PRD_000807
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | doub | 1.21Å | 1.23Å | |
| C1 | C2 | sing | 1.51Å | 1.53Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | C4 | sing | 1.51Å | 1.51Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| N1 | C10 | sing | 1.47Å | 1.47Å | |
| N1 | C14 | sing | 1.47Å | 1.48Å | |
| C10 | C11 | sing | 1.51Å | 1.53Å | |
| C10 | C12 | sing | 1.54Å | 1.53Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | O2 | doub | 1.21Å | 1.23Å | |
| C12 | C13 | sing | 1.55Å | 1.50Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.55Å | 1.51Å | |
| 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 | |
| N2 | C15 | sing | 1.47Å | 1.46Å | |
| N2 | H17 | sing | 0.97Å | 1.00Å | |
| C15 | C16 | sing | 1.51Å | 1.53Å | |
| C15 | C17 | sing | 1.53Å | 1.53Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | O3 | doub | 1.21Å | 1.23Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| C18 | C20 | sing | 1.53Å | 1.52Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| N3 | C21 | sing | 1.46Å | 1.46Å | |
| N3 | H28 | sing | 0.97Å | 1.00Å | |
| C21 | C22 | sing | 1.51Å | 1.52Å | |
| C21 | C23 | sing | 1.53Å | 1.54Å | |
| C21 | H29 | sing | 1.09Å | 1.10Å | |
| C22 | O4 | doub | 1.21Å | 1.23Å | |
| C23 | C24 | sing | 1.51Å | 1.50Å | |
| C23 | H30 | sing | 1.09Å | 1.10Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| C24 | N4 | sing | 1.34Å | 1.38Å | Aromatic |
| C24 | C25 | doub | 1.35Å | 1.35Å | Aromatic |
| N4 | C26 | doub | 1.30Å | 1.32Å | Aromatic |
| N4 | H32 | sing | 0.97Å | 1.00Å | |
| C25 | N5 | sing | 1.37Å | 1.37Å | Aromatic |
| C25 | H33 | sing | 1.08Å | 1.08Å | |
| C26 | N5 | sing | 1.35Å | 1.32Å | Aromatic |
| C26 | H34 | sing | 1.08Å | 1.08Å | |
| N5 | H35 | sing | 0.97Å | 1.00Å | |
| N6 | C27 | sing | 1.46Å | 1.46Å | |
| N6 | H36 | sing | 0.97Å | 1.00Å | |
| C27 | C28 | sing | 1.51Å | 1.54Å | |
| C27 | C29 | sing | 1.53Å | 1.53Å | |
| C27 | H37 | sing | 1.09Å | 1.10Å | |
| C28 | O5 | doub | 1.21Å | 1.23Å | |
| C29 | O6 | sing | 1.43Å | 1.42Å | |
| C29 | H38 | sing | 1.09Å | 1.10Å | |
| C29 | H39 | sing | 1.09Å | 1.10Å | |
| O6 | H40 | sing | 0.97Å | 0.95Å | |
| N7 | C30 | sing | 1.46Å | 1.46Å | |
| N7 | H41 | sing | 0.97Å | 1.00Å | |
| C30 | C31 | sing | 1.53Å | 1.53Å | |
| C30 | C33 | sing | 1.51Å | 1.51Å | |
| C30 | H42 | sing | 1.09Å | 1.10Å | |
| C31 | C32 | sing | 1.53Å | 1.53Å | |
| C31 | O7 | sing | 1.43Å | 1.43Å | |
| C31 | H43 | sing | 1.09Å | 1.10Å | |
| C32 | H44 | sing | 1.09Å | 1.10Å | |
| C32 | H45 | sing | 1.09Å | 1.10Å | |
| C32 | H46 | sing | 1.09Å | 1.10Å | |
| O7 | P1 | sing | 1.61Å | 1.61Å | |
| P1 | O8 | doub | 1.48Å | 1.51Å | |
| P1 | O9 | sing | 1.61Å | 1.52Å | |
| P1 | O10 | sing | 1.61Å | 1.51Å | |
| O9 | H47 | sing | 0.97Å | 0.95Å | |
| O10 | H48 | sing | 0.97Å | 0.95Å | |
| C33 | O11 | doub | 1.21Å | 1.24Å | |
| N8 | C34 | sing | 1.46Å | 1.47Å | |
| N8 | H49 | sing | 0.97Å | 1.00Å | |
| C34 | C35 | sing | 1.51Å | 1.52Å | |
| C34 | C36 | sing | 1.53Å | 1.53Å | |
| C34 | H50 | sing | 1.09Å | 1.10Å | |
| C35 | O12 | doub | 1.21Å | 1.23Å | |
| C36 | H51 | sing | 1.09Å | 1.10Å | |
| C36 | H52 | sing | 1.09Å | 1.10Å | |
| C36 | H53 | sing | 1.09Å | 1.10Å | |
| N9 | H54 | sing | 0.97Å | 1.00Å | |
| N9 | H55 | sing | 0.97Å | 1.00Å | |
| C1 | N1 | sing | 1.35Å | 1.35Å | |
| C11 | N2 | sing | 1.35Å | 1.33Å | |
| C16 | N3 | sing | 1.35Å | 1.33Å | |
| C22 | N6 | sing | 1.35Å | 1.33Å | |
| C28 | N7 | sing | 1.35Å | 1.33Å | |
| C33 | N8 | sing | 1.35Å | 1.33Å | |
| C35 | N9 | sing | 1.35Å | 1.26Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 120.3° | 120.0° |
| O1 | C1 | N1 | 122.8° | 120.0° |
| C1 | C2 | C3 | 111.3° | 109.5° |
| C1 | C2 | H1 | 109.0° | 109.5° |
| C1 | C2 | H2 | 109.0° | 109.5° |
| C2 | C1 | N1 | 116.9° | 120.0° |
| C3 | C2 | H1 | 109.0° | 109.5° |
| C3 | C2 | H2 | 109.0° | 109.4° |
| C2 | C3 | C4 | 113.7° | 109.5° |
| C2 | C3 | H3 | 108.4° | 109.5° |
| C2 | C3 | H4 | 108.4° | 109.4° |
| H1 | C2 | H2 | 109.5° | 109.5° |
| C4 | C3 | H3 | 108.4° | 109.5° |
| C4 | C3 | H4 | 108.4° | 109.5° |
| C3 | C4 | C5 | 120.6° | 120.0° |
| C3 | C4 | C9 | 120.6° | 120.0° |
| H3 | C3 | H4 | 109.5° | 109.5° |
| C5 | C4 | C9 | 118.8° | 120.0° |
| C4 | C5 | C6 | 120.8° | 120.0° |
| C4 | C5 | H5 | 119.6° | 120.0° |
| C4 | C9 | C8 | 120.9° | 120.0° |
| C4 | C9 | H9 | 119.6° | 120.0° |
| C6 | C5 | H5 | 119.6° | 120.0° |
| C5 | C6 | C7 | 120.0° | 120.0° |
| C5 | C6 | H6 | 120.0° | 120.0° |
| C7 | C6 | H6 | 120.0° | 120.0° |
| C6 | C7 | C8 | 119.8° | 120.0° |
| C6 | C7 | H7 | 120.1° | 120.0° |
| C8 | C7 | H7 | 120.1° | 120.0° |
| C7 | C8 | C9 | 119.7° | 120.0° |
| C7 | C8 | H8 | 120.1° | 120.1° |
| C9 | C8 | H8 | 120.2° | 119.9° |
| C8 | C9 | H9 | 119.5° | 120.0° |
| C10 | N1 | C14 | 111.6° | 108.7° |
| N1 | C10 | C11 | 113.4° | 109.9° |
| N1 | C10 | C12 | 103.2° | 107.3° |
| N1 | C10 | H10 | 110.2° | 109.9° |
| C10 | N1 | C1 | 123.9° | 125.7° |
| N1 | C14 | C13 | 103.4° | 104.7° |
| N1 | C14 | H15 | 111.0° | 110.4° |
| N1 | C14 | H16 | 110.9° | 110.4° |
| C14 | N1 | C1 | 124.4° | 125.6° |
| C11 | C10 | C12 | 111.4° | 109.9° |
| C11 | C10 | H10 | 109.3° | 109.8° |
| C10 | C11 | O2 | 119.8° | 120.0° |
| C10 | C11 | N2 | 117.0° | 120.0° |
| C12 | C10 | H10 | 109.3° | 110.0° |
| C10 | C12 | C13 | 103.5° | 102.9° |
| C10 | C12 | H11 | 110.9° | 110.8° |
| C10 | C12 | H12 | 111.0° | 110.7° |
| O2 | C11 | N2 | 123.2° | 120.0° |
| C13 | C12 | H11 | 110.9° | 110.7° |
| C13 | C12 | H12 | 110.9° | 110.7° |
| C12 | C13 | C14 | 105.0° | 101.5° |
| C12 | C13 | H13 | 110.6° | 111.0° |
| C12 | C13 | H14 | 110.6° | 111.0° |
| H11 | C12 | H12 | 109.5° | 110.8° |
| C14 | C13 | H13 | 110.6° | 111.2° |
| C14 | C13 | H14 | 110.6° | 110.9° |
| C13 | C14 | H15 | 111.0° | 110.5° |
| C13 | C14 | H16 | 111.0° | 110.3° |
| H13 | C13 | H14 | 109.5° | 111.0° |
| H15 | C14 | H16 | 109.5° | 110.4° |
| C15 | N2 | H17 | 119.2° | 120.0° |
| N2 | C15 | C16 | 113.1° | 109.4° |
| N2 | C15 | C17 | 113.0° | 109.5° |
| N2 | C15 | H18 | 106.5° | 109.5° |
| C15 | N2 | C11 | 121.6° | 119.9° |
| H17 | N2 | C11 | 119.2° | 120.0° |
| C16 | C15 | C17 | 112.0° | 109.5° |
| C16 | C15 | H18 | 105.7° | 109.5° |
| C15 | C16 | O3 | 121.2° | 120.0° |
| C15 | C16 | N3 | 115.2° | 120.0° |
| C17 | C15 | H18 | 105.7° | 109.5° |
| C15 | C17 | C18 | 123.0° | 109.5° |
| C15 | C17 | H19 | 106.0° | 109.5° |
| C15 | C17 | H20 | 106.0° | 109.4° |
| O3 | C16 | N3 | 123.5° | 119.9° |
| C18 | C17 | H19 | 106.0° | 109.5° |
| C18 | C17 | H20 | 106.0° | 109.5° |
| C17 | C18 | C19 | 106.4° | 109.5° |
| C17 | C18 | C20 | 111.0° | 109.5° |
| C17 | C18 | H21 | 109.7° | 109.4° |
| H19 | C17 | H20 | 109.4° | 109.5° |
| C19 | C18 | C20 | 110.2° | 109.5° |
| C19 | C18 | H21 | 109.8° | 109.5° |
| C18 | C19 | H22 | 109.5° | 109.4° |
| C18 | C19 | H23 | 109.5° | 109.5° |
| C18 | C19 | H24 | 109.5° | 109.5° |
| C20 | C18 | H21 | 109.6° | 109.5° |
| C18 | C20 | H25 | 109.5° | 109.5° |
| C18 | C20 | H26 | 109.5° | 109.5° |
| C18 | C20 | H27 | 109.5° | 109.5° |
| H22 | C19 | H23 | 109.5° | 109.4° |
| H22 | C19 | H24 | 109.5° | 109.4° |
| H23 | C19 | H24 | 109.5° | 109.5° |
| H25 | C20 | H26 | 109.4° | 109.4° |
| H25 | C20 | H27 | 109.5° | 109.5° |
| H26 | C20 | H27 | 109.5° | 109.5° |
| C21 | N3 | H28 | 118.4° | 120.0° |
| N3 | C21 | C22 | 109.0° | 109.5° |
| N3 | C21 | C23 | 110.2° | 109.5° |
| N3 | C21 | H29 | 109.8° | 109.5° |
| C21 | N3 | C16 | 123.3° | 120.0° |
| H28 | N3 | C16 | 118.3° | 119.9° |
| C22 | C21 | C23 | 110.3° | 109.5° |
| C22 | C21 | H29 | 108.9° | 109.5° |
| C21 | C22 | O4 | 120.7° | 120.0° |
| C21 | C22 | N6 | 116.3° | 120.0° |
| C23 | C21 | H29 | 108.7° | 109.5° |
| C21 | C23 | C24 | 113.7° | 109.4° |
| C21 | C23 | H30 | 108.4° | 109.5° |
| C21 | C23 | H31 | 108.4° | 109.5° |
| O4 | C22 | N6 | 123.0° | 120.0° |
| C24 | C23 | H30 | 108.4° | 109.4° |
| C24 | C23 | H31 | 108.4° | 109.4° |
| C23 | C24 | N4 | 122.7° | 126.0° |
| C23 | C24 | C25 | 131.3° | 126.0° |
| H30 | C23 | H31 | 109.5° | 109.5° |
| N4 | C24 | C25 | 106.1° | 108.1° |
| C24 | N4 | C26 | 109.4° | 109.3° |
| C24 | N4 | H32 | 125.3° | 125.4° |
| C24 | C25 | N5 | 107.2° | 106.8° |
| C24 | C25 | H33 | 126.4° | 126.6° |
| C26 | N4 | H32 | 125.3° | 125.4° |
| N4 | C26 | N5 | 108.4° | 108.7° |
| N4 | C26 | H34 | 125.8° | 125.7° |
| N5 | C25 | H33 | 126.4° | 126.6° |
| C25 | N5 | C26 | 108.9° | 107.2° |
| C25 | N5 | H35 | 125.5° | 126.4° |
| N5 | C26 | H34 | 125.8° | 125.6° |
| C26 | N5 | H35 | 125.6° | 126.4° |
| C27 | N6 | H36 | 119.1° | 120.0° |
| N6 | C27 | C28 | 110.2° | 109.5° |
| N6 | C27 | C29 | 110.0° | 109.5° |
| N6 | C27 | H37 | 109.1° | 109.4° |
| C27 | N6 | C22 | 121.8° | 120.0° |
| H36 | N6 | C22 | 119.1° | 120.0° |
| C28 | C27 | C29 | 111.2° | 109.5° |
| C28 | C27 | H37 | 108.0° | 109.5° |
| C27 | C28 | O5 | 120.7° | 120.0° |
| C27 | C28 | N7 | 116.3° | 120.0° |
| C29 | C27 | H37 | 108.1° | 109.5° |
| C27 | C29 | O6 | 110.7° | 109.5° |
| C27 | C29 | H38 | 109.2° | 109.4° |
| C27 | C29 | H39 | 109.2° | 109.4° |
| O5 | C28 | N7 | 123.0° | 120.0° |
| O6 | C29 | H38 | 109.2° | 109.5° |
| O6 | C29 | H39 | 109.2° | 109.5° |
| C29 | O6 | H40 | 109.5° | 114.0° |
| H38 | C29 | H39 | 109.4° | 109.4° |
| C30 | N7 | H41 | 118.5° | 120.0° |
| N7 | C30 | C31 | 108.8° | 109.5° |
| N7 | C30 | C33 | 113.1° | 109.5° |
| N7 | C30 | H42 | 108.0° | 109.5° |
| C30 | N7 | C28 | 123.0° | 120.0° |
| H41 | N7 | C28 | 118.5° | 120.0° |
| C31 | C30 | C33 | 111.9° | 109.5° |
| C31 | C30 | H42 | 107.3° | 109.5° |
| C30 | C31 | C32 | 112.1° | 109.5° |
| C30 | C31 | O7 | 108.2° | 109.5° |
| C30 | C31 | H43 | 108.9° | 109.5° |
| C33 | C30 | H42 | 107.5° | 109.4° |
| C30 | C33 | O11 | 120.8° | 120.0° |
| C30 | C33 | N8 | 115.7° | 120.0° |
| C32 | C31 | O7 | 108.4° | 109.5° |
| C32 | C31 | H43 | 108.9° | 109.5° |
| C31 | C32 | H44 | 109.5° | 109.5° |
| C31 | C32 | H45 | 109.5° | 109.5° |
| C31 | C32 | H46 | 109.5° | 109.5° |
| O7 | C31 | H43 | 110.3° | 109.4° |
| C31 | O7 | P1 | 123.8° | 123.0° |
| H44 | C32 | H45 | 109.5° | 109.5° |
| H44 | C32 | H46 | 109.4° | 109.4° |
| H45 | C32 | H46 | 109.5° | 109.5° |
| O7 | P1 | O8 | 104.3° | 109.5° |
| O7 | P1 | O9 | 105.3° | 109.5° |
| O7 | P1 | O10 | 103.5° | 109.5° |
| O8 | P1 | O9 | 115.0° | 109.4° |
| O8 | P1 | O10 | 113.2° | 109.5° |
| O9 | P1 | O10 | 114.0° | 109.5° |
| P1 | O9 | H47 | 109.5° | 114.0° |
| P1 | O10 | H48 | 109.5° | 113.9° |
| O11 | C33 | N8 | 123.4° | 120.0° |
| C34 | N8 | H49 | 118.6° | 120.1° |
| N8 | C34 | C35 | 111.2° | 109.4° |
| N8 | C34 | C36 | 110.7° | 109.5° |
| N8 | C34 | H50 | 108.7° | 109.5° |
| C34 | N8 | C33 | 122.9° | 120.0° |
| H49 | N8 | C33 | 118.5° | 120.0° |
| C35 | C34 | C36 | 110.2° | 109.5° |
| C35 | C34 | H50 | 108.0° | 109.5° |
| C34 | C35 | O12 | 120.4° | 120.0° |
| C34 | C35 | N9 | 123.4° | 120.0° |
| C36 | C34 | H50 | 107.9° | 109.5° |
| C34 | C36 | H51 | 109.5° | 109.4° |
| C34 | C36 | H52 | 109.4° | 109.5° |
| C34 | C36 | H53 | 109.5° | 109.5° |
| O12 | C35 | N9 | 115.9° | 120.0° |
| H51 | C36 | H52 | 109.4° | 109.4° |
| H51 | C36 | H53 | 109.5° | 109.5° |
| H52 | C36 | H53 | 109.5° | 109.5° |
| H54 | N9 | H55 | 120.0° | 120.0° |
| H54 | N9 | C35 | 120.0° | 120.0° |
| H55 | N9 | C35 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | N1 | 179.9° | 179.7° |
| O1 | C1 | C2 | C3 | 11.8° | 0.0° |
| O1 | C1 | C2 | H1 | 132.1° | 120.0° |
| O1 | C1 | C2 | H2 | 108.5° | 120.0° |
| O1 | C1 | N1 | C10 | 2.3° | 0.0° |
| O1 | C1 | N1 | C14 | 178.3° | 179.7° |
| C1 | C2 | C3 | H1 | 120.3° | 120.0° |
| C1 | C2 | C3 | H2 | 120.3° | 120.0° |
| C1 | C2 | H1 | H2 | 119.1° | 120.0° |
| C1 | C2 | C3 | C4 | 165.9° | 180.0° |
| C1 | C2 | C3 | H3 | 45.3° | 60.0° |
| C1 | C2 | C3 | H4 | 73.5° | 60.0° |
| C2 | C1 | N1 | C10 | 177.8° | 179.7° |
| C2 | C1 | N1 | C14 | 1.8° | 0.6° |
| C3 | C2 | H1 | H2 | 119.2° | 120.0° |
| C2 | C3 | C4 | H3 | 120.6° | 120.0° |
| C2 | C3 | C4 | H4 | 120.6° | 120.0° |
| C2 | C3 | H3 | H4 | 118.1° | 120.0° |
| C2 | C3 | C4 | C5 | 108.6° | 90.0° |
| C2 | C3 | C4 | C9 | 71.5° | 90.2° |
| C3 | C2 | C1 | N1 | 168.1° | 179.7° |
| H1 | C2 | C3 | C4 | 73.8° | 60.0° |
| H1 | C2 | C3 | H3 | 165.5° | 180.0° |
| H1 | C2 | C3 | H4 | 46.8° | 60.0° |
| H1 | C2 | C1 | N1 | 47.8° | 59.7° |
| H2 | C2 | C3 | C4 | 45.6° | 60.0° |
| H2 | C2 | C3 | H3 | 75.0° | 60.0° |
| H2 | C2 | C3 | H4 | 166.2° | 180.0° |
| H2 | C2 | C1 | N1 | 71.6° | 60.3° |
| C4 | C3 | H3 | H4 | 118.1° | 120.0° |
| C3 | C4 | C5 | C9 | 179.9° | 179.8° |
| C3 | C4 | C5 | C6 | 179.9° | 180.0° |
| C3 | C4 | C5 | H5 | 0.1° | 0.0° |
| C3 | C4 | C9 | C8 | 179.8° | 179.7° |
| C3 | C4 | C9 | H9 | 0.1° | 0.0° |
| H3 | C3 | C4 | C5 | 12.0° | 30.0° |
| H3 | C3 | C4 | C9 | 167.8° | 149.7° |
| H4 | C3 | C4 | C5 | 130.8° | 150.0° |
| H4 | C3 | C4 | C9 | 49.1° | 29.7° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 0.5° | 0.0° |
| C4 | C5 | C6 | H6 | 179.6° | 180.0° |
| C5 | C4 | C9 | C8 | 0.0° | 0.5° |
| C5 | C4 | C9 | H9 | 180.0° | 179.7° |
| C9 | C4 | C5 | C6 | 0.3° | 0.3° |
| C9 | C4 | C5 | H5 | 179.7° | 179.8° |
| C4 | C9 | C8 | C7 | 0.1° | 0.4° |
| C4 | C9 | C8 | H9 | 180.0° | 179.8° |
| C4 | C9 | C8 | H8 | 179.9° | 179.7° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 0.4° | 0.1° |
| C5 | C6 | C7 | H7 | 179.6° | 180.0° |
| H5 | C5 | C6 | C7 | 179.5° | 180.0° |
| H5 | C5 | C6 | H6 | 0.4° | 0.0° |
| C6 | C7 | C8 | H7 | 180.0° | 179.9° |
| C6 | C7 | C8 | C9 | 0.1° | 0.1° |
| C6 | C7 | C8 | H8 | 179.9° | 180.0° |
| H6 | C6 | C7 | C8 | 179.6° | 180.0° |
| H6 | C6 | C7 | H7 | 0.4° | 0.0° |
| C7 | C8 | C9 | H8 | 180.0° | 179.9° |
| C7 | C8 | C9 | H9 | 180.0° | 179.8° |
| H7 | C7 | C8 | C9 | 179.9° | 179.8° |
| H7 | C7 | C8 | H8 | 0.1° | 0.1° |
| H8 | C8 | C9 | H9 | 0.1° | 0.1° |
| C10 | N1 | C14 | C1 | 176.4° | 179.7° |
| N1 | C10 | C11 | C12 | 115.8° | 117.8° |
| N1 | C10 | C11 | H10 | 123.3° | 121.0° |
| N1 | C10 | C12 | H10 | 117.2° | 119.5° |
| N1 | C10 | C11 | O2 | 150.1° | 0.0° |
| N1 | C10 | C12 | C13 | 30.8° | 22.2° |
| N1 | C10 | C12 | H11 | 88.2° | 140.5° |
| N1 | C10 | C12 | H12 | 149.9° | 96.2° |
| C10 | N1 | C14 | C13 | 9.0° | 24.5° |
| C10 | N1 | C14 | H15 | 128.0° | 94.5° |
| C10 | N1 | C14 | H16 | 110.1° | 143.2° |
| N1 | C10 | C11 | N2 | 30.5° | 180.0° |
| C14 | N1 | C10 | C11 | 134.1° | 120.7° |
| C14 | N1 | C10 | C12 | 13.6° | 1.3° |
| C14 | N1 | C10 | H10 | 103.0° | 118.3° |
| N1 | C14 | C13 | C12 | 28.6° | 37.3° |
| N1 | C14 | C13 | H15 | 119.0° | 118.9° |
| N1 | C14 | C13 | H16 | 119.0° | 118.7° |
| N1 | C14 | C13 | H13 | 147.9° | 80.8° |
| N1 | C14 | C13 | H14 | 90.7° | 155.2° |
| N1 | C14 | H15 | H16 | 122.8° | 122.3° |
| C11 | C10 | C12 | H10 | 120.9° | 121.0° |
| C10 | C11 | O2 | N2 | 179.4° | 180.0° |
| C11 | C10 | C12 | C13 | 152.8° | 97.2° |
| C11 | C10 | C12 | H11 | 33.7° | 21.1° |
| C11 | C10 | C12 | H12 | 88.2° | 144.4° |
| C10 | C11 | N2 | C15 | 162.4° | 180.0° |
| C10 | C11 | N2 | H17 | 17.6° | 0.0° |
| C11 | C10 | N1 | C1 | 49.4° | 59.6° |
| C12 | C10 | C11 | O2 | 94.1° | 117.8° |
| C10 | C12 | C13 | H11 | 119.0° | 118.4° |
| C10 | C12 | C13 | H12 | 119.1° | 118.4° |
| C10 | C12 | H11 | H12 | 122.8° | 123.3° |
| C10 | C12 | C13 | C14 | 37.2° | 35.7° |
| C10 | C12 | C13 | H13 | 156.5° | 82.6° |
| C10 | C12 | C13 | H14 | 82.1° | 153.6° |
| C12 | C10 | N1 | C1 | 170.0° | 179.0° |
| C12 | C10 | C11 | N2 | 85.3° | 62.1° |
| H10 | C10 | C11 | O2 | 26.7° | 121.0° |
| H10 | C10 | C12 | C13 | 86.4° | 141.7° |
| H10 | C10 | C12 | H11 | 154.6° | 99.9° |
| H10 | C10 | C12 | H12 | 32.7° | 23.4° |
| H10 | C10 | N1 | C1 | 73.4° | 61.4° |
| H10 | C10 | C11 | N2 | 153.8° | 59.0° |
| O2 | C11 | N2 | C15 | 18.2° | 0.1° |
| O2 | C11 | N2 | H17 | 161.8° | 180.0° |
| C13 | C12 | H11 | H12 | 122.7° | 123.2° |
| C12 | C13 | C14 | H13 | 119.3° | 118.1° |
| C12 | C13 | C14 | H14 | 119.3° | 117.9° |
| C12 | C13 | H13 | H14 | 122.1° | 123.9° |
| C12 | C13 | C14 | H15 | 147.6° | 81.6° |
| C12 | C13 | C14 | H16 | 90.4° | 156.0° |
| H11 | C12 | C13 | C14 | 81.8° | 154.1° |
| H11 | C12 | C13 | H13 | 37.5° | 35.8° |
| H11 | C12 | C13 | H14 | 158.9° | 88.0° |
| H12 | C12 | C13 | C14 | 156.3° | 82.7° |
| H12 | C12 | C13 | H13 | 84.4° | 159.1° |
| H12 | C12 | C13 | H14 | 37.0° | 35.2° |
| C14 | C13 | H13 | H14 | 122.1° | 124.0° |
| C13 | C14 | H15 | H16 | 122.9° | 122.3° |
| C13 | C14 | N1 | C1 | 167.5° | 155.8° |
| H13 | C13 | C14 | H15 | 93.1° | 160.4° |
| H13 | C13 | C14 | H16 | 28.9° | 37.9° |
| H14 | C13 | C14 | H15 | 28.3° | 36.4° |
| H14 | C13 | C14 | H16 | 150.3° | 86.1° |
| H15 | C14 | N1 | C1 | 48.4° | 85.2° |
| H16 | C14 | N1 | C1 | 73.5° | 37.1° |
| C15 | N2 | H17 | C11 | 180.0° | 180.0° |
| N2 | C15 | C16 | C17 | 129.1° | 120.0° |
| N2 | C15 | C16 | H18 | 116.2° | 120.0° |
| N2 | C15 | C17 | H18 | 116.1° | 120.0° |
| N2 | C15 | C16 | O3 | 23.1° | 0.0° |
| N2 | C15 | C17 | C18 | 63.5° | 65.0° |
| N2 | C15 | C17 | H19 | 174.6° | 55.0° |
| N2 | C15 | C17 | H20 | 58.3° | 175.0° |
| N2 | C15 | C16 | N3 | 156.2° | 180.0° |
| H17 | N2 | C15 | C16 | 29.5° | 25.0° |
| H17 | N2 | C15 | C17 | 99.1° | 95.0° |
| H17 | N2 | C15 | H18 | 145.2° | 145.0° |
| C16 | C15 | C17 | H18 | 114.7° | 120.0° |
| C15 | C16 | O3 | N3 | 179.3° | 180.0° |
| C16 | C15 | C17 | C18 | 65.7° | 175.0° |
| C16 | C15 | C17 | H19 | 56.2° | 65.0° |
| C16 | C15 | C17 | H20 | 172.5° | 55.0° |
| C15 | C16 | N3 | C21 | 167.8° | 180.0° |
| C15 | C16 | N3 | H28 | 12.2° | 0.0° |
| C16 | C15 | N2 | C11 | 150.5° | 155.0° |
| C17 | C15 | C16 | O3 | 106.0° | 120.0° |
| C15 | C17 | C18 | H19 | 121.9° | 120.0° |
| C15 | C17 | C18 | H20 | 121.9° | 119.9° |
| C15 | C17 | H19 | H20 | 113.9° | 119.9° |
| C15 | C17 | C18 | C19 | 150.6° | 175.0° |
| C15 | C17 | C18 | C20 | 89.4° | 65.0° |
| C15 | C17 | C18 | H21 | 31.9° | 55.0° |
| C17 | C15 | N2 | C11 | 80.9° | 85.0° |
| C17 | C15 | C16 | N3 | 74.7° | 60.0° |
| H18 | C15 | C16 | O3 | 139.3° | 120.0° |
| H18 | C15 | C17 | C18 | 179.6° | 55.0° |
| H18 | C15 | C17 | H19 | 58.5° | 175.0° |
| H18 | C15 | C17 | H20 | 57.8° | 65.0° |
| H18 | C15 | N2 | C11 | 34.8° | 35.0° |
| H18 | C15 | C16 | N3 | 40.0° | 60.0° |
| O3 | C16 | N3 | C21 | 11.5° | 0.0° |
| O3 | C16 | N3 | H28 | 168.4° | 180.0° |
| C18 | C17 | H19 | H20 | 113.9° | 120.0° |
| C17 | C18 | C19 | C20 | 120.5° | 120.0° |
| C17 | C18 | C19 | H21 | 118.6° | 119.9° |
| C17 | C18 | C20 | H21 | 121.3° | 119.9° |
| C17 | C18 | C19 | H22 | 180.0° | 60.0° |
| C17 | C18 | C19 | H23 | 60.0° | 180.0° |
| C17 | C18 | C19 | H24 | 60.0° | 59.9° |
| C17 | C18 | C20 | H25 | 180.0° | 60.0° |
| C17 | C18 | C20 | H26 | 60.0° | 180.0° |
| C17 | C18 | C20 | H27 | 60.0° | 60.0° |
| H19 | C17 | C18 | C19 | 28.8° | 55.0° |
| H19 | C17 | C18 | C20 | 148.7° | 175.0° |
| H19 | C17 | C18 | H21 | 90.0° | 65.0° |
| H20 | C17 | C18 | C19 | 87.5° | 65.1° |
| H20 | C17 | C18 | C20 | 32.5° | 55.0° |
| H20 | C17 | C18 | H21 | 153.8° | 175.0° |
| C19 | C18 | C20 | H21 | 121.0° | 120.1° |
| C18 | C19 | H22 | H23 | 120.0° | 120.0° |
| C18 | C19 | H22 | H24 | 120.0° | 120.0° |
| C18 | C19 | H23 | H24 | 120.0° | 120.1° |
| C19 | C18 | C20 | H25 | 62.3° | 180.0° |
| C19 | C18 | C20 | H26 | 57.7° | 60.0° |
| C19 | C18 | C20 | H27 | 177.7° | 60.0° |
| C20 | C18 | C19 | H22 | 59.5° | 60.0° |
| C20 | C18 | C19 | H23 | 179.5° | 60.0° |
| C20 | C18 | C19 | H24 | 60.5° | 180.0° |
| C18 | C20 | H25 | H26 | 120.0° | 120.0° |
| C18 | C20 | H25 | H27 | 120.0° | 120.0° |
| C18 | C20 | H26 | H27 | 120.0° | 120.0° |
| H21 | C18 | C19 | H22 | 61.4° | 179.9° |
| H21 | C18 | C19 | H23 | 58.6° | 60.1° |
| H21 | C18 | C19 | H24 | 178.6° | 60.0° |
| H21 | C18 | C20 | H25 | 58.7° | 59.9° |
| H21 | C18 | C20 | H26 | 178.7° | 60.1° |
| H21 | C18 | C20 | H27 | 61.3° | 179.9° |
| H22 | C19 | H23 | H24 | 120.0° | 120.0° |
| H25 | C20 | H26 | H27 | 119.9° | 120.0° |
| C21 | N3 | H28 | C16 | 180.0° | 180.0° |
| N3 | C21 | C22 | C23 | 121.1° | 120.0° |
| N3 | C21 | C22 | H29 | 119.7° | 120.0° |
| N3 | C21 | C23 | H29 | 120.3° | 120.0° |
| N3 | C21 | C22 | O4 | 9.7° | 0.0° |
| N3 | C21 | C23 | C24 | 49.4° | 65.0° |
| N3 | C21 | C23 | H30 | 170.0° | 54.9° |
| N3 | C21 | C23 | H31 | 71.2° | 175.0° |
| N3 | C21 | C22 | N6 | 170.0° | 180.0° |
| H28 | N3 | C21 | C22 | 25.2° | 25.0° |
| H28 | N3 | C21 | C23 | 96.0° | 95.0° |
| H28 | N3 | C21 | H29 | 144.3° | 145.0° |
| C22 | C21 | C23 | H29 | 119.3° | 120.0° |
| C21 | C22 | O4 | N6 | 179.6° | 180.0° |
| C22 | C21 | C23 | C24 | 70.9° | 175.0° |
| C22 | C21 | C23 | H30 | 49.7° | 65.0° |
| C22 | C21 | C23 | H31 | 168.4° | 55.1° |
| C21 | C22 | N6 | C27 | 175.7° | 180.0° |
| C21 | C22 | N6 | H36 | 4.3° | 0.1° |
| C22 | C21 | N3 | C16 | 154.8° | 155.0° |
| C23 | C21 | C22 | O4 | 111.4° | 120.0° |
| C21 | C23 | C24 | H30 | 120.6° | 120.0° |
| C21 | C23 | C24 | H31 | 120.6° | 120.0° |
| C21 | C23 | H30 | H31 | 118.1° | 120.1° |
| C21 | C23 | C24 | N4 | 79.4° | 95.1° |
| C21 | C23 | C24 | C25 | 99.9° | 85.3° |
| C23 | C21 | N3 | C16 | 84.1° | 85.0° |
| C23 | C21 | C22 | N6 | 69.0° | 60.0° |
| H29 | C21 | C22 | O4 | 129.4° | 120.0° |
| H29 | C21 | C23 | C24 | 169.7° | 55.0° |
| H29 | C21 | C23 | H30 | 69.7° | 174.9° |
| H29 | C21 | C23 | H31 | 49.1° | 65.0° |
| H29 | C21 | N3 | C16 | 35.6° | 35.0° |
| H29 | C21 | C22 | N6 | 50.2° | 60.0° |
| O4 | C22 | N6 | C27 | 4.7° | 0.0° |
| O4 | C22 | N6 | H36 | 175.3° | 180.0° |
| C24 | C23 | H30 | H31 | 118.0° | 120.0° |
| C23 | C24 | N4 | C25 | 179.5° | 179.6° |
| C23 | C24 | N4 | C26 | 179.3° | 179.9° |
| C23 | C24 | N4 | H32 | 0.8° | 0.1° |
| C23 | C24 | C25 | N5 | 179.4° | 180.0° |
| C23 | C24 | C25 | H33 | 0.7° | 0.1° |
| H30 | C23 | C24 | N4 | 41.2° | 24.9° |
| H30 | C23 | C24 | C25 | 139.4° | 154.7° |
| H31 | C23 | C24 | N4 | 160.0° | 144.9° |
| H31 | C23 | C24 | C25 | 20.7° | 34.6° |
| C24 | N4 | C26 | H32 | 180.0° | 179.9° |
| N4 | C24 | C25 | N5 | 0.1° | 0.3° |
| N4 | C24 | C25 | H33 | 179.9° | 179.7° |
| C24 | N4 | C26 | N5 | 0.3° | 0.2° |
| C24 | N4 | C26 | H34 | 179.7° | 180.0° |
| C25 | C24 | N4 | C26 | 0.2° | 0.3° |
| C25 | C24 | N4 | H32 | 179.8° | 179.8° |
| C24 | C25 | N5 | H33 | 180.0° | 180.0° |
| C24 | C25 | N5 | C26 | 0.1° | 0.2° |
| C24 | C25 | N5 | H35 | 179.9° | 180.0° |
| N4 | C26 | N5 | C25 | 0.2° | 0.0° |
| N4 | C26 | N5 | H34 | 180.0° | 179.8° |
| N4 | C26 | N5 | H35 | 179.8° | 179.8° |
| H32 | N4 | C26 | N5 | 179.7° | 179.9° |
| H32 | N4 | C26 | H34 | 0.3° | 0.1° |
| C25 | N5 | C26 | H35 | 180.0° | 179.8° |
| C25 | N5 | C26 | H34 | 179.8° | 179.8° |
| H33 | C25 | N5 | C26 | 179.9° | 179.8° |
| H33 | C25 | N5 | H35 | 0.1° | 0.0° |
| H34 | C26 | N5 | H35 | 0.2° | 0.0° |
| C27 | N6 | H36 | C22 | 180.0° | 179.9° |
| N6 | C27 | C28 | C29 | 122.4° | 120.0° |
| N6 | C27 | C28 | H37 | 119.1° | 119.9° |
| N6 | C27 | C29 | H37 | 119.0° | 119.9° |
| N6 | C27 | C28 | O5 | 2.0° | 0.0° |
| N6 | C27 | C29 | O6 | 55.6° | 65.0° |
| N6 | C27 | C29 | H38 | 175.8° | 174.9° |
| N6 | C27 | C29 | H39 | 64.6° | 55.0° |
| N6 | C27 | C28 | N7 | 177.9° | 180.0° |
| H36 | N6 | C27 | C28 | 110.0° | 25.1° |
| H36 | N6 | C27 | C29 | 13.1° | 95.0° |
| H36 | N6 | C27 | H37 | 131.5° | 145.1° |
| C28 | C27 | C29 | H37 | 118.5° | 120.0° |
| C27 | C28 | O5 | N7 | 179.8° | 180.0° |
| C28 | C27 | C29 | O6 | 66.9° | 55.0° |
| C28 | C27 | C29 | H38 | 53.3° | 65.0° |
| C28 | C27 | C29 | H39 | 172.9° | 175.0° |
| C27 | C28 | N7 | C30 | 176.5° | 180.0° |
| C27 | C28 | N7 | H41 | 3.5° | 0.0° |
| C28 | C27 | N6 | C22 | 70.0° | 155.0° |
| C29 | C27 | C28 | O5 | 120.4° | 120.0° |
| C27 | C29 | O6 | H38 | 120.2° | 120.0° |
| C27 | C29 | O6 | H39 | 120.2° | 120.0° |
| C27 | C29 | H38 | H39 | 119.4° | 119.9° |
| C27 | C29 | O6 | H40 | 180.0° | 180.0° |
| C29 | C27 | N6 | C22 | 166.9° | 85.0° |
| C29 | C27 | C28 | N7 | 59.8° | 60.0° |
| H37 | C27 | C28 | O5 | 121.1° | 120.0° |
| H37 | C27 | C29 | O6 | 174.6° | 175.0° |
| H37 | C27 | C29 | H38 | 65.2° | 55.0° |
| H37 | C27 | C29 | H39 | 54.4° | 64.9° |
| H37 | C27 | N6 | C22 | 48.5° | 35.0° |
| H37 | C27 | C28 | N7 | 58.7° | 60.0° |
| O5 | C28 | N7 | C30 | 3.3° | 0.0° |
| O5 | C28 | N7 | H41 | 176.6° | 180.0° |
| O6 | C29 | H38 | H39 | 119.4° | 120.0° |
| H38 | C29 | O6 | H40 | 59.8° | 60.0° |
| H39 | C29 | O6 | H40 | 59.8° | 60.0° |
| C30 | N7 | H41 | C28 | 180.0° | 180.0° |
| N7 | C30 | C31 | C33 | 125.7° | 120.0° |
| N7 | C30 | C31 | H42 | 116.6° | 120.0° |
| N7 | C30 | C33 | H42 | 119.2° | 120.0° |
| N7 | C30 | C31 | C32 | 176.0° | 55.0° |
| N7 | C30 | C31 | O7 | 56.4° | 65.0° |
| N7 | C30 | C31 | H43 | 63.4° | 175.0° |
| N7 | C30 | C33 | O11 | 50.1° | 0.0° |
| N7 | C30 | C33 | N8 | 129.6° | 180.0° |
| H41 | N7 | C30 | C31 | 0.6° | 95.0° |
| H41 | N7 | C30 | C33 | 124.4° | 25.0° |
| H41 | N7 | C30 | H42 | 116.7° | 144.9° |
| C31 | C30 | C33 | H42 | 117.5° | 120.0° |
| C30 | C31 | C32 | O7 | 119.5° | 120.0° |
| C30 | C31 | C32 | H43 | 120.5° | 120.0° |
| C30 | C31 | O7 | H43 | 119.0° | 120.0° |
| C30 | C31 | C32 | H44 | 180.0° | 60.0° |
| C30 | C31 | C32 | H45 | 60.0° | 180.0° |
| C30 | C31 | C32 | H46 | 60.0° | 60.0° |
| C30 | C31 | O7 | P1 | 110.6° | 120.0° |
| C31 | C30 | C33 | O11 | 73.1° | 120.0° |
| C31 | C30 | N7 | C28 | 179.4° | 85.0° |
| C31 | C30 | C33 | N8 | 107.1° | 60.0° |
| C33 | C30 | C31 | C32 | 58.3° | 175.0° |
| C33 | C30 | C31 | O7 | 177.8° | 55.0° |
| C33 | C30 | C31 | H43 | 62.3° | 65.0° |
| C30 | C33 | O11 | N8 | 179.7° | 180.0° |
| C30 | C33 | N8 | C34 | 179.5° | 180.0° |
| C30 | C33 | N8 | H49 | 0.5° | 0.0° |
| C33 | C30 | N7 | C28 | 55.6° | 155.0° |
| H42 | C30 | C31 | C32 | 59.4° | 65.0° |
| H42 | C30 | C31 | O7 | 60.2° | 175.0° |
| H42 | C30 | C31 | H43 | 179.9° | 55.0° |
| H42 | C30 | C33 | O11 | 169.3° | 120.0° |
| H42 | C30 | N7 | C28 | 63.3° | 35.1° |
| H42 | C30 | C33 | N8 | 10.4° | 60.0° |
| C32 | C31 | O7 | H43 | 119.1° | 120.0° |
| C31 | C32 | H44 | H45 | 120.0° | 120.0° |
| C31 | C32 | H44 | H46 | 120.0° | 120.0° |
| C31 | C32 | H45 | H46 | 120.0° | 120.0° |
| C32 | C31 | O7 | P1 | 127.5° | 120.0° |
| O7 | C31 | C32 | H44 | 60.5° | 60.0° |
| O7 | C31 | C32 | H45 | 179.5° | 60.0° |
| O7 | C31 | C32 | H46 | 59.4° | 180.0° |
| C31 | O7 | P1 | O8 | 61.2° | 55.0° |
| C31 | O7 | P1 | O9 | 60.3° | 65.0° |
| C31 | O7 | P1 | O10 | 179.8° | 175.0° |
| H43 | C31 | C32 | H44 | 59.5° | 180.0° |
| H43 | C31 | C32 | H45 | 60.5° | 60.0° |
| H43 | C31 | C32 | H46 | 179.4° | 60.0° |
| H43 | C31 | O7 | P1 | 8.4° | 0.0° |
| H44 | C32 | H45 | H46 | 120.0° | 120.0° |
| O7 | P1 | O8 | O9 | 114.8° | 120.0° |
| O7 | P1 | O8 | O10 | 111.8° | 120.0° |
| O7 | P1 | O9 | O10 | 112.8° | 120.0° |
| O7 | P1 | O9 | H47 | 114.2° | 60.0° |
| O7 | P1 | O10 | H48 | 112.3° | 180.0° |
| O8 | P1 | O9 | O10 | 133.0° | 120.0° |
| O8 | P1 | O9 | H47 | 0.0° | 180.0° |
| O8 | P1 | O10 | H48 | 0.0° | 60.0° |
| O9 | P1 | O10 | H48 | 133.9° | 60.0° |
| O10 | P1 | O9 | H47 | 133.0° | 60.0° |
| O11 | C33 | N8 | C34 | 0.3° | 0.0° |
| O11 | C33 | N8 | H49 | 179.7° | 180.0° |
| C34 | N8 | H49 | C33 | 180.0° | 180.0° |
| N8 | C34 | C35 | C36 | 123.1° | 120.0° |
| N8 | C34 | C35 | H50 | 119.3° | 120.0° |
| N8 | C34 | C36 | H50 | 118.9° | 120.0° |
| N8 | C34 | C35 | O12 | 22.8° | 0.0° |
| N8 | C34 | C36 | H51 | 180.0° | 180.0° |
| N8 | C34 | C36 | H52 | 60.0° | 60.1° |
| N8 | C34 | C36 | H53 | 60.0° | 60.0° |
| N8 | C34 | C35 | N9 | 151.6° | 180.0° |
| H49 | N8 | C34 | C35 | 109.7° | 25.0° |
| H49 | N8 | C34 | C36 | 13.2° | 95.0° |
| H49 | N8 | C34 | H50 | 131.5° | 145.0° |
| C35 | C34 | C36 | H50 | 117.8° | 120.0° |
| C34 | C35 | O12 | N9 | 174.8° | 180.0° |
| C35 | C34 | C36 | H51 | 56.6° | 60.1° |
| C35 | C34 | C36 | H52 | 176.6° | 180.0° |
| C35 | C34 | C36 | H53 | 63.4° | 59.9° |
| C34 | C35 | N9 | H54 | 174.7° | 0.0° |
| C34 | C35 | N9 | H55 | 5.3° | 180.0° |
| C35 | C34 | N8 | C33 | 70.3° | 155.0° |
| C36 | C34 | C35 | O12 | 100.3° | 120.0° |
| C34 | C36 | H51 | H52 | 120.0° | 119.9° |
| C34 | C36 | H51 | H53 | 120.0° | 120.0° |
| C34 | C36 | H52 | H53 | 120.0° | 120.1° |
| C36 | C34 | N8 | C33 | 166.8° | 85.0° |
| C36 | C34 | C35 | N9 | 85.3° | 60.0° |
| H50 | C34 | C35 | O12 | 142.1° | 120.0° |
| H50 | C34 | C36 | H51 | 61.1° | 59.9° |
| H50 | C34 | C36 | H52 | 58.8° | 60.0° |
| H50 | C34 | C36 | H53 | 178.8° | 179.9° |
| H50 | C34 | N8 | C33 | 48.5° | 35.0° |
| H50 | C34 | C35 | N9 | 32.4° | 60.0° |
| O12 | C35 | N9 | H54 | 0.0° | 180.0° |
| O12 | C35 | N9 | H55 | 180.0° | 0.0° |
| H51 | C36 | H52 | H53 | 120.0° | 120.0° |
| H54 | N9 | H55 | C35 | 180.0° | 180.0° |
