18 | C16 | C17 | H30 | 168.0° | 174.1° |
| C18 | C16 | C17 | H31 | 72.0° | 54.2° |
| C16 | C18 | H32 | H33 | 120.0° | 120.1° |
| C16 | C18 | H32 | H34 | 120.0° | 120.0° |
| C16 | C18 | H33 | H34 | 120.0° | 120.0° |
| H10 | C1 | H11 | H12 | 120.0° | 120.0° |
| H8 | C7 | C6 | H6 | 37.7° | 179.3° |
| H8 | C7 | C6 | H7 | 156.6° | 59.1° |
| H9 | C7 | C6 | H6 | 80.8° | 59.2° |
| H9 | C7 | C6 | H7 | 38.1° | 60.9° |
| H6 | C6 | C5 | H5 | 44.7° | 177.8° |
| H6 | C6 | C5 | H4 | 73.4° | 57.6° |
| H7 | C6 | C5 | H5 | 163.5° | 57.6° |
| H7 | C6 | C5 | H4 | 45.4° | 62.5° |
| H5 | C5 | C4 | H2 | 120.6° | 177.8° |
| H5 | C5 | C4 | H3 | 1.3° | 57.7° |
| H4 | C5 | C4 | H2 | 2.5° | 57.6° |
| H4 | C5 | C4 | H3 | 116.8° | 62.5° |
| H2 | C4 | C2 | H1 | 55.1° | 179.3° |
| H3 | C4 | C2 | H1 | 174.3° | 59.1° |
| H13 | N2 | C8 | H14 | 3.7° | 141.5° |
| H14 | C8 | C10 | H15 | 169.1° | 67.2° |
| H15 | C10 | C12 | H18 | 55.5° | 63.3° |
| H15 | C10 | C12 | H19 | 64.5° | 56.7° |
| H15 | C10 | C12 | H20 | 175.5° | 176.7° |
| H15 | C10 | C11 | H16 | 177.5° | 170.3° |
| H15 | C10 | C11 | H17 | 58.3° | 69.6° |
| H18 | C12 | H19 | H20 | 120.0° | 119.9° |
| H16 | C11 | C13 | H21 | 59.6° | 55.3° |
| H16 | C11 | C13 | H22 | 60.4° | 64.7° |
| H16 | C11 | C13 | H23 | 179.6° | 175.2° |
| H17 | C11 | C13 | H21 | 59.6° | 175.2° |
| H17 | C11 | C13 | H22 | 179.6° | 55.2° |
| H17 | C11 | C13 | H23 | 60.4° | 64.8° |
| H21 | C13 | H22 | H23 | 120.0° | 120.0° |
| H24 | C14 | H25 | H26 | 120.0° | 120.0° |
| H27 | C15 | C16 | H28 | 1.1° | 61.3° |
| H27 | C15 | C19 | H35 | 160.6° | 54.0° |
| H27 | C15 | C19 | H36 | 77.9° | 174.0° |
| H28 | C16 | C17 | H29 | 65.3° | 54.1° |
| H28 | C16 | C17 | H30 | 54.7° | 65.9° |
| H28 | C16 | C17 | H31 | 174.7° | 174.1° |
| H28 | C16 | C18 | H32 | 67.0° | 64.2° |
| H28 | C16 | C18 | H33 | 173.0° | 55.8° |
| H28 | C16 | C18 | H34 | 53.0° | 175.8° |
| H29 | C17 | H30 | H31 | 120.0° | 120.0° |
| H32 | C18 | H33 | H34 | 119.9° | 120.0° |
| H35 | C19 | C20 | H37 | 45.3° | 173.3° |
| H36 | C19 | C20 | H37 | 166.7° | 66.7° |
| H38 | C22 | H39 | H40 | 120.0° | 120.0° |
| H42 | N5 | C27 | H43 | 169.1° | 145.0° |
| H43 | C27 | C28 | H44 | 132.1° | 65.0° |
| H43 | C27 | C28 | H45 | 110.0° | 175.0° |
| H43 | C27 | C32 | H51 | 169.4° | 175.0° |
| H43 | C27 | C32 | H52 | 49.3° | 65.0° |
| H44 | C28 | C29 | H46 | 129.9° | 175.0° |
| H45 | C28 | C29 | H46 | 12.0° | 64.9° |
| H46 | C29 | C30 | H47 | 68.0° | 60.0° |
| H46 | C29 | C30 | H48 | 51.9° | 60.0° |
| H46 | C29 | C30 | H49 | 171.9° | 180.0° |
| H47 | C30 | H48 | H49 | 120.0° | 120.0° |
| H53 | C34 | C35 | H54 | 1.3° | 0.0° |
| H54 | C35 | C36 | H55 | 0.2° | 0.0° |
| H55 | C36 | C37 | H56 | 0.7° | 0.1° |
| H56 | C37 | C38 | H57 | 0.2° | 0.1° |
