PRD_000817
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | sing | 1.48Å | 1.50Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C1 | C2 | sing | 1.51Å | 1.55Å | |
| C1 | C3 | sing | 1.53Å | 1.56Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | O1 | doub | 1.21Å | 1.27Å | |
| C3 | O2 | sing | 1.43Å | 1.42Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| O2 | H5 | sing | 0.97Å | 0.95Å | |
| N2 | C4 | sing | 1.48Å | 1.49Å | |
| N2 | H6 | sing | 0.97Å | 1.00Å | |
| C4 | C5 | sing | 1.51Å | 1.53Å | |
| C4 | C6 | sing | 1.53Å | 1.58Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | O3 | doub | 1.21Å | 1.27Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| N3 | C7 | sing | 1.48Å | 1.48Å | |
| N3 | H11 | sing | 0.97Å | 1.00Å | |
| C7 | C8 | sing | 1.51Å | 1.50Å | |
| C7 | C9 | sing | 1.53Å | 1.52Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| C8 | O4 | doub | 1.21Å | 1.25Å | |
| C9 | C10 | sing | 1.53Å | 1.52Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | C11 | sing | 1.53Å | 1.51Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | C12 | sing | 1.53Å | 1.52Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | N4 | sing | 1.47Å | 1.49Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H20 | sing | 1.09Å | 1.10Å | |
| N4 | H21 | sing | 1.01Å | 1.00Å | |
| N4 | H22 | sing | 1.01Å | 1.00Å | |
| N4 | H23 | sing | 1.01Å | 1.00Å | |
| N5 | C13 | sing | 1.48Å | 1.48Å | |
| N5 | H24 | sing | 0.97Å | 1.00Å | |
| C13 | C14 | sing | 1.51Å | 1.53Å | |
| C13 | C15 | sing | 1.53Å | 1.58Å | |
| C13 | H25 | sing | 1.09Å | 1.10Å | |
| C14 | O5 | doub | 1.21Å | 1.28Å | |
| C15 | C16 | sing | 1.53Å | 1.54Å | |
| C15 | C17 | sing | 1.53Å | 1.52Å | |
| C15 | H26 | sing | 1.09Å | 1.10Å | |
| C16 | C18 | sing | 1.53Å | 1.55Å | |
| C16 | 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 | |
| N6 | C19 | sing | 1.48Å | 1.45Å | |
| N6 | H35 | sing | 0.97Å | 1.00Å | |
| C19 | C20 | sing | 1.51Å | 1.50Å | |
| C19 | C21 | sing | 1.53Å | 1.58Å | |
| C19 | H36 | sing | 1.09Å | 1.10Å | |
| C20 | O6 | doub | 1.21Å | 1.22Å | |
| C21 | C22 | sing | 1.51Å | 1.52Å | |
| C21 | H37 | sing | 1.09Å | 1.10Å | |
| C21 | H38 | sing | 1.09Å | 1.10Å | |
| C22 | O7 | doub | 1.21Å | 1.29Å | |
| C22 | O8 | sing | 1.34Å | 1.26Å | |
| O8 | H39 | sing | 0.97Å | 0.95Å | |
| N7 | C23 | sing | 1.48Å | 1.46Å | |
| N7 | H40 | sing | 0.97Å | 1.00Å | |
| C23 | C24 | sing | 1.51Å | 1.54Å | |
| C23 | C25 | sing | 1.53Å | 1.51Å | |
| C23 | H41 | sing | 1.09Å | 1.10Å | |
| C24 | O9 | doub | 1.21Å | 1.29Å | |
| C25 | C26 | sing | 1.51Å | 1.54Å | |
| C25 | H42 | sing | 1.09Å | 1.10Å | |
| C25 | H43 | sing | 1.09Å | 1.10Å | |
| C26 | O10 | doub | 1.21Å | 1.24Å | |
| C26 | N8 | sing | 1.35Å | 1.35Å | |
| N8 | H44 | sing | 0.97Å | 1.00Å | |
| N8 | H45 | sing | 0.97Å | 1.00Å | |
| N9 | C27 | sing | 1.48Å | 1.47Å | |
| N9 | H46 | sing | 0.97Å | 1.00Å | |
| C27 | C28 | sing | 1.51Å | 1.55Å | |
| C27 | C29 | sing | 1.53Å | 1.54Å | |
| C27 | H47 | sing | 1.09Å | 1.10Å | |
| C28 | O11 | doub | 1.21Å | 1.25Å | |
| C29 | C30 | sing | 1.53Å | 1.54Å | |
| C29 | H48 | sing | 1.09Å | 1.10Å | |
| C29 | H49 | sing | 1.09Å | 1.10Å | |
| C30 | C31 | sing | 1.53Å | 1.49Å | |
| C30 | C32 | sing | 1.53Å | 1.57Å | |
| C30 | H50 | sing | 1.09Å | 1.10Å | |
| C31 | H51 | sing | 1.09Å | 1.10Å | |
| C31 | H52 | sing | 1.09Å | 1.10Å | |
| C31 | H53 | sing | 1.09Å | 1.10Å | |
| C32 | H54 | sing | 1.09Å | 1.10Å | |
| C32 | H55 | sing | 1.09Å | 1.10Å | |
| C32 | H56 | sing | 1.09Å | 1.10Å | |
| N10 | C33 | sing | 1.48Å | 1.49Å | |
| N10 | H57 | sing | 0.97Å | 1.00Å | |
| C33 | C34 | sing | 1.51Å | 1.55Å | |
| C33 | C35 | sing | 1.53Å | 1.54Å | |
| C33 | H58 | sing | 1.09Å | 1.10Å | |
| C34 | O12 | doub | 1.21Å | 1.25Å | |
| C35 | C36 | sing | 1.51Å | 1.55Å | |
| C35 | H59 | sing | 1.09Å | 1.10Å | |
| C35 | H60 | sing | 1.09Å | 1.10Å | |
| C36 | O13 | doub | 1.21Å | 1.26Å | |
| C36 | O14 | sing | 1.34Å | 1.26Å | |
| O14 | H61 | sing | 0.97Å | 0.95Å | |
| N1 | C34 | sing | 1.37Å | 1.35Å | |
| C2 | N2 | sing | 1.36Å | 1.34Å | |
| C5 | N3 | sing | 1.37Å | 1.34Å | |
| C8 | N5 | sing | 1.36Å | 1.34Å | |
| C14 | N6 | sing | 1.37Å | 1.35Å | |
| C20 | N7 | sing | 1.36Å | 1.34Å | |
| C24 | N9 | sing | 1.37Å | 1.33Å | |
| C28 | N10 | sing | 1.36Å | 1.34Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N1 | H1 | 119.6° | 122.3° |
| N1 | C1 | C2 | 118.6° | 108.7° |
| N1 | C1 | C3 | 113.1° | 109.6° |
| N1 | C1 | H2 | 103.5° | 109.6° |
| C1 | N1 | C34 | 120.8° | 115.4° |
| H1 | N1 | C34 | 119.6° | 122.3° |
| C2 | C1 | C3 | 113.0° | 109.6° |
| C2 | C1 | H2 | 103.1° | 109.6° |
| C1 | C2 | O1 | 121.2° | 120.4° |
| C1 | C2 | N2 | 114.9° | 119.1° |
| C3 | C1 | H2 | 103.0° | 109.8° |
| C1 | C3 | O2 | 113.2° | 109.4° |
| C1 | C3 | H3 | 108.6° | 109.4° |
| C1 | C3 | H4 | 108.6° | 109.5° |
| O1 | C2 | N2 | 123.9° | 120.5° |
| O2 | C3 | H3 | 108.5° | 109.5° |
| O2 | C3 | H4 | 108.5° | 109.5° |
| C3 | O2 | H5 | 109.5° | 114.0° |
| H3 | C3 | H4 | 109.4° | 109.5° |
| C4 | N2 | H6 | 117.2° | 121.8° |
| N2 | C4 | C5 | 113.4° | 108.8° |
| N2 | C4 | C6 | 112.8° | 109.6° |
| N2 | C4 | H7 | 106.6° | 109.5° |
| C4 | N2 | C2 | 125.5° | 116.6° |
| H6 | N2 | C2 | 117.2° | 121.7° |
| C5 | C4 | C6 | 111.5° | 109.6° |
| C5 | C4 | H7 | 106.1° | 109.6° |
| C4 | C5 | O3 | 121.1° | 120.6° |
| C4 | C5 | N3 | 115.7° | 118.8° |
| C6 | C4 | H7 | 105.7° | 109.7° |
| C4 | C6 | H8 | 109.5° | 109.5° |
| C4 | C6 | H9 | 109.5° | 109.5° |
| C4 | C6 | H10 | 109.5° | 109.5° |
| O3 | C5 | N3 | 123.1° | 120.6° |
| H8 | C6 | H9 | 109.5° | 109.4° |
| H8 | C6 | H10 | 109.5° | 109.5° |
| H9 | C6 | H10 | 109.4° | 109.4° |
| C7 | N3 | H11 | 119.9° | 122.3° |
| N3 | C7 | C8 | 106.9° | 108.7° |
| N3 | C7 | C9 | 110.9° | 109.6° |
| N3 | C7 | H12 | 110.6° | 109.6° |
| C7 | N3 | C5 | 120.3° | 115.5° |
| H11 | N3 | C5 | 119.9° | 122.3° |
| C8 | C7 | C9 | 107.8° | 109.6° |
| C8 | C7 | H12 | 110.4° | 109.6° |
| C7 | C8 | O4 | 119.5° | 120.5° |
| C7 | C8 | N5 | 117.3° | 119.1° |
| C9 | C7 | H12 | 110.0° | 109.8° |
| C7 | C9 | C10 | 118.1° | 109.5° |
| C7 | C9 | H13 | 107.3° | 109.5° |
| C7 | C9 | H14 | 107.3° | 109.5° |
| O4 | C8 | N5 | 123.2° | 120.4° |
| C10 | C9 | H13 | 107.3° | 109.4° |
| C10 | C9 | H14 | 107.3° | 109.5° |
| C9 | C10 | C11 | 110.3° | 109.5° |
| C9 | C10 | H15 | 109.2° | 109.5° |
| C9 | C10 | H16 | 109.3° | 109.5° |
| H13 | C9 | H14 | 109.5° | 109.5° |
| C11 | C10 | H15 | 109.3° | 109.5° |
| C11 | C10 | H16 | 109.3° | 109.5° |
| C10 | C11 | C12 | 109.3° | 109.4° |
| C10 | C11 | H17 | 109.5° | 109.5° |
| C10 | C11 | H18 | 109.5° | 109.5° |
| H15 | C10 | H16 | 109.5° | 109.4° |
| C12 | C11 | H17 | 109.5° | 109.5° |
| C12 | C11 | H18 | 109.5° | 109.4° |
| C11 | C12 | N4 | 111.2° | 109.5° |
| C11 | C12 | H19 | 109.1° | 109.5° |
| C11 | C12 | H20 | 109.0° | 109.5° |
| H17 | C11 | H18 | 109.5° | 109.5° |
| N4 | C12 | H19 | 109.0° | 109.5° |
| N4 | C12 | H20 | 109.0° | 109.4° |
| C12 | N4 | H21 | 109.5° | 109.4° |
| C12 | N4 | H22 | 109.5° | 109.5° |
| C12 | N4 | H23 | 109.5° | 109.5° |
| H19 | C12 | H20 | 109.5° | 109.5° |
| H21 | N4 | H22 | 109.5° | 109.5° |
| H21 | N4 | H23 | 109.5° | 109.5° |
| H22 | N4 | H23 | 109.4° | 109.4° |
| C13 | N5 | H24 | 119.3° | 121.7° |
| N5 | C13 | C14 | 108.6° | 108.9° |
| N5 | C13 | C15 | 110.6° | 109.6° |
| N5 | C13 | H25 | 108.9° | 109.6° |
| C13 | N5 | C8 | 121.5° | 116.6° |
| H24 | N5 | C8 | 119.3° | 121.7° |
| C14 | C13 | C15 | 112.9° | 109.6° |
| C14 | C13 | H25 | 108.2° | 109.6° |
| C13 | C14 | O5 | 121.8° | 120.6° |
| C13 | C14 | N6 | 114.6° | 118.8° |
| C15 | C13 | H25 | 107.7° | 109.7° |
| C13 | C15 | C16 | 111.9° | 109.4° |
| C13 | C15 | C17 | 112.0° | 109.5° |
| C13 | C15 | H26 | 107.1° | 109.5° |
| O5 | C14 | N6 | 123.6° | 120.6° |
| C16 | C15 | C17 | 110.2° | 109.4° |
| C16 | C15 | H26 | 107.6° | 109.5° |
| C15 | C16 | C18 | 113.2° | 109.4° |
| C15 | C16 | H27 | 108.5° | 109.5° |
| C15 | C16 | H28 | 108.5° | 109.4° |
| C17 | C15 | H26 | 107.8° | 109.5° |
| C15 | C17 | H29 | 109.5° | 109.4° |
| C15 | C17 | H30 | 109.5° | 109.5° |
| C15 | C17 | H31 | 109.5° | 109.5° |
| C18 | C16 | H27 | 108.5° | 109.4° |
| C18 | C16 | H28 | 108.5° | 109.5° |
| C16 | C18 | H32 | 109.5° | 109.5° |
| C16 | C18 | H33 | 109.5° | 109.4° |
| C16 | C18 | H34 | 109.5° | 109.4° |
| H27 | C16 | H28 | 109.5° | 109.5° |
| 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 | 109.5° | 109.4° |
| H33 | C18 | H34 | 109.4° | 109.5° |
| C19 | N6 | H35 | 119.4° | 122.3° |
| N6 | C19 | C20 | 111.0° | 108.7° |
| N6 | C19 | C21 | 116.2° | 109.6° |
| N6 | C19 | H36 | 107.5° | 109.7° |
| C19 | N6 | C14 | 121.3° | 115.4° |
| H35 | N6 | C14 | 119.4° | 122.3° |
| C20 | C19 | C21 | 108.7° | 109.6° |
| C20 | C19 | H36 | 106.9° | 109.6° |
| C19 | C20 | O6 | 118.9° | 120.4° |
| C19 | C20 | N7 | 116.0° | 119.1° |
| C21 | C19 | H36 | 106.1° | 109.7° |
| C19 | C21 | C22 | 113.8° | 109.5° |
| C19 | C21 | H37 | 108.4° | 109.5° |
| C19 | C21 | H38 | 108.4° | 109.5° |
| O6 | C20 | N7 | 125.0° | 120.4° |
| C22 | C21 | H37 | 108.4° | 109.4° |
| C22 | C21 | H38 | 108.3° | 109.5° |
| C21 | C22 | O7 | 119.5° | 120.0° |
| C21 | C22 | O8 | 118.3° | 120.0° |
| H37 | C21 | H38 | 109.5° | 109.5° |
| O7 | C22 | O8 | 122.2° | 120.0° |
| C22 | O8 | H39 | 109.5° | 117.0° |
| C23 | N7 | H40 | 118.4° | 121.6° |
| N7 | C23 | C24 | 105.5° | 108.9° |
| N7 | C23 | C25 | 110.8° | 109.6° |
| N7 | C23 | H41 | 109.8° | 109.6° |
| C23 | N7 | C20 | 123.2° | 116.6° |
| H40 | N7 | C20 | 118.4° | 121.7° |
| C24 | C23 | C25 | 113.2° | 109.6° |
| C24 | C23 | H41 | 108.6° | 109.6° |
| C23 | C24 | O9 | 123.5° | 120.6° |
| C23 | C24 | N9 | 113.7° | 118.8° |
| C25 | C23 | H41 | 109.0° | 109.6° |
| C23 | C25 | C26 | 112.3° | 109.5° |
| C23 | C25 | H42 | 108.8° | 109.5° |
| C23 | C25 | H43 | 108.8° | 109.5° |
| O9 | C24 | N9 | 122.7° | 120.6° |
| C26 | C25 | H42 | 108.8° | 109.4° |
| C26 | C25 | H43 | 108.7° | 109.5° |
| C25 | C26 | O10 | 120.8° | 120.0° |
| C25 | C26 | N8 | 116.4° | 120.0° |
| H42 | C25 | H43 | 109.5° | 109.5° |
| O10 | C26 | N8 | 122.7° | 120.0° |
| C26 | N8 | H44 | 120.0° | 120.0° |
| C26 | N8 | H45 | 120.0° | 120.1° |
| H44 | N8 | H45 | 120.0° | 119.9° |
| C27 | N9 | H46 | 120.5° | 122.3° |
| N9 | C27 | C28 | 109.3° | 108.6° |
| N9 | C27 | C29 | 110.8° | 109.6° |
| N9 | C27 | H47 | 108.1° | 109.6° |
| C27 | N9 | C24 | 119.1° | 115.4° |
| H46 | N9 | C24 | 120.5° | 122.3° |
| C28 | C27 | C29 | 114.0° | 109.6° |
| C28 | C27 | H47 | 107.2° | 109.7° |
| C27 | C28 | O11 | 120.6° | 120.5° |
| C27 | C28 | N10 | 115.5° | 119.1° |
| C29 | C27 | H47 | 107.2° | 109.7° |
| C27 | C29 | C30 | 114.7° | 109.5° |
| C27 | C29 | H48 | 108.2° | 109.5° |
| C27 | C29 | H49 | 108.1° | 109.5° |
| O11 | C28 | N10 | 123.6° | 120.5° |
| C30 | C29 | H48 | 108.2° | 109.5° |
| C30 | C29 | H49 | 108.2° | 109.5° |
| C29 | C30 | C31 | 103.7° | 109.5° |
| C29 | C30 | C32 | 115.5° | 109.5° |
| C29 | C30 | H50 | 109.4° | 109.5° |
| H48 | C29 | H49 | 109.4° | 109.5° |
| C31 | C30 | C32 | 109.1° | 109.5° |
| C31 | C30 | H50 | 110.1° | 109.5° |
| C30 | C31 | H51 | 109.5° | 109.5° |
| C30 | C31 | H52 | 109.4° | 109.5° |
| C30 | C31 | H53 | 109.5° | 109.5° |
| C32 | C30 | H50 | 109.0° | 109.4° |
| C30 | C32 | H54 | 109.5° | 109.5° |
| C30 | C32 | H55 | 109.5° | 109.5° |
| C30 | C32 | H56 | 109.5° | 109.4° |
| H51 | C31 | H52 | 109.4° | 109.4° |
| H51 | C31 | H53 | 109.4° | 109.5° |
| H52 | C31 | H53 | 109.5° | 109.5° |
| H54 | C32 | H55 | 109.5° | 109.5° |
| H54 | C32 | H56 | 109.5° | 109.4° |
| H55 | C32 | H56 | 109.5° | 109.4° |
| C33 | N10 | H57 | 118.5° | 121.7° |
| N10 | C33 | C34 | 116.3° | 109.0° |
| N10 | C33 | C35 | 110.5° | 109.6° |
| N10 | C33 | H58 | 106.4° | 109.6° |
| C33 | N10 | C28 | 123.1° | 116.6° |
| H57 | N10 | C28 | 118.4° | 121.7° |
| C34 | C33 | C35 | 111.4° | 109.4° |
| C34 | C33 | H58 | 105.7° | 109.7° |
| C33 | C34 | O12 | 118.9° | 120.6° |
| C33 | C34 | N1 | 118.7° | 118.8° |
| C35 | C33 | H58 | 105.8° | 109.6° |
| C33 | C35 | C36 | 112.9° | 109.5° |
| C33 | C35 | H59 | 108.6° | 109.4° |
| C33 | C35 | H60 | 108.6° | 109.4° |
| O12 | C34 | N1 | 122.4° | 120.6° |
| C36 | C35 | H59 | 108.6° | 109.5° |
| C36 | C35 | H60 | 108.6° | 109.5° |
| C35 | C36 | O13 | 119.8° | 120.0° |
| C35 | C36 | O14 | 117.5° | 120.0° |
| H59 | C35 | H60 | 109.4° | 109.5° |
| O13 | C36 | O14 | 122.7° | 120.0° |
| C36 | O14 | H61 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N1 | H1 | C34 | 180.0° | 179.8° |
| N1 | C1 | C2 | C3 | 135.9° | 119.8° |
| N1 | C1 | C2 | H2 | 113.6° | 119.7° |
| N1 | C1 | C3 | H2 | 111.1° | 120.4° |
| N1 | C1 | C2 | O1 | 148.7° | 32.8° |
| N1 | C1 | C3 | O2 | 59.7° | 175.3° |
| N1 | C1 | C3 | H3 | 179.7° | 64.7° |
| N1 | C1 | C3 | H4 | 60.9° | 55.3° |
| C1 | N1 | C34 | C33 | 170.7° | 179.8° |
| C1 | N1 | C34 | O12 | 8.1° | 0.0° |
| N1 | C1 | C2 | N2 | 31.9° | 147.3° |
| H1 | N1 | C1 | C2 | 71.2° | 49.3° |
| H1 | N1 | C1 | C3 | 64.7° | 169.1° |
| H1 | N1 | C1 | H2 | 175.5° | 70.4° |
| H1 | N1 | C34 | C33 | 9.3° | 0.4° |
| H1 | N1 | C34 | O12 | 171.9° | 179.8° |
| C2 | C1 | C3 | H2 | 110.5° | 120.4° |
| C1 | C2 | O1 | N2 | 179.4° | 180.0° |
| C2 | C1 | C3 | O2 | 78.7° | 56.2° |
| C2 | C1 | C3 | H3 | 41.9° | 176.1° |
| C2 | C1 | C3 | H4 | 160.8° | 63.8° |
| C1 | C2 | N2 | C4 | 177.9° | 179.9° |
| C1 | C2 | N2 | H6 | 2.1° | 0.1° |
| C2 | C1 | N1 | C34 | 108.9° | 130.9° |
| C3 | C1 | C2 | O1 | 12.8° | 152.5° |
| C1 | C3 | O2 | H3 | 120.6° | 119.9° |
| C1 | C3 | O2 | H4 | 120.6° | 120.0° |
| C1 | C3 | H3 | H4 | 118.3° | 120.0° |
| C1 | C3 | O2 | H5 | 180.0° | 180.0° |
| C3 | C1 | N1 | C34 | 115.3° | 11.1° |
| C3 | C1 | C2 | N2 | 167.8° | 27.5° |
| H2 | C1 | C2 | O1 | 97.7° | 87.0° |
| H2 | C1 | C3 | O2 | 170.8° | 64.3° |
| H2 | C1 | C3 | H3 | 68.7° | 55.7° |
| H2 | C1 | C3 | H4 | 50.2° | 175.7° |
| H2 | C1 | N1 | C34 | 4.5° | 109.4° |
| H2 | C1 | C2 | N2 | 81.7° | 93.0° |
| O1 | C2 | N2 | C4 | 2.7° | 0.1° |
| O1 | C2 | N2 | H6 | 177.3° | 180.0° |
| O2 | C3 | H3 | H4 | 118.3° | 120.1° |
| H3 | C3 | O2 | H5 | 59.4° | 60.1° |
| H4 | C3 | O2 | H5 | 59.4° | 60.0° |
| C4 | N2 | H6 | C2 | 180.0° | 180.0° |
| N2 | C4 | C5 | C6 | 128.7° | 119.8° |
| N2 | C4 | C5 | H7 | 116.7° | 119.7° |
| N2 | C4 | C6 | H7 | 116.1° | 120.3° |
| N2 | C4 | C5 | O3 | 142.8° | 30.9° |
| N2 | C4 | C6 | H8 | 180.0° | 60.0° |
| N2 | C4 | C6 | H9 | 60.0° | 180.0° |
| N2 | C4 | C6 | H10 | 60.0° | 60.0° |
| N2 | C4 | C5 | N3 | 39.4° | 149.1° |
| H6 | N2 | C4 | C5 | 121.7° | 48.8° |
| H6 | N2 | C4 | C6 | 110.3° | 71.0° |
| H6 | N2 | C4 | H7 | 5.3° | 168.5° |
| C5 | C4 | C6 | H7 | 114.9° | 120.4° |
| C4 | C5 | O3 | N3 | 177.7° | 180.0° |
| C5 | C4 | C6 | H8 | 51.0° | 59.3° |
| C5 | C4 | C6 | H9 | 171.0° | 60.7° |
| C5 | C4 | C6 | H10 | 69.0° | 179.4° |
| C4 | C5 | N3 | C7 | 174.1° | 179.9° |
| C4 | C5 | N3 | H11 | 6.0° | 0.0° |
| C5 | C4 | N2 | C2 | 58.3° | 131.3° |
| C6 | C4 | C5 | O3 | 14.1° | 88.9° |
| C4 | C6 | H8 | H9 | 120.0° | 120.0° |
| C4 | C6 | H8 | H10 | 120.0° | 120.0° |
| C4 | C6 | H9 | H10 | 120.0° | 120.0° |
| C6 | C4 | N2 | C2 | 69.7° | 108.9° |
| C6 | C4 | C5 | N3 | 168.1° | 91.1° |
| H7 | C4 | C5 | O3 | 100.5° | 150.6° |
| H7 | C4 | C6 | H8 | 63.9° | 179.7° |
| H7 | C4 | C6 | H9 | 56.1° | 59.7° |
| H7 | C4 | C6 | H10 | 176.1° | 60.3° |
| H7 | C4 | N2 | C2 | 174.7° | 11.5° |
| H7 | C4 | C5 | N3 | 77.3° | 29.4° |
| O3 | C5 | N3 | C7 | 3.7° | 0.1° |
| O3 | C5 | N3 | H11 | 176.2° | 180.0° |
| H8 | C6 | H9 | H10 | 120.0° | 120.0° |
| C7 | N3 | H11 | C5 | 180.0° | 179.9° |
| N3 | C7 | C8 | C9 | 119.4° | 119.7° |
| N3 | C7 | C8 | H12 | 120.4° | 119.7° |
| N3 | C7 | C9 | H12 | 122.8° | 120.4° |
| N3 | C7 | C8 | O4 | 27.6° | 33.4° |
| N3 | C7 | C9 | C10 | 53.2° | 63.8° |
| N3 | C7 | C9 | H13 | 68.0° | 176.2° |
| N3 | C7 | C9 | H14 | 174.5° | 56.3° |
| N3 | C7 | C8 | N5 | 151.2° | 146.6° |
| H11 | N3 | C7 | C8 | 57.8° | 51.0° |
| H11 | N3 | C7 | C9 | 59.5° | 170.7° |
| H11 | N3 | C7 | H12 | 178.1° | 68.8° |
| C8 | C7 | C9 | H12 | 120.5° | 120.4° |
| C7 | C8 | O4 | N5 | 178.8° | 180.0° |
| C8 | C7 | C9 | C10 | 170.0° | 55.4° |
| C8 | C7 | C9 | H13 | 48.8° | 64.6° |
| C8 | C7 | C9 | H14 | 68.8° | 175.4° |
| C7 | C8 | N5 | C13 | 178.2° | 179.9° |
| C7 | C8 | N5 | H24 | 1.8° | 0.1° |
| C8 | C7 | N3 | C5 | 122.3° | 129.1° |
| C9 | C7 | C8 | O4 | 91.7° | 153.1° |
| C7 | C9 | C10 | H13 | 121.2° | 120.0° |
| C7 | C9 | C10 | H14 | 121.2° | 120.1° |
| C7 | C9 | H13 | H14 | 116.1° | 120.0° |
| C7 | C9 | C10 | C11 | 63.2° | 174.8° |
| C7 | C9 | C10 | H15 | 57.0° | 54.7° |
| C7 | C9 | C10 | H16 | 176.7° | 65.2° |
| C9 | C7 | N3 | C5 | 120.4° | 9.3° |
| C9 | C7 | C8 | N5 | 89.4° | 26.9° |
| H12 | C7 | C8 | O4 | 148.1° | 86.3° |
| H12 | C7 | C9 | C10 | 69.5° | 175.8° |
| H12 | C7 | C9 | H13 | 169.3° | 55.9° |
| H12 | C7 | C9 | H14 | 51.7° | 64.1° |
| H12 | C7 | N3 | C5 | 2.0° | 111.2° |
| H12 | C7 | C8 | N5 | 30.8° | 93.7° |
| O4 | C8 | N5 | C13 | 0.7° | 0.1° |
| O4 | C8 | N5 | H24 | 179.4° | 179.9° |
| C10 | C9 | H13 | H14 | 116.1° | 120.0° |
| C9 | C10 | C11 | H15 | 120.1° | 120.0° |
| C9 | C10 | C11 | H16 | 120.1° | 120.0° |
| C9 | C10 | H15 | H16 | 119.6° | 119.9° |
| C9 | C10 | C11 | C12 | 167.6° | 174.5° |
| C9 | C10 | C11 | H17 | 47.6° | 65.4° |
| C9 | C10 | C11 | H18 | 72.4° | 54.6° |
| H13 | C9 | C10 | C11 | 175.6° | 65.2° |
| H13 | C9 | C10 | H15 | 64.3° | 174.7° |
| H13 | C9 | C10 | H16 | 55.5° | 54.8° |
| H14 | C9 | C10 | C11 | 58.1° | 54.7° |
| H14 | C9 | C10 | H15 | 178.2° | 65.3° |
| H14 | C9 | C10 | H16 | 62.0° | 174.8° |
| C11 | C10 | H15 | H16 | 119.6° | 120.0° |
| C10 | C11 | C12 | H17 | 119.9° | 120.0° |
| C10 | C11 | C12 | H18 | 119.9° | 120.0° |
| C10 | C11 | H17 | H18 | 120.1° | 120.0° |
| C10 | C11 | C12 | N4 | 157.0° | 174.9° |
| C10 | C11 | C12 | H19 | 36.7° | 54.9° |
| C10 | C11 | C12 | H20 | 82.8° | 65.1° |
| H15 | C10 | C11 | C12 | 72.3° | 54.5° |
| H15 | C10 | C11 | H17 | 167.7° | 174.5° |
| H15 | C10 | C11 | H18 | 47.7° | 65.4° |
| H16 | C10 | C11 | C12 | 47.5° | 65.5° |
| H16 | C10 | C11 | H17 | 72.5° | 54.6° |
| H16 | C10 | C11 | H18 | 167.4° | 174.6° |
| C12 | C11 | H17 | H18 | 120.1° | 120.0° |
| C11 | C12 | N4 | H19 | 120.3° | 120.1° |
| C11 | C12 | N4 | H20 | 120.2° | 120.0° |
| C11 | C12 | H19 | H20 | 119.2° | 120.0° |
| C11 | C12 | N4 | H21 | 180.0° | 64.8° |
| C11 | C12 | N4 | H22 | 60.0° | 175.2° |
| C11 | C12 | N4 | H23 | 60.0° | 55.2° |
| H17 | C11 | C12 | N4 | 83.1° | 65.0° |
| H17 | C11 | C12 | H19 | 156.7° | 174.9° |
| H17 | C11 | C12 | H20 | 37.2° | 54.9° |
| H18 | C11 | C12 | N4 | 37.0° | 55.0° |
| H18 | C11 | C12 | H19 | 83.2° | 65.1° |
| H18 | C11 | C12 | H20 | 157.3° | 174.9° |
| N4 | C12 | H19 | H20 | 119.2° | 120.0° |
| C12 | N4 | H21 | H22 | 120.0° | 120.0° |
| C12 | N4 | H21 | H23 | 120.0° | 120.0° |
| C12 | N4 | H22 | H23 | 120.0° | 120.0° |
| H19 | C12 | N4 | H21 | 59.7° | 55.2° |
| H19 | C12 | N4 | H22 | 179.7° | 64.8° |
| H19 | C12 | N4 | H23 | 60.3° | 175.3° |
| H20 | C12 | N4 | H21 | 59.8° | 175.2° |
| H20 | C12 | N4 | H22 | 60.3° | 55.2° |
| H20 | C12 | N4 | H23 | 179.8° | 64.8° |
| H21 | N4 | H22 | H23 | 120.0° | 120.0° |
| C13 | N5 | H24 | C8 | 180.0° | 180.0° |
| N5 | C13 | C14 | C15 | 123.0° | 119.8° |
| N5 | C13 | C14 | H25 | 118.0° | 119.8° |
| N5 | C13 | C15 | H25 | 118.8° | 120.3° |
| N5 | C13 | C14 | O5 | 141.5° | 30.8° |
| N5 | C13 | C15 | C16 | 142.8° | 175.0° |
| N5 | C13 | C15 | C17 | 92.9° | 65.0° |
| N5 | C13 | C15 | H26 | 25.2° | 55.0° |
| N5 | C13 | C14 | N6 | 39.1° | 149.2° |
| H24 | N5 | C13 | C14 | 124.6° | 47.9° |
| H24 | N5 | C13 | C15 | 0.3° | 71.9° |
| H24 | N5 | C13 | H25 | 117.8° | 167.7° |
| C14 | C13 | C15 | H25 | 119.3° | 120.3° |
| C13 | C14 | O5 | N6 | 179.4° | 180.0° |
| C14 | C13 | C15 | C16 | 95.3° | 65.6° |
| C14 | C13 | C15 | C17 | 29.0° | 54.3° |
| C14 | C13 | C15 | H26 | 147.0° | 174.4° |
| C13 | C14 | N6 | C19 | 169.5° | 179.9° |
| C13 | C14 | N6 | H35 | 10.5° | 0.1° |
| C14 | C13 | N5 | C8 | 55.4° | 132.1° |
| C15 | C13 | C14 | O5 | 95.5° | 89.0° |
| C13 | C15 | C16 | C17 | 125.3° | 120.0° |
| C13 | C15 | C16 | H26 | 117.4° | 120.0° |
| C13 | C15 | C17 | H26 | 117.6° | 120.0° |
| C13 | C15 | C16 | C18 | 82.5° | 175.0° |
| C13 | C15 | C16 | H27 | 157.0° | 65.0° |
| C13 | C15 | C16 | H28 | 38.0° | 55.0° |
| C13 | C15 | C17 | H29 | 180.0° | 60.0° |
| C13 | C15 | C17 | H30 | 60.0° | 59.9° |
| C13 | C15 | C17 | H31 | 60.0° | 180.0° |
| C15 | C13 | N5 | C8 | 179.7° | 108.1° |
| C15 | C13 | C14 | N6 | 84.0° | 91.0° |
| H25 | C13 | C14 | O5 | 23.5° | 150.6° |
| H25 | C13 | C15 | C16 | 24.0° | 54.7° |
| H25 | C13 | C15 | C17 | 148.3° | 174.7° |
| H25 | C13 | C15 | H26 | 93.7° | 65.3° |
| H25 | C13 | N5 | C8 | 62.2° | 12.3° |
| H25 | C13 | C14 | N6 | 157.0° | 29.4° |
| O5 | C14 | N6 | C19 | 9.9° | 0.1° |
| O5 | C14 | N6 | H35 | 170.1° | 179.9° |
| C16 | C15 | C17 | H26 | 117.1° | 120.0° |
| C15 | C16 | C18 | H27 | 120.5° | 120.0° |
| C15 | C16 | C18 | H28 | 120.5° | 120.0° |
| C15 | C16 | H27 | H28 | 118.3° | 120.0° |
| C16 | C15 | C17 | H29 | 54.7° | 180.0° |
| C16 | C15 | C17 | H30 | 174.8° | 60.0° |
| C16 | C15 | C17 | H31 | 65.2° | 60.0° |
| C15 | C16 | C18 | H32 | 180.0° | 60.0° |
| C15 | C16 | C18 | H33 | 60.0° | 179.9° |
| C15 | C16 | C18 | H34 | 60.0° | 60.0° |
| C17 | C15 | C16 | C18 | 152.1° | 65.0° |
| C17 | C15 | C16 | H27 | 31.6° | 55.0° |
| C17 | C15 | C16 | H28 | 87.3° | 175.0° |
| C15 | C17 | H29 | H30 | 120.0° | 120.0° |
| C15 | C17 | H29 | H31 | 120.0° | 120.0° |
| C15 | C17 | H30 | H31 | 120.0° | 120.1° |
| H26 | C15 | C16 | C18 | 34.8° | 55.0° |
| H26 | C15 | C16 | H27 | 85.7° | 175.0° |
| H26 | C15 | C16 | H28 | 155.4° | 65.0° |
| H26 | C15 | C17 | H29 | 62.4° | 60.0° |
| H26 | C15 | C17 | H30 | 57.6° | 179.9° |
| H26 | C15 | C17 | H31 | 177.6° | 60.0° |
| C18 | C16 | H27 | H28 | 118.3° | 120.1° |
| C16 | C18 | H32 | H33 | 120.0° | 120.0° |
| C16 | C18 | H32 | H34 | 120.0° | 120.0° |
| C16 | C18 | H33 | H34 | 120.0° | 119.9° |
| H27 | C16 | C18 | H32 | 59.5° | 60.0° |
| H27 | C16 | C18 | H33 | 179.5° | 60.1° |
| H27 | C16 | C18 | H34 | 60.6° | 180.0° |
| H28 | C16 | C18 | H32 | 59.5° | 179.9° |
| H28 | C16 | C18 | H33 | 60.6° | 60.0° |
| H28 | C16 | C18 | H34 | 179.5° | 60.0° |
| H29 | C17 | H30 | H31 | 120.0° | 120.0° |
| H32 | C18 | H33 | H34 | 120.0° | 120.0° |
| C19 | N6 | H35 | C14 | 180.0° | 180.0° |
| N6 | C19 | C20 | C21 | 129.0° | 119.7° |
| N6 | C19 | C20 | H36 | 116.9° | 119.8° |
| N6 | C19 | C21 | H36 | 119.4° | 120.5° |
| N6 | C19 | C20 | O6 | 179.6° | 33.5° |
| N6 | C19 | C21 | C22 | 48.7° | 176.9° |
| N6 | C19 | C21 | H37 | 169.3° | 57.0° |
| N6 | C19 | C21 | H38 | 72.0° | 63.0° |
| N6 | C19 | C20 | N7 | 2.4° | 146.5° |
| H35 | N6 | C19 | C20 | 86.7° | 50.8° |
| H35 | N6 | C19 | C21 | 38.1° | 170.5° |
| H35 | N6 | C19 | H36 | 156.7° | 69.0° |
| C20 | C19 | C21 | H36 | 114.6° | 120.3° |
| C19 | C20 | O6 | N7 | 176.9° | 180.0° |
| C20 | C19 | C21 | C22 | 77.3° | 63.9° |
| C20 | C19 | C21 | H37 | 43.3° | 176.1° |
| C20 | C19 | C21 | H38 | 162.0° | 56.1° |
| C19 | C20 | N7 | C23 | 179.8° | 179.9° |
| C19 | C20 | N7 | H40 | 0.2° | 0.0° |
| C20 | C19 | N6 | C14 | 93.3° | 129.3° |
| C21 | C19 | C20 | O6 | 50.6° | 153.2° |
| C19 | C21 | C22 | H37 | 120.7° | 120.0° |
| C19 | C21 | C22 | H38 | 120.7° | 120.0° |
| C19 | C21 | H37 | H38 | 118.1° | 120.0° |
| C19 | C21 | C22 | O7 | 175.7° | 11.9° |
| C19 | C21 | C22 | O8 | 5.7° | 168.1° |
| C21 | C19 | N6 | C14 | 141.8° | 9.6° |
| C21 | C19 | C20 | N7 | 126.6° | 26.8° |
| H36 | C19 | C20 | O6 | 63.5° | 86.4° |
| H36 | C19 | C21 | C22 | 168.0° | 56.4° |
| H36 | C19 | C21 | H37 | 71.3° | 63.5° |
| H36 | C19 | C21 | H38 | 47.4° | 176.5° |
| H36 | C19 | N6 | C14 | 23.3° | 111.0° |
| H36 | C19 | C20 | N7 | 119.3° | 93.6° |
| O6 | C20 | N7 | C23 | 3.1° | 0.1° |
| O6 | C20 | N7 | H40 | 176.8° | 180.0° |
| C22 | C21 | H37 | H38 | 118.0° | 120.0° |
| C21 | C22 | O7 | O8 | 178.5° | 179.9° |
| C21 | C22 | O8 | H39 | 178.6° | 180.0° |
| H37 | C21 | C22 | O7 | 55.0° | 108.1° |
| H37 | C21 | C22 | O8 | 126.4° | 71.9° |
| H38 | C21 | C22 | O7 | 63.7° | 131.9° |
| H38 | C21 | C22 | O8 | 114.9° | 48.1° |
| O7 | C22 | O8 | H39 | 0.0° | 0.1° |
| C23 | N7 | H40 | C20 | 180.0° | 179.9° |
| N7 | C23 | C24 | C25 | 121.3° | 119.8° |
| N7 | C23 | C24 | H41 | 117.6° | 119.8° |
| N7 | C23 | C25 | H41 | 120.9° | 120.3° |
| N7 | C23 | C24 | O9 | 94.6° | 30.0° |
| N7 | C23 | C25 | C26 | 172.8° | 65.0° |
| N7 | C23 | C25 | H42 | 52.4° | 55.0° |
| N7 | C23 | C25 | H43 | 66.8° | 175.0° |
| N7 | C23 | C24 | N9 | 81.1° | 150.0° |
| H40 | N7 | C23 | C24 | 24.6° | 48.0° |
| H40 | N7 | C23 | C25 | 98.2° | 71.8° |
| H40 | N7 | C23 | H41 | 141.4° | 167.9° |
| C24 | C23 | C25 | H41 | 120.9° | 120.3° |
| C23 | C24 | O9 | N9 | 175.4° | 180.0° |
| C24 | C23 | C25 | C26 | 69.0° | 175.6° |
| C24 | C23 | C25 | H42 | 170.6° | 64.4° |
| C24 | C23 | C25 | H43 | 51.4° | 55.6° |
| C23 | C24 | N9 | C27 | 172.4° | 180.0° |
| C23 | C24 | N9 | H46 | 7.5° | 0.0° |
| C24 | C23 | N7 | C20 | 155.4° | 132.0° |
| C25 | C23 | C24 | O9 | 26.7° | 89.9° |
| C23 | C25 | C26 | H42 | 120.4° | 120.0° |
| C23 | C25 | C26 | H43 | 120.4° | 120.0° |
| C23 | C25 | H42 | H43 | 118.7° | 120.0° |
| C23 | C25 | C26 | O10 | 18.8° | 0.0° |
| C23 | C25 | C26 | N8 | 160.9° | 180.0° |
| C25 | C23 | N7 | C20 | 81.8° | 108.2° |
| C25 | C23 | C24 | N9 | 157.6° | 90.1° |
| H41 | C23 | C24 | O9 | 147.8° | 149.8° |
| H41 | C23 | C25 | C26 | 51.9° | 55.3° |
| H41 | C23 | C25 | H42 | 68.5° | 175.3° |
| H41 | C23 | C25 | H43 | 172.3° | 64.7° |
| H41 | C23 | N7 | C20 | 38.6° | 12.2° |
| H41 | C23 | C24 | N9 | 36.5° | 30.2° |
| O9 | C24 | N9 | C27 | 3.3° | 0.0° |
| O9 | C24 | N9 | H46 | 176.7° | 180.0° |
| C26 | C25 | H42 | H43 | 118.7° | 120.0° |
| C25 | C26 | O10 | N8 | 179.7° | 180.0° |
| C25 | C26 | N8 | H44 | 179.7° | 0.0° |
| C25 | C26 | N8 | H45 | 0.3° | 180.0° |
| H42 | C25 | C26 | O10 | 101.6° | 119.9° |
| H42 | C25 | C26 | N8 | 78.7° | 60.0° |
| H43 | C25 | C26 | O10 | 139.3° | 120.0° |
| H43 | C25 | C26 | N8 | 40.5° | 60.0° |
| O10 | C26 | N8 | H44 | 0.0° | 180.0° |
| O10 | C26 | N8 | H45 | 180.0° | 0.0° |
| C26 | N8 | H44 | H45 | 180.0° | 180.0° |
| C27 | N9 | H46 | C24 | 180.0° | 179.9° |
| N9 | C27 | C28 | C29 | 124.6° | 119.7° |
| N9 | C27 | C28 | H47 | 116.9° | 119.7° |
| N9 | C27 | C29 | H47 | 117.7° | 120.4° |
| N9 | C27 | C28 | O11 | 142.8° | 32.8° |
| N9 | C27 | C29 | C30 | 78.8° | 59.6° |
| N9 | C27 | C29 | H48 | 42.0° | 179.6° |
| N9 | C27 | C29 | H49 | 160.4° | 60.4° |
| N9 | C27 | C28 | N10 | 31.7° | 147.3° |
| H46 | N9 | C27 | C28 | 118.6° | 51.8° |
| H46 | N9 | C27 | C29 | 7.8° | 171.5° |
| H46 | N9 | C27 | H47 | 125.1° | 68.0° |
| C28 | C27 | C29 | H47 | 118.5° | 120.5° |
| C27 | C28 | O11 | N10 | 174.0° | 179.9° |
| C28 | C27 | C29 | C30 | 157.4° | 59.5° |
| C28 | C27 | C29 | H48 | 81.8° | 60.5° |
| C28 | C27 | C29 | H49 | 36.7° | 179.5° |
| C27 | C28 | N10 | C33 | 170.9° | 179.9° |
| C27 | C28 | N10 | H57 | 9.1° | 0.0° |
| C28 | C27 | N9 | C24 | 61.4° | 128.3° |
| C29 | C27 | C28 | O11 | 92.6° | 152.5° |
| C27 | C29 | C30 | H48 | 120.8° | 120.0° |
| C27 | C29 | C30 | H49 | 120.8° | 120.0° |
| C27 | C29 | H48 | H49 | 117.6° | 120.0° |
| C27 | C29 | C30 | C31 | 178.4° | 79.8° |
| C27 | C29 | C30 | C32 | 59.2° | 160.2° |
| C27 | C29 | C30 | H50 | 64.2° | 40.2° |
| C29 | C27 | N9 | C24 | 172.2° | 8.6° |
| C29 | C27 | C28 | N10 | 93.0° | 27.6° |
| H47 | C27 | C28 | O11 | 25.9° | 87.0° |
| H47 | C27 | C29 | C30 | 39.0° | 180.0° |
| H47 | C27 | C29 | H48 | 159.8° | 60.0° |
| H47 | C27 | C29 | H49 | 81.8° | 60.0° |
| H47 | C27 | N9 | C24 | 54.9° | 111.9° |
| H47 | C27 | C28 | N10 | 148.5° | 92.9° |
| O11 | C28 | N10 | C33 | 3.3° | 0.0° |
| O11 | C28 | N10 | H57 | 176.7° | 179.9° |
| C30 | C29 | H48 | H49 | 117.6° | 120.0° |
| C29 | C30 | C31 | C32 | 123.5° | 120.0° |
| C29 | C30 | C31 | H50 | 116.9° | 120.0° |
| C29 | C30 | C32 | H50 | 123.5° | 120.0° |
| C29 | C30 | C31 | H51 | 180.0° | 168.1° |
| C29 | C30 | C31 | H52 | 60.0° | 71.9° |
| C29 | C30 | C31 | H53 | 60.0° | 48.1° |
| C29 | C30 | C32 | H54 | 180.0° | 54.1° |
| C29 | C30 | C32 | H55 | 60.0° | 174.2° |
| C29 | C30 | C32 | H56 | 60.0° | 65.9° |
| H48 | C29 | C30 | C31 | 60.8° | 40.2° |
| H48 | C29 | C30 | C32 | 180.0° | 79.9° |
| H48 | C29 | C30 | H50 | 56.6° | 160.2° |
| H49 | C29 | C30 | C31 | 57.6° | 160.2° |
| H49 | C29 | C30 | C32 | 61.6° | 40.2° |
| H49 | C29 | C30 | H50 | 175.1° | 79.8° |
| C31 | C30 | C32 | H50 | 120.2° | 120.0° |
| C30 | C31 | H51 | H52 | 120.0° | 120.0° |
| C30 | C31 | H51 | H53 | 120.0° | 120.0° |
| C30 | C31 | H52 | H53 | 120.0° | 120.1° |
| C31 | C30 | C32 | H54 | 63.7° | 174.1° |
| C31 | C30 | C32 | H55 | 56.2° | 65.8° |
| C31 | C30 | C32 | H56 | 176.2° | 54.1° |
| C32 | C30 | C31 | H51 | 56.5° | 48.1° |
| C32 | C30 | C31 | H52 | 176.4° | 168.0° |
| C32 | C30 | C31 | H53 | 63.5° | 71.9° |
| C30 | C32 | H54 | H55 | 120.0° | 120.1° |
| C30 | C32 | H54 | H56 | 120.0° | 120.0° |
| C30 | C32 | H55 | H56 | 120.0° | 119.9° |
| H50 | C30 | C31 | H51 | 63.1° | 71.9° |
| H50 | C30 | C31 | H52 | 56.9° | 48.1° |
| H50 | C30 | C31 | H53 | 176.9° | 168.1° |
| H50 | C30 | C32 | H54 | 56.5° | 65.9° |
| H50 | C30 | C32 | H55 | 176.5° | 54.2° |
| H50 | C30 | C32 | H56 | 63.5° | 174.1° |
| H51 | C31 | H52 | H53 | 120.0° | 120.0° |
| H54 | C32 | H55 | H56 | 120.0° | 120.0° |
| C33 | N10 | H57 | C28 | 180.0° | 179.9° |
| N10 | C33 | C34 | C35 | 127.9° | 119.8° |
| N10 | C33 | C34 | H58 | 117.7° | 119.9° |
| N10 | C33 | C35 | H58 | 114.7° | 120.3° |
| N10 | C33 | C34 | O12 | 141.7° | 32.0° |
| N10 | C33 | C35 | C36 | 87.4° | 65.0° |
| N10 | C33 | C35 | H59 | 33.1° | 55.0° |
| N10 | C33 | C35 | H60 | 152.1° | 175.0° |
| N10 | C33 | C34 | N1 | 37.1° | 147.8° |
| H57 | N10 | C33 | C34 | 130.7° | 48.3° |
| H57 | N10 | C33 | C35 | 2.4° | 71.4° |
| H57 | N10 | C33 | H58 | 111.9° | 168.3° |
| C34 | C33 | C35 | H58 | 114.3° | 120.3° |
| C33 | C34 | O12 | N1 | 178.8° | 179.8° |
| C34 | C33 | C35 | C36 | 141.7° | 175.6° |
| C34 | C33 | C35 | H59 | 97.8° | 64.4° |
| C34 | C33 | C35 | H60 | 21.2° | 55.6° |
| C34 | C33 | N10 | C28 | 49.3° | 131.8° |
| C35 | C33 | C34 | O12 | 90.4° | 87.8° |
| C33 | C35 | C36 | H59 | 120.5° | 120.0° |
| C33 | C35 | C36 | H60 | 120.5° | 120.0° |
| C33 | C35 | H59 | H60 | 118.4° | 119.9° |
| C33 | C35 | C36 | O13 | 5.6° | 0.0° |
| C33 | C35 | C36 | O14 | 174.1° | 180.0° |
| C35 | C33 | C34 | N1 | 90.8° | 92.5° |
| C35 | C33 | N10 | C28 | 177.6° | 108.5° |
| H58 | C33 | C34 | O12 | 24.0° | 152.0° |
| H58 | C33 | C35 | C36 | 27.4° | 55.3° |
| H58 | C33 | C35 | H59 | 147.9° | 175.3° |
| H58 | C33 | C35 | H60 | 93.2° | 64.7° |
| H58 | C33 | C34 | N1 | 154.8° | 27.8° |
| H58 | C33 | N10 | C28 | 68.0° | 11.8° |
| C36 | C35 | H59 | H60 | 118.4° | 120.0° |
| C35 | C36 | O13 | O14 | 179.7° | 179.9° |
| C35 | C36 | O14 | H61 | 179.7° | 180.0° |
| H59 | C35 | C36 | O13 | 126.2° | 120.0° |
| H59 | C35 | C36 | O14 | 53.6° | 60.0° |
| H60 | C35 | C36 | O13 | 114.9° | 119.9° |
| H60 | C35 | C36 | O14 | 65.4° | 60.0° |
| O13 | C36 | O14 | H61 | 0.0° | 0.1° |
