PRD_000925
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | doub | 1.21Å | 1.22Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| O2 | C4 | doub | 1.21Å | 1.22Å | |
| C4 | C3 | sing | 1.51Å | 1.49Å | |
| C3 | N1 | sing | 1.46Å | 1.49Å | |
| C3 | C5 | sing | 1.53Å | 1.52Å | |
| N2 | C7 | doub | 1.32Å | 1.35Å | Aromatic |
| N2 | C8 | sing | 1.32Å | 1.34Å | Aromatic |
| C7 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.51Å | 1.52Å | |
| C6 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| N1 | H4 | sing | 0.97Å | 1.00Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.08Å | 1.08Å | |
| C8 | H9 | sing | 1.08Å | 1.08Å | |
| C9 | H10 | sing | 1.08Å | 1.08Å | |
| C10 | H11 | sing | 1.08Å | 1.08Å | |
| N3 | C11 | sing | 1.46Å | 1.45Å | |
| N3 | H12 | sing | 0.97Å | 1.00Å | |
| C11 | C12 | sing | 1.51Å | 1.52Å | |
| C11 | C13 | sing | 1.53Å | 1.55Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | O3 | doub | 1.21Å | 1.24Å | |
| C13 | C14 | sing | 1.51Å | 1.53Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | O4 | doub | 1.21Å | 1.27Å | |
| C14 | O5 | sing | 1.34Å | 1.25Å | |
| O5 | H16 | sing | 0.97Å | 0.95Å | |
| C15 | O6 | doub | 1.21Å | 1.21Å | |
| C16 | C15 | sing | 1.51Å | 1.54Å | |
| C17 | C16 | sing | 1.53Å | 1.51Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| N4 | C17 | sing | 1.47Å | 1.42Å | |
| C18 | C17 | sing | 1.53Å | 1.55Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | C18 | sing | 1.53Å | 1.56Å | |
| C19 | C21 | sing | 1.53Å | 1.53Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H29 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.09Å | 1.10Å | |
| H17 | C16 | sing | 1.09Å | 1.10Å | |
| H18 | C16 | sing | 1.09Å | 1.10Å | |
| H20 | N4 | sing | 0.97Å | 1.00Å | |
| H22 | C18 | sing | 1.09Å | 1.10Å | |
| H23 | C19 | sing | 1.09Å | 1.10Å | |
| H24 | C20 | sing | 1.09Å | 1.10Å | |
| H25 | C20 | sing | 1.09Å | 1.10Å | |
| H28 | C21 | sing | 1.09Å | 1.10Å | |
| C23 | O7 | doub | 1.21Å | 1.24Å | |
| C23 | C22 | sing | 1.51Å | 1.51Å | |
| C22 | C24 | sing | 1.53Å | 1.53Å | |
| C22 | N5 | sing | 1.47Å | 1.46Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | C26 | sing | 1.53Å | 1.52Å | |
| C26 | C28 | sing | 1.53Å | 1.52Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| N5 | H30 | sing | 0.97Å | 1.00Å | |
| C22 | H31 | sing | 1.09Å | 1.10Å | |
| C24 | H32 | sing | 1.09Å | 1.10Å | |
| C24 | H33 | sing | 1.09Å | 1.10Å | |
| C25 | H34 | sing | 1.09Å | 1.10Å | |
| C25 | H35 | sing | 1.09Å | 1.10Å | |
| C26 | H36 | sing | 1.09Å | 1.10Å | |
| C27 | H37 | sing | 1.09Å | 1.10Å | |
| C27 | H38 | sing | 1.09Å | 1.10Å | |
| C27 | H39 | sing | 1.09Å | 1.10Å | |
| C28 | H40 | sing | 1.09Å | 1.10Å | |
| C28 | H41 | sing | 1.09Å | 1.10Å | |
| C28 | H42 | sing | 1.09Å | 1.10Å | |
| O8 | C30 | doub | 1.21Å | 1.25Å | |
| C31 | C32 | sing | 1.51Å | 1.49Å | |
| C31 | C29 | sing | 1.53Å | 1.55Å | |
| C30 | C33 | sing | 1.51Å | 1.49Å | |
| C30 | C29 | sing | 1.51Å | 1.52Å | |
| O9 | C32 | doub | 1.21Å | 1.25Å | |
| C32 | O10 | sing | 1.34Å | 1.25Å | |
| C29 | N6 | sing | 1.47Å | 1.48Å | |
| N6 | H43 | sing | 0.97Å | 1.00Å | |
| C29 | H44 | sing | 1.09Å | 1.10Å | |
| C31 | H45 | sing | 1.09Å | 1.10Å | |
| C31 | H46 | sing | 1.09Å | 1.10Å | |
| O10 | H47 | sing | 0.97Å | 0.95Å | |
| C33 | H48 | sing | 1.09Å | 1.10Å | |
| C33 | H49 | sing | 1.09Å | 1.10Å | |
| C33 | O11 | sing | 1.45Å | 74.27Å | |
| O11 | C34 | sing | 1.35Å | 0.00Å | |
| C34 | O12 | doub | 1.21Å | 0.00Å | |
| C34 | C35 | sing | 1.48Å | 0.00Å | |
| C35 | C36 | sing | 1.40Å | 0.00Å | Aromatic |
| C36 | C37 | doub | 1.38Å | 0.00Å | Aromatic |
| C37 | C38 | sing | 1.38Å | 0.00Å | Aromatic |
| C38 | C39 | doub | 1.38Å | 0.00Å | Aromatic |
| C39 | C40 | sing | 1.38Å | 0.00Å | Aromatic |
| C40 | C35 | doub | 1.40Å | 0.00Å | Aromatic |
| C37 | H50 | sing | 1.08Å | 0.00Å | |
| C38 | H51 | sing | 1.08Å | 0.00Å | |
| C39 | H52 | sing | 1.08Å | 0.00Å | |
| C40 | C41 | sing | 1.51Å | 0.00Å | |
| C36 | C42 | sing | 1.51Å | 0.00Å | |
| C41 | H53 | sing | 1.09Å | 0.00Å | |
| C41 | H54 | sing | 1.09Å | 0.00Å | |
| C41 | H55 | sing | 1.09Å | 0.00Å | |
| C42 | H56 | sing | 1.09Å | 0.00Å | |
| C42 | H57 | sing | 1.09Å | 0.00Å | |
| C42 | H58 | sing | 1.09Å | 0.00Å | |
| C1 | N1 | sing | 1.35Å | 1.33Å | |
| C4 | N3 | sing | 1.35Å | 1.33Å | |
| C12 | N4 | sing | 1.35Å | 1.32Å | |
| C15 | N5 | sing | 1.35Å | 1.30Å | |
| C23 | N6 | sing | 1.35Å | 1.35Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 119.7° | 120.0° |
| O1 | C1 | N1 | 119.7° | 120.0° |
| C1 | C2 | H1 | 109.5° | 109.4° |
| C1 | C2 | H2 | 109.5° | 109.4° |
| C1 | C2 | H3 | 109.4° | 109.4° |
| C2 | C1 | N1 | 119.6° | 120.0° |
| H1 | C2 | H2 | 109.5° | 109.5° |
| H1 | C2 | H3 | 109.5° | 109.5° |
| H2 | C2 | H3 | 109.5° | 109.5° |
| O2 | C4 | C3 | 119.3° | 120.0° |
| O2 | C4 | N3 | 123.9° | 120.0° |
| C4 | C3 | N1 | 108.2° | 109.5° |
| C4 | C3 | C5 | 103.5° | 109.5° |
| C4 | C3 | H5 | 111.0° | 109.5° |
| C3 | C4 | N3 | 116.8° | 120.0° |
| N1 | C3 | C5 | 112.4° | 109.5° |
| C3 | N1 | H4 | 126.9° | 120.0° |
| N1 | C3 | H5 | 111.0° | 109.5° |
| C3 | N1 | C1 | 106.3° | 120.0° |
| C3 | C5 | C6 | 110.7° | 109.5° |
| C5 | C3 | H5 | 110.5° | 109.5° |
| C3 | C5 | H6 | 109.2° | 109.5° |
| C3 | C5 | H7 | 109.2° | 109.5° |
| C7 | N2 | C8 | 122.3° | 121.8° |
| N2 | C7 | C6 | 119.5° | 120.7° |
| N2 | C7 | H8 | 120.3° | 119.7° |
| N2 | C8 | C9 | 120.4° | 120.8° |
| N2 | C8 | H9 | 119.9° | 119.6° |
| C7 | C6 | C5 | 120.1° | 120.4° |
| C7 | C6 | C10 | 119.2° | 119.2° |
| C6 | C7 | H8 | 120.2° | 119.6° |
| C8 | C9 | C10 | 118.9° | 119.2° |
| C9 | C8 | H9 | 119.8° | 119.6° |
| C8 | C9 | H10 | 120.5° | 120.5° |
| C5 | C6 | C10 | 120.7° | 120.4° |
| C6 | C5 | H6 | 109.2° | 109.5° |
| C6 | C5 | H7 | 109.2° | 109.5° |
| C6 | C10 | C9 | 119.7° | 118.4° |
| C6 | C10 | H11 | 120.2° | 120.8° |
| C10 | C9 | H10 | 120.5° | 120.4° |
| C9 | C10 | H11 | 120.1° | 120.8° |
| H4 | N1 | C1 | 126.8° | 120.0° |
| H6 | C5 | H7 | 109.5° | 109.4° |
| C11 | N3 | H12 | 120.1° | 120.0° |
| N3 | C11 | C12 | 103.4° | 109.5° |
| N3 | C11 | C13 | 113.6° | 109.4° |
| N3 | C11 | H13 | 110.8° | 109.4° |
| C11 | N3 | C4 | 119.8° | 120.0° |
| H12 | N3 | C4 | 120.1° | 120.0° |
| C12 | C11 | C13 | 109.5° | 109.5° |
| C12 | C11 | H13 | 109.8° | 109.5° |
| C11 | C12 | O3 | 122.1° | 120.0° |
| C11 | C12 | N4 | 110.6° | 120.0° |
| C13 | C11 | H13 | 109.5° | 109.5° |
| C11 | C13 | C14 | 114.3° | 109.5° |
| C11 | C13 | H14 | 108.3° | 109.5° |
| C11 | C13 | H15 | 108.2° | 109.5° |
| O3 | C12 | N4 | 116.7° | 119.9° |
| C14 | C13 | H14 | 108.3° | 109.5° |
| C14 | C13 | H15 | 108.3° | 109.5° |
| C13 | C14 | O4 | 122.9° | 120.0° |
| C13 | C14 | O5 | 114.3° | 120.0° |
| H14 | C13 | H15 | 109.5° | 109.4° |
| O4 | C14 | O5 | 122.8° | 120.0° |
| C14 | O5 | H16 | 109.5° | 117.0° |
| O6 | C15 | C16 | 123.1° | 120.0° |
| O6 | C15 | N5 | 135.4° | 120.0° |
| C15 | C16 | C17 | 111.5° | 109.5° |
| C15 | C16 | H17 | 109.0° | 109.5° |
| C15 | C16 | H18 | 108.9° | 109.5° |
| C16 | C15 | N5 | 100.0° | 120.0° |
| C16 | C17 | H19 | 110.2° | 109.5° |
| C16 | C17 | N4 | 98.3° | 109.4° |
| C16 | C17 | C18 | 113.9° | 109.5° |
| C17 | C16 | H17 | 109.0° | 109.5° |
| C17 | C16 | H18 | 109.0° | 109.5° |
| H19 | C17 | N4 | 111.7° | 109.4° |
| H19 | C17 | C18 | 109.7° | 109.5° |
| N4 | C17 | C18 | 112.6° | 109.5° |
| C17 | N4 | H20 | 122.7° | 120.0° |
| C17 | N4 | C12 | 114.6° | 120.0° |
| C17 | C18 | H21 | 107.1° | 109.5° |
| C17 | C18 | C19 | 118.9° | 109.5° |
| C17 | C18 | H22 | 107.1° | 109.4° |
| H21 | C18 | C19 | 107.1° | 109.5° |
| H21 | C18 | H22 | 109.5° | 109.4° |
| C18 | C19 | C21 | 114.4° | 109.5° |
| C18 | C19 | C20 | 111.7° | 109.5° |
| C19 | C18 | H22 | 107.1° | 109.5° |
| C18 | C19 | H23 | 108.7° | 109.4° |
| C21 | C19 | C20 | 103.7° | 109.5° |
| C19 | C21 | H29 | 109.5° | 109.5° |
| C19 | C21 | H27 | 109.4° | 109.5° |
| C21 | C19 | H23 | 109.0° | 109.5° |
| C19 | C21 | H28 | 109.4° | 109.5° |
| C19 | C20 | H26 | 109.5° | 109.5° |
| C20 | C19 | H23 | 109.2° | 109.5° |
| C19 | C20 | H24 | 109.4° | 109.5° |
| C19 | C20 | H25 | 109.4° | 109.5° |
| H26 | C20 | H24 | 109.5° | 109.5° |
| H26 | C20 | H25 | 109.5° | 109.5° |
| H29 | C21 | H27 | 109.5° | 109.5° |
| H29 | C21 | H28 | 109.5° | 109.5° |
| H27 | C21 | H28 | 109.5° | 109.4° |
| H17 | C16 | H18 | 109.4° | 109.4° |
| H20 | N4 | C12 | 122.7° | 120.0° |
| H24 | C20 | H25 | 109.5° | 109.4° |
| O7 | C23 | C22 | 124.2° | 120.0° |
| O7 | C23 | N6 | 121.2° | 120.0° |
| C23 | C22 | C24 | 112.3° | 109.4° |
| C23 | C22 | N5 | 106.7° | 109.5° |
| C23 | C22 | H31 | 108.1° | 109.5° |
| C22 | C23 | N6 | 114.5° | 120.0° |
| C24 | C22 | N5 | 113.0° | 109.4° |
| C22 | C24 | C25 | 108.6° | 109.5° |
| C24 | C22 | H31 | 107.8° | 109.5° |
| C22 | C24 | H32 | 109.7° | 109.5° |
| C22 | C24 | H33 | 109.7° | 109.5° |
| C22 | N5 | H30 | 123.4° | 120.0° |
| N5 | C22 | H31 | 108.7° | 109.5° |
| C22 | N5 | C15 | 113.2° | 120.0° |
| C24 | C25 | C26 | 110.7° | 109.5° |
| C25 | C24 | H32 | 109.7° | 109.5° |
| C25 | C24 | H33 | 109.7° | 109.4° |
| C24 | C25 | H34 | 109.2° | 109.5° |
| C24 | C25 | H35 | 109.2° | 109.5° |
| C25 | C26 | C28 | 109.1° | 109.5° |
| C25 | C26 | C27 | 112.3° | 109.5° |
| C26 | C25 | H34 | 109.2° | 109.5° |
| C26 | C25 | H35 | 109.2° | 109.4° |
| C25 | C26 | H36 | 107.7° | 109.4° |
| C28 | C26 | C27 | 112.3° | 109.5° |
| C28 | C26 | H36 | 107.6° | 109.5° |
| C26 | C28 | H40 | 109.5° | 109.5° |
| C26 | C28 | H41 | 109.5° | 109.5° |
| C26 | C28 | H42 | 109.4° | 109.5° |
| C27 | C26 | H36 | 107.7° | 109.4° |
| C26 | C27 | H37 | 109.5° | 109.4° |
| C26 | C27 | H38 | 109.5° | 109.4° |
| C26 | C27 | H39 | 109.4° | 109.5° |
| H30 | N5 | C15 | 123.4° | 120.0° |
| H32 | C24 | H33 | 109.5° | 109.4° |
| H34 | C25 | H35 | 109.5° | 109.4° |
| H37 | C27 | H38 | 109.5° | 109.4° |
| H37 | C27 | H39 | 109.5° | 109.5° |
| H38 | C27 | H39 | 109.5° | 109.5° |
| H40 | C28 | H41 | 109.4° | 109.4° |
| H40 | C28 | H42 | 109.5° | 109.4° |
| H41 | C28 | H42 | 109.5° | 109.4° |
| O8 | C30 | C33 | 121.2° | 120.0° |
| O8 | C30 | C29 | 120.3° | 120.0° |
| C32 | C31 | C29 | 107.9° | 109.5° |
| C31 | C32 | O9 | 122.9° | 120.0° |
| C31 | C32 | O10 | 120.3° | 120.0° |
| C32 | C31 | H45 | 109.9° | 109.4° |
| C32 | C31 | H46 | 109.8° | 109.5° |
| C31 | C29 | C30 | 109.8° | 109.5° |
| C31 | C29 | N6 | 107.7° | 109.4° |
| C31 | C29 | H44 | 108.3° | 109.5° |
| C29 | C31 | H45 | 109.9° | 109.5° |
| C29 | C31 | H46 | 109.9° | 109.5° |
| C33 | C30 | C29 | 118.4° | 120.0° |
| C30 | C33 | H48 | 117.3° | 109.5° |
| C30 | C33 | H49 | 117.3° | 109.5° |
| C30 | C33 | O11 | 74.7° | 109.5° |
| C30 | C29 | N6 | 113.1° | 109.5° |
| C30 | C29 | H44 | 108.6° | 109.5° |
| O9 | C32 | O10 | 116.7° | 120.0° |
| C32 | O10 | H47 | 109.5° | 117.0° |
| C29 | N6 | H43 | 118.6° | 120.0° |
| N6 | C29 | H44 | 109.2° | 109.5° |
| C29 | N6 | C23 | 122.7° | 119.9° |
| H43 | N6 | C23 | 118.7° | 120.0° |
| H45 | C31 | H46 | 109.5° | 109.5° |
| H48 | C33 | H49 | 109.5° | 109.4° |
| H48 | C33 | O11 | 117.3° | 109.5° |
| H49 | C33 | O11 | 117.3° | 109.5° |
| C33 | O11 | C34 | 90.0° | 117.0° |
| O11 | C34 | O12 | 90.0° | 120.0° |
| O11 | C34 | C35 | 90.0° | 120.0° |
| O12 | C34 | C35 | 90.0° | 120.0° |
| C34 | C35 | C36 | 90.0° | 120.1° |
| C34 | C35 | C40 | 90.0° | 120.1° |
| C35 | C36 | C37 | 90.0° | 119.8° |
| C36 | C35 | C40 | 90.0° | 119.7° |
| C35 | C36 | C42 | 90.0° | 120.1° |
| C36 | C37 | C38 | 90.0° | 120.2° |
| C36 | C37 | H50 | 90.0° | 120.0° |
| C37 | C36 | C42 | 90.0° | 120.1° |
| C37 | C38 | C39 | 90.0° | 120.3° |
| C38 | C37 | H50 | 90.0° | 119.9° |
| C37 | C38 | H51 | 90.0° | 119.8° |
| C38 | C39 | C40 | 90.0° | 120.2° |
| C39 | C38 | H51 | 90.0° | 119.9° |
| C38 | C39 | H52 | 90.0° | 119.9° |
| C39 | C40 | C35 | 90.0° | 119.8° |
| C40 | C39 | H52 | 90.0° | 119.9° |
| C39 | C40 | C41 | 90.0° | 120.1° |
| C35 | C40 | C41 | 90.0° | 120.1° |
| C40 | C41 | H53 | 90.0° | 109.4° |
| C40 | C41 | H54 | 90.0° | 109.5° |
| C40 | C41 | H55 | 90.0° | 109.5° |
| C36 | C42 | H56 | 90.0° | 109.5° |
| C36 | C42 | H57 | 90.0° | 109.5° |
| C36 | C42 | H58 | 90.0° | 109.5° |
| H53 | C41 | H54 | 90.0° | 109.5° |
| H53 | C41 | H55 | 90.0° | 109.5° |
| H54 | C41 | H55 | 90.0° | 109.4° |
| H56 | C42 | H57 | 90.0° | 109.4° |
| H56 | C42 | H58 | 90.0° | 109.5° |
| H57 | C42 | H58 | 90.0° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | N1 | 168.0° | 179.8° |
| O1 | C1 | C2 | H1 | 0.0° | 90.0° |
| O1 | C1 | C2 | H2 | 120.0° | 150.0° |
| O1 | C1 | C2 | H3 | 120.0° | 30.0° |
| O1 | C1 | N1 | C3 | 37.7° | 0.0° |
| O1 | C1 | N1 | H4 | 142.3° | 180.0° |
| C1 | C2 | H1 | H2 | 120.0° | 120.0° |
| C1 | C2 | H1 | H3 | 120.0° | 120.0° |
| C1 | C2 | H2 | H3 | 120.0° | 120.0° |
| C2 | C1 | N1 | C3 | 154.2° | 179.7° |
| C2 | C1 | N1 | H4 | 25.8° | 0.2° |
| H1 | C2 | H2 | H3 | 120.0° | 120.0° |
| H1 | C2 | C1 | N1 | 168.0° | 89.8° |
| H2 | C2 | C1 | N1 | 72.0° | 30.2° |
| H3 | C2 | C1 | N1 | 48.0° | 150.3° |
| O2 | C4 | C3 | N3 | 179.2° | 179.9° |
| O2 | C4 | C3 | N1 | 31.7° | 20.0° |
| O2 | C4 | C3 | C5 | 87.8° | 100.0° |
| O2 | C4 | C3 | H5 | 153.7° | 140.0° |
| O2 | C4 | N3 | C11 | 9.0° | 5.1° |
| O2 | C4 | N3 | H12 | 171.0° | 175.0° |
| C4 | C3 | N1 | C5 | 113.7° | 120.0° |
| C4 | C3 | N1 | H5 | 122.0° | 120.0° |
| C4 | C3 | C5 | H5 | 118.9° | 120.0° |
| C4 | C3 | C5 | C6 | 176.1° | 175.0° |
| C4 | C3 | N1 | H4 | 54.7° | 120.0° |
| C4 | C3 | C5 | H6 | 55.9° | 64.9° |
| C4 | C3 | C5 | H7 | 63.7° | 55.0° |
| C3 | C4 | N3 | C11 | 170.2° | 174.9° |
| C3 | C4 | N3 | H12 | 9.8° | 5.0° |
| C4 | C3 | N1 | C1 | 125.3° | 60.0° |
| N1 | C3 | C5 | H5 | 124.6° | 120.0° |
| N1 | C3 | C5 | C6 | 59.6° | 65.0° |
| C3 | N1 | H4 | C1 | 180.0° | 180.0° |
| N1 | C3 | C5 | H6 | 60.6° | 55.0° |
| N1 | C3 | C5 | H7 | 179.8° | 175.0° |
| N1 | C3 | C4 | N3 | 149.1° | 160.0° |
| C3 | C5 | C6 | C7 | 105.9° | 89.7° |
| C3 | C5 | C6 | H6 | 120.2° | 120.0° |
| C3 | C5 | C6 | H7 | 120.2° | 120.0° |
| C3 | C5 | C6 | C10 | 74.6° | 90.0° |
| C5 | C3 | N1 | H4 | 59.0° | 120.0° |
| C3 | C5 | H6 | H7 | 119.4° | 120.0° |
| C5 | C3 | N1 | C1 | 121.0° | 60.0° |
| C5 | C3 | C4 | N3 | 91.5° | 80.1° |
| N2 | C7 | C6 | H8 | 180.0° | 180.0° |
| C7 | N2 | C8 | C9 | 0.4° | 0.1° |
| N2 | C7 | C6 | C5 | 179.9° | 180.0° |
| N2 | C7 | C6 | C10 | 0.6° | 0.2° |
| C7 | N2 | C8 | H9 | 179.6° | 180.0° |
| C8 | N2 | C7 | C6 | 0.6° | 0.0° |
| N2 | C8 | C9 | H9 | 180.0° | 180.0° |
| N2 | C8 | C9 | C10 | 0.2° | 0.2° |
| C8 | N2 | C7 | H8 | 179.4° | 179.9° |
| N2 | C8 | C9 | H10 | 179.8° | 180.0° |
| C7 | C6 | C5 | C10 | 179.5° | 179.7° |
| C7 | C6 | C10 | C9 | 0.4° | 0.5° |
| C7 | C6 | C5 | H6 | 133.9° | 150.3° |
| C7 | C6 | C5 | H7 | 14.3° | 30.3° |
| C7 | C6 | C10 | H11 | 179.6° | 179.7° |
| C8 | C9 | C10 | C6 | 0.2° | 0.5° |
| C8 | C9 | C10 | H10 | 180.0° | 179.8° |
| C8 | C9 | C10 | H11 | 179.8° | 179.7° |
| C5 | C6 | C10 | C9 | 179.9° | 179.8° |
| C6 | C5 | C3 | H5 | 65.0° | 55.0° |
| C6 | C5 | H6 | H7 | 119.4° | 120.0° |
| C5 | C6 | C7 | H8 | 0.1° | 0.1° |
| C5 | C6 | C10 | H11 | 0.1° | 0.0° |
| C6 | C10 | C9 | H11 | 180.0° | 179.8° |
| C10 | C6 | C5 | H6 | 45.6° | 30.0° |
| C10 | C6 | C5 | H7 | 165.2° | 150.0° |
| C10 | C6 | C7 | H8 | 179.4° | 179.8° |
| C6 | C10 | C9 | H10 | 179.8° | 179.7° |
| C10 | C9 | C8 | H9 | 179.8° | 179.8° |
| H4 | N1 | C3 | H5 | 176.7° | 0.0° |
| H5 | C3 | C5 | H6 | 174.8° | 175.1° |
| H5 | C3 | C5 | H7 | 55.2° | 65.0° |
| H5 | C3 | N1 | C1 | 3.3° | 180.0° |
| H5 | C3 | C4 | N3 | 27.1° | 39.9° |
| H9 | C8 | C9 | H10 | 0.2° | 0.0° |
| H10 | C9 | C10 | H11 | 0.2° | 0.1° |
| C11 | N3 | H12 | C4 | 180.0° | 179.9° |
| N3 | C11 | C12 | C13 | 121.4° | 120.0° |
| N3 | C11 | C12 | H13 | 118.3° | 120.0° |
| N3 | C11 | C13 | H13 | 124.5° | 120.0° |
| N3 | C11 | C12 | O3 | 9.6° | 0.0° |
| N3 | C11 | C13 | C14 | 61.5° | 65.9° |
| N3 | C11 | C13 | H14 | 59.2° | 54.1° |
| N3 | C11 | C13 | H15 | 177.8° | 174.0° |
| N3 | C11 | C12 | N4 | 153.1° | 180.0° |
| H12 | N3 | C11 | C12 | 102.8° | 97.7° |
| H12 | N3 | C11 | C13 | 15.8° | 22.4° |
| H12 | N3 | C11 | H13 | 139.6° | 142.4° |
| C12 | C11 | C13 | H13 | 120.5° | 120.0° |
| C11 | C12 | O3 | N4 | 141.4° | 179.9° |
| C12 | C11 | C13 | C14 | 176.4° | 174.1° |
| C12 | C11 | C13 | H14 | 55.7° | 65.9° |
| C12 | C11 | C13 | H15 | 62.8° | 54.0° |
| C11 | C12 | N4 | C17 | 173.3° | 174.8° |
| C11 | C12 | N4 | H20 | 6.7° | 5.0° |
| C12 | C11 | N3 | C4 | 77.2° | 82.2° |
| C13 | C11 | C12 | O3 | 131.0° | 120.0° |
| C11 | C13 | C14 | H14 | 120.7° | 120.0° |
| C11 | C13 | C14 | H15 | 120.7° | 120.0° |
| C11 | C13 | H14 | H15 | 117.8° | 120.0° |
| C11 | C13 | C14 | O4 | 46.2° | 4.4° |
| C11 | C13 | C14 | O5 | 136.8° | 175.5° |
| C13 | C11 | N3 | C4 | 164.2° | 157.7° |
| C13 | C11 | C12 | N4 | 85.6° | 60.0° |
| H13 | C11 | C12 | O3 | 108.7° | 119.9° |
| H13 | C11 | C13 | C14 | 63.0° | 54.0° |
| H13 | C11 | C13 | H14 | 176.2° | 174.1° |
| H13 | C11 | C13 | H15 | 57.7° | 66.0° |
| H13 | C11 | N3 | C4 | 40.4° | 37.7° |
| H13 | C11 | C12 | N4 | 34.8° | 60.0° |
| O3 | C12 | N4 | C17 | 41.1° | 5.2° |
| O3 | C12 | N4 | H20 | 138.9° | 174.9° |
| C14 | C13 | H14 | H15 | 117.8° | 120.0° |
| C13 | C14 | O4 | O5 | 176.7° | 179.9° |
| C13 | C14 | O5 | H16 | 177.0° | 180.0° |
| H14 | C13 | C14 | O4 | 166.9° | 115.6° |
| H14 | C13 | C14 | O5 | 16.1° | 64.5° |
| H15 | C13 | C14 | O4 | 74.5° | 124.4° |
| H15 | C13 | C14 | O5 | 102.5° | 55.5° |
| O4 | C14 | O5 | H16 | 0.0° | 0.1° |
| O6 | C15 | C16 | N5 | 168.3° | 180.0° |
| O6 | C15 | C16 | C17 | 62.9° | 0.0° |
| O6 | C15 | C16 | H17 | 57.4° | 120.0° |
| O6 | C15 | C16 | H18 | 176.8° | 120.0° |
| O6 | C15 | N5 | C22 | 7.4° | 0.0° |
| O6 | C15 | N5 | H30 | 172.6° | 180.0° |
| C15 | C16 | C17 | H17 | 120.3° | 120.0° |
| C15 | C16 | C17 | H18 | 120.3° | 120.0° |
| C15 | C16 | C17 | H19 | 165.6° | 54.9° |
| C15 | C16 | C17 | N4 | 77.5° | 65.0° |
| C15 | C16 | C17 | C18 | 41.8° | 175.0° |
| C15 | C16 | H17 | H18 | 119.0° | 119.9° |
| C16 | C15 | N5 | C22 | 173.4° | 180.0° |
| C16 | C15 | N5 | H30 | 6.6° | 0.0° |
| C16 | C17 | H19 | N4 | 108.2° | 119.9° |
| C16 | C17 | H19 | C18 | 126.2° | 120.1° |
| C16 | C17 | N4 | C18 | 120.3° | 120.0° |
| C16 | C17 | C18 | H21 | 50.2° | 53.9° |
| C16 | C17 | C18 | C19 | 171.5° | 66.1° |
| C17 | C16 | H17 | H18 | 119.1° | 120.0° |
| C16 | C17 | N4 | H20 | 21.7° | 21.9° |
| C16 | C17 | C18 | H22 | 67.2° | 173.9° |
| C16 | C17 | N4 | C12 | 158.3° | 158.3° |
| C17 | C16 | C15 | N5 | 128.8° | 180.0° |
| H19 | C17 | N4 | C18 | 124.0° | 120.0° |
| H19 | C17 | C18 | H21 | 73.9° | 174.0° |
| H19 | C17 | C18 | C19 | 47.4° | 53.9° |
| H19 | C17 | C16 | H17 | 74.1° | 65.1° |
| H19 | C17 | C16 | H18 | 45.3° | 175.0° |
| H19 | C17 | N4 | H20 | 137.4° | 141.8° |
| H19 | C17 | C18 | H22 | 168.8° | 66.1° |
| H19 | C17 | N4 | C12 | 42.6° | 38.3° |
| N4 | C17 | C18 | H21 | 161.1° | 66.1° |
| N4 | C17 | C18 | C19 | 77.6° | 173.9° |
| N4 | C17 | C16 | H17 | 42.8° | 175.0° |
| N4 | C17 | C16 | H18 | 162.2° | 55.0° |
| C17 | N4 | H20 | C12 | 180.0° | 179.9° |
| N4 | C17 | C18 | H22 | 43.7° | 53.9° |
| C17 | C18 | H21 | C19 | 128.5° | 120.0° |
| C17 | C18 | H21 | H22 | 115.8° | 119.9° |
| C17 | C18 | C19 | H22 | 121.4° | 120.0° |
| C17 | C18 | C19 | C21 | 86.6° | 66.2° |
| C17 | C18 | C19 | C20 | 155.9° | 173.8° |
| C18 | C17 | C16 | H17 | 162.1° | 55.0° |
| C18 | C17 | C16 | H18 | 78.5° | 65.0° |
| C18 | C17 | N4 | H20 | 98.6° | 98.2° |
| C17 | C18 | C19 | H23 | 35.4° | 53.7° |
| C18 | C17 | N4 | C12 | 81.4° | 81.7° |
| H21 | C18 | C19 | H22 | 117.3° | 120.0° |
| H21 | C18 | C19 | C21 | 152.1° | 173.7° |
| H21 | C18 | C19 | C20 | 34.6° | 53.7° |
| H21 | C18 | C19 | H23 | 85.9° | 66.3° |
| C18 | C19 | C21 | C20 | 121.9° | 120.0° |
| C18 | C19 | C21 | H23 | 121.9° | 120.0° |
| C18 | C19 | C20 | H23 | 120.2° | 119.9° |
| C18 | C19 | C20 | H26 | 180.0° | 60.0° |
| C18 | C19 | C21 | H29 | 180.0° | 174.4° |
| C18 | C19 | C21 | H27 | 60.0° | 54.4° |
| C18 | C19 | C20 | H24 | 60.0° | 179.9° |
| C18 | C19 | C20 | H25 | 60.0° | 60.0° |
| C18 | C19 | C21 | H28 | 60.0° | 65.5° |
| C21 | C19 | C20 | H23 | 116.0° | 120.0° |
| C21 | C19 | C20 | H26 | 56.3° | 60.0° |
| C19 | C21 | H29 | H27 | 120.0° | 120.0° |
| C19 | C21 | H29 | H28 | 120.0° | 120.0° |
| C19 | C21 | H27 | H28 | 120.0° | 120.0° |
| C21 | C19 | C18 | H22 | 34.8° | 53.7° |
| C21 | C19 | C20 | H24 | 176.3° | 60.0° |
| C21 | C19 | C20 | H25 | 63.7° | 180.0° |
| C19 | C20 | H26 | H24 | 120.0° | 120.0° |
| C19 | C20 | H26 | H25 | 120.0° | 120.0° |
| C20 | C19 | C21 | H29 | 58.1° | 54.4° |
| C20 | C19 | C21 | H27 | 61.9° | 65.6° |
| C20 | C19 | C18 | H22 | 82.7° | 66.3° |
| C19 | C20 | H24 | H25 | 120.0° | 120.0° |
| C20 | C19 | C21 | H28 | 178.1° | 174.5° |
| H26 | C20 | C19 | H23 | 59.7° | 179.9° |
| H26 | C20 | H24 | H25 | 120.0° | 120.0° |
| H29 | C21 | H27 | H28 | 120.0° | 120.0° |
| H29 | C21 | C19 | H23 | 58.1° | 65.6° |
| H27 | C21 | C19 | H23 | 178.1° | 174.4° |
| H17 | C16 | C15 | N5 | 110.9° | 60.0° |
| H18 | C16 | C15 | N5 | 8.4° | 60.0° |
| H22 | C18 | C19 | H23 | 156.8° | 173.7° |
| H23 | C19 | C20 | H24 | 60.2° | 60.0° |
| H23 | C19 | C20 | H25 | 179.8° | 59.9° |
| H23 | C19 | C21 | H28 | 61.9° | 54.4° |
| O7 | C23 | C22 | N6 | 178.6° | 179.9° |
| O7 | C23 | C22 | C24 | 101.6° | 120.0° |
| O7 | C23 | C22 | N5 | 22.8° | 0.1° |
| O7 | C23 | C22 | H31 | 139.6° | 120.0° |
| O7 | C23 | N6 | C29 | 4.8° | 5.0° |
| O7 | C23 | N6 | H43 | 175.2° | 175.0° |
| C23 | C22 | C24 | N5 | 120.8° | 120.0° |
| C23 | C22 | C24 | H31 | 119.0° | 120.0° |
| C23 | C22 | N5 | H31 | 116.4° | 120.0° |
| C23 | C22 | C24 | C25 | 67.5° | 175.0° |
| C23 | C22 | N5 | H30 | 28.3° | 24.9° |
| C23 | C22 | C24 | H32 | 52.4° | 64.9° |
| C23 | C22 | C24 | H33 | 172.6° | 55.0° |
| C22 | C23 | N6 | C29 | 173.8° | 175.0° |
| C22 | C23 | N6 | H43 | 6.2° | 5.0° |
| C23 | C22 | N5 | C15 | 151.7° | 155.0° |
| C24 | C22 | N5 | H31 | 119.7° | 120.0° |
| C22 | C24 | C25 | H32 | 119.9° | 120.1° |
| C22 | C24 | C25 | H33 | 119.9° | 120.0° |
| C22 | C24 | C25 | C26 | 168.6° | NaN° |
| C24 | C22 | N5 | H30 | 95.7° | 95.0° |
| C22 | C24 | H32 | H33 | 120.4° | 120.0° |
| C22 | C24 | C25 | H34 | 71.2° | 59.9° |
| C22 | C24 | C25 | H35 | 48.4° | 60.0° |
| C24 | C22 | N5 | C15 | 84.3° | 85.0° |
| C24 | C22 | C23 | N6 | 79.9° | 60.1° |
| N5 | C22 | C24 | C25 | 53.3° | 65.0° |
| C22 | N5 | H30 | C15 | 180.0° | 179.9° |
| N5 | C22 | C24 | H32 | 173.2° | 55.0° |
| N5 | C22 | C24 | H33 | 66.6° | 175.0° |
| N5 | C22 | C23 | N6 | 155.7° | 180.0° |
| C24 | C25 | C26 | H34 | 120.2° | 120.1° |
| C24 | C25 | C26 | H35 | 120.2° | 120.0° |
| C24 | C25 | C26 | C28 | 45.5° | 65.0° |
| C24 | C25 | C26 | C27 | 170.7° | 175.0° |
| C25 | C24 | C22 | H31 | 173.5° | 55.0° |
| C25 | C24 | H32 | H33 | 120.4° | 120.0° |
| C24 | C25 | H34 | H35 | 119.4° | 120.0° |
| C24 | C25 | C26 | H36 | 71.0° | 55.1° |
| C25 | C26 | C28 | C27 | 125.2° | 120.0° |
| C25 | C26 | C28 | H36 | 116.6° | 120.0° |
| C25 | C26 | C27 | H36 | 118.3° | 119.9° |
| C26 | C25 | C24 | H32 | 48.8° | 59.9° |
| C26 | C25 | C24 | H33 | 71.5° | 60.0° |
| C26 | C25 | H34 | H35 | 119.5° | 119.9° |
| C25 | C26 | C27 | H37 | 180.0° | 60.1° |
| C25 | C26 | C27 | H38 | 60.0° | 180.0° |
| C25 | C26 | C27 | H39 | 60.0° | 60.0° |
| C25 | C26 | C28 | H40 | 180.0° | 60.0° |
| C25 | C26 | C28 | H41 | 60.0° | 180.0° |
| C25 | C26 | C28 | H42 | 60.0° | 60.0° |
| C28 | C26 | C27 | H36 | 118.3° | 120.0° |
| C28 | C26 | C25 | H34 | 74.6° | 175.0° |
| C28 | C26 | C25 | H35 | 165.7° | 55.0° |
| C28 | C26 | C27 | H37 | 56.6° | 60.0° |
| C28 | C26 | C27 | H38 | 63.4° | 60.0° |
| C28 | C26 | C27 | H39 | 176.6° | 180.0° |
| C26 | C28 | H40 | H41 | 120.0° | 120.0° |
| C26 | C28 | H40 | H42 | 120.0° | 120.0° |
| C26 | C28 | H41 | H42 | 120.0° | 120.0° |
| C27 | C26 | C25 | H34 | 50.5° | 54.9° |
| C27 | C26 | C25 | H35 | 69.1° | 65.0° |
| C26 | C27 | H37 | H38 | 120.0° | 119.9° |
| C26 | C27 | H37 | H39 | 120.0° | 120.1° |
| C26 | C27 | H38 | H39 | 120.0° | 120.0° |
| C27 | C26 | C28 | H40 | 54.9° | 180.0° |
| C27 | C26 | C28 | H41 | 174.8° | 60.0° |
| C27 | C26 | C28 | H42 | 65.2° | 60.0° |
| H30 | N5 | C22 | H31 | 144.7° | 145.0° |
| H31 | C22 | C24 | H32 | 66.7° | 175.0° |
| H31 | C22 | C24 | H33 | 53.6° | 65.0° |
| H31 | C22 | N5 | C15 | 35.3° | 35.0° |
| H31 | C22 | C23 | N6 | 39.0° | 60.0° |
| H32 | C24 | C25 | H34 | 168.9° | 180.0° |
| H32 | C24 | C25 | H35 | 71.4° | 60.0° |
| H33 | C24 | C25 | H34 | 48.7° | 60.1° |
| H33 | C24 | C25 | H35 | 168.3° | 180.0° |
| H34 | C25 | C26 | H36 | 168.9° | 65.0° |
| H35 | C25 | C26 | H36 | 49.2° | 175.0° |
| H36 | C26 | C27 | H37 | 61.7° | 180.0° |
| H36 | C26 | C27 | H38 | 178.3° | 60.1° |
| H36 | C26 | C27 | H39 | 58.3° | 59.9° |
| H36 | C26 | C28 | H40 | 63.4° | 60.0° |
| H36 | C26 | C28 | H41 | 56.5° | 60.0° |
| H36 | C26 | C28 | H42 | 176.6° | 180.0° |
| H37 | C27 | H38 | H39 | 120.0° | 120.0° |
| H40 | C28 | H41 | H42 | 120.0° | 119.9° |
| O8 | C30 | C29 | C31 | 37.3° | 105.0° |
| O8 | C30 | C33 | C29 | 177.3° | 180.0° |
| O8 | C30 | C29 | N6 | 157.6° | 14.9° |
| O8 | C30 | C29 | H44 | 80.9° | 135.0° |
| O8 | C30 | C33 | H48 | 132.5° | 120.0° |
| O8 | C30 | C33 | H49 | 93.9° | 120.0° |
| O8 | C30 | C33 | O11 | 19.3° | 0.0° |
| C32 | C31 | C29 | H45 | 119.7° | 120.0° |
| C32 | C31 | C29 | H46 | 119.7° | 120.0° |
| C32 | C31 | C29 | C30 | 160.3° | 176.2° |
| C31 | C32 | O9 | O10 | 177.5° | 180.0° |
| C32 | C31 | C29 | N6 | 76.2° | 63.8° |
| C32 | C31 | C29 | H44 | 41.8° | 56.1° |
| C32 | C31 | H45 | H46 | 120.7° | 120.0° |
| C31 | C32 | O10 | H47 | 177.6° | 180.0° |
| C31 | C29 | C30 | C33 | 145.3° | 75.0° |
| C31 | C29 | C30 | N6 | 120.3° | 120.0° |
| C31 | C29 | C30 | H44 | 118.3° | 120.0° |
| C29 | C31 | C32 | O9 | 155.3° | 4.6° |
| C29 | C31 | C32 | O10 | 27.3° | 175.4° |
| C31 | C29 | N6 | H44 | 117.4° | 120.0° |
| C31 | C29 | N6 | H43 | 46.8° | 22.1° |
| C29 | C31 | H45 | H46 | 120.8° | 120.0° |
| C31 | C29 | N6 | C23 | 133.2° | 157.9° |
| C33 | C30 | C29 | N6 | 25.0° | 165.0° |
| C33 | C30 | C29 | H44 | 96.4° | 45.0° |
| C30 | C33 | H48 | H49 | 136.9° | 120.0° |
| C30 | C33 | H48 | O11 | 86.1° | 120.0° |
| C30 | C33 | H49 | O11 | 86.1° | 120.0° |
| C30 | C33 | O11 | C34 | 90.0° | 180.0° |
| C30 | C29 | N6 | H44 | 121.1° | 120.0° |
| C30 | C29 | N6 | H43 | 74.7° | 97.8° |
| C30 | C29 | C31 | H45 | 40.5° | 63.8° |
| C30 | C29 | C31 | H46 | 80.0° | 56.2° |
| C29 | C30 | C33 | H48 | 50.2° | 60.0° |
| C29 | C30 | C33 | H49 | 83.4° | 60.0° |
| C29 | C30 | C33 | O11 | 163.4° | 180.0° |
| C30 | C29 | N6 | C23 | 105.3° | 82.2° |
| O9 | C32 | C31 | H45 | 85.0° | 115.4° |
| O9 | C32 | C31 | H46 | 35.6° | 124.6° |
| O9 | C32 | O10 | H47 | 0.0° | 0.0° |
| O10 | C32 | C31 | H45 | 92.5° | 64.6° |
| O10 | C32 | C31 | H46 | 147.0° | 55.3° |
| C29 | N6 | H43 | C23 | 180.0° | 180.0° |
| N6 | C29 | C31 | H45 | 164.1° | 56.1° |
| N6 | C29 | C31 | H46 | 43.6° | 176.1° |
| H43 | N6 | C29 | H44 | 164.2° | 142.2° |
| H44 | C29 | C31 | H45 | 77.9° | 176.1° |
| H44 | C29 | C31 | H46 | 161.6° | 63.9° |
| H44 | C29 | N6 | C23 | 15.8° | 37.9° |
| H48 | C33 | H49 | O11 | 137.0° | 120.0° |
| H48 | C33 | O11 | C34 | 90.0° | 60.0° |
| H49 | C33 | O11 | C34 | 90.0° | 60.0° |
| C33 | O11 | C34 | O12 | 90.0° | 0.0° |
| C33 | O11 | C34 | C35 | 90.0° | 180.0° |
| O11 | C34 | O12 | C35 | 90.0° | 180.0° |
| O11 | C34 | C35 | C36 | 90.0° | 90.0° |
| O11 | C34 | C35 | C40 | 90.0° | 89.7° |
| O12 | C34 | C35 | C36 | 90.0° | 90.0° |
| O12 | C34 | C35 | C40 | 90.0° | 90.3° |
| C34 | C35 | C36 | C40 | 90.0° | 179.8° |
| C34 | C35 | C36 | C37 | 90.0° | 180.0° |
| C34 | C35 | C40 | C39 | 90.0° | 179.7° |
| C34 | C35 | C40 | C41 | 90.0° | 0.3° |
| C34 | C35 | C36 | C42 | 90.0° | 0.0° |
| C35 | C36 | C37 | C42 | 90.0° | 180.0° |
| C35 | C36 | C37 | C38 | 90.0° | 0.1° |
| C36 | C35 | C40 | C39 | 90.0° | 0.6° |
| C35 | C36 | C37 | H50 | 90.0° | 180.0° |
| C36 | C35 | C40 | C41 | 90.0° | 179.9° |
| C35 | C36 | C42 | H56 | 90.0° | 90.0° |
| C35 | C36 | C42 | H57 | 90.0° | 150.0° |
| C35 | C36 | C42 | H58 | 90.0° | 30.1° |
| C36 | C37 | C38 | H50 | 90.0° | 180.0° |
| C36 | C37 | C38 | C39 | 90.0° | 0.0° |
| C37 | C36 | C35 | C40 | 90.0° | 0.2° |
| C36 | C37 | C38 | H51 | 90.0° | 180.0° |
| C37 | C36 | C42 | H56 | 90.0° | 90.0° |
| C37 | C36 | C42 | H57 | 90.0° | 30.0° |
| C37 | C36 | C42 | H58 | 90.0° | 149.9° |
| C37 | C38 | C39 | H51 | 90.0° | 180.0° |
| C37 | C38 | C39 | C40 | 90.0° | 0.3° |
| C37 | C38 | C39 | H52 | 90.0° | 180.0° |
| C38 | C37 | C36 | C42 | 90.0° | 180.0° |
| C38 | C39 | C40 | H52 | 90.0° | 179.7° |
| C38 | C39 | C40 | C35 | 90.0° | 0.6° |
| C39 | C38 | C37 | H50 | 90.0° | 180.0° |
| C38 | C39 | C40 | C41 | 90.0° | 180.0° |
| C39 | C40 | C35 | C41 | 90.0° | 179.4° |
| C40 | C39 | C38 | H51 | 90.0° | 179.6° |
| C39 | C40 | C41 | H53 | 90.0° | 90.0° |
| C39 | C40 | C41 | H54 | 90.0° | 150.0° |
| C39 | C40 | C41 | H55 | 90.0° | 30.0° |
| C35 | C40 | C39 | H52 | 90.0° | 179.7° |
| C40 | C35 | C36 | C42 | 90.0° | 179.8° |
| C35 | C40 | C41 | H53 | 90.0° | 90.6° |
| C35 | C40 | C41 | H54 | 90.0° | 29.4° |
| C35 | C40 | C41 | H55 | 90.0° | 149.4° |
| H50 | C37 | C38 | H51 | 90.0° | 0.0° |
| H50 | C37 | C36 | C42 | 90.0° | 0.0° |
| H51 | C38 | C39 | H52 | 90.0° | 0.0° |
| H52 | C39 | C40 | C41 | 90.0° | 0.4° |
| C40 | C41 | H53 | H54 | 90.0° | 120.0° |
| C40 | C41 | H53 | H55 | 90.0° | 120.0° |
| C40 | C41 | H54 | H55 | 90.0° | 120.0° |
| C36 | C42 | H56 | H57 | 90.0° | 120.0° |
| C36 | C42 | H56 | H58 | 90.0° | 120.1° |
| C36 | C42 | H57 | H58 | 90.0° | 120.0° |
| H53 | C41 | H54 | H55 | 90.0° | 120.0° |
| H56 | C42 | H57 | H58 | 90.0° | 120.0° |
