PRD_002148
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C39 | N6 | sing | 1.32Å | 1.38Å | Aromatic |
| C39 | C38 | doub | 1.34Å | 1.34Å | Aromatic |
| N6 | C32 | doub | 1.29Å | 1.30Å | Aromatic |
| C36 | C35 | doub | 1.38Å | 1.38Å | Aromatic |
| C36 | C37 | sing | 1.38Å | 1.38Å | Aromatic |
| C35 | C34 | sing | 1.38Å | 1.38Å | Aromatic |
| C37 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
| C34 | C33 | doub | 1.38Å | 1.39Å | Aromatic |
| C31 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | C30 | sing | 1.51Å | 1.51Å | |
| C30 | C29 | sing | 1.53Å | 1.54Å | |
| C38 | S1 | sing | 1.76Å | 1.71Å | Aromatic |
| C32 | C29 | sing | 1.51Å | 1.56Å | |
| C32 | S1 | sing | 1.71Å | 1.73Å | Aromatic |
| C29 | N2 | sing | 1.46Å | 1.47Å | |
| N2 | C8 | sing | 1.35Å | 1.35Å | |
| C8 | O2 | doub | 1.21Å | 1.23Å | |
| C8 | C7 | sing | 1.51Å | 1.54Å | |
| C2 | C3 | sing | 1.55Å | 1.50Å | |
| C2 | C1 | sing | 1.54Å | 1.54Å | |
| C7 | C9 | sing | 1.53Å | 1.53Å | |
| C7 | C6 | sing | 1.53Å | 1.55Å | |
| C25 | O1 | sing | 1.43Å | 1.44Å | |
| C3 | C4 | sing | 1.55Å | 1.51Å | |
| C1 | C6 | sing | 1.53Å | 1.53Å | |
| C1 | N1 | sing | 1.47Å | 1.47Å | |
| C6 | O1 | sing | 1.43Å | 1.43Å | |
| C4 | N1 | sing | 1.47Å | 1.47Å | |
| N1 | C5 | sing | 1.35Å | 1.37Å | |
| C5 | O4 | doub | 1.21Å | 1.22Å | |
| C5 | C10 | sing | 1.51Å | 1.51Å | |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| C11 | O3 | sing | 1.43Å | 1.43Å | |
| C11 | C12 | sing | 1.53Å | 1.61Å | |
| C19 | C16 | sing | 1.53Å | 1.52Å | |
| O3 | C24 | sing | 1.43Å | 1.43Å | |
| C12 | C16 | sing | 1.53Å | 1.60Å | |
| C12 | N3 | sing | 1.47Å | 1.56Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.53Å | 1.51Å | |
| C21 | C20 | sing | 1.53Å | 1.51Å | |
| N3 | C23 | sing | 1.46Å | 1.47Å | |
| N3 | C13 | sing | 1.35Å | 1.36Å | |
| C20 | C14 | sing | 1.53Å | 1.55Å | |
| C20 | C22 | sing | 1.53Å | 1.53Å | |
| C14 | C13 | sing | 1.51Å | 1.53Å | |
| C14 | N4 | sing | 1.46Å | 1.46Å | |
| C13 | O5 | doub | 1.21Å | 1.22Å | |
| O6 | C15 | doub | 1.21Å | 1.23Å | |
| N4 | C15 | sing | 1.35Å | 1.34Å | |
| C15 | C26 | sing | 1.51Å | 1.59Å | |
| C26 | N5 | sing | 1.47Å | 1.46Å | |
| C26 | C27 | sing | 1.53Å | 1.55Å | |
| C26 | C28 | sing | 1.53Å | 1.55Å | |
| C6 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| N2 | H10 | sing | 0.97Å | 1.00Å | |
| C9 | H11 | sing | 1.09Å | 1.10Å | |
| C9 | H12 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| N4 | H19 | sing | 0.97Å | 1.00Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C20 | H29 | sing | 1.09Å | 1.10Å | |
| C21 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C21 | H32 | sing | 1.09Å | 1.10Å | |
| C22 | H33 | sing | 1.09Å | 1.10Å | |
| C22 | H34 | sing | 1.09Å | 1.10Å | |
| C22 | H35 | sing | 1.09Å | 1.10Å | |
| C23 | H36 | sing | 1.09Å | 1.10Å | |
| C23 | H37 | sing | 1.09Å | 1.10Å | |
| C23 | H38 | sing | 1.09Å | 1.10Å | |
| C24 | H39 | sing | 1.09Å | 1.10Å | |
| C24 | H40 | sing | 1.09Å | 1.10Å | |
| C24 | H41 | sing | 1.09Å | 1.10Å | |
| C25 | H42 | sing | 1.09Å | 1.10Å | |
| C25 | H43 | sing | 1.09Å | 1.10Å | |
| C25 | H44 | sing | 1.09Å | 1.10Å | |
| N5 | H45 | sing | 1.01Å | 1.00Å | |
| N5 | H46 | sing | 1.01Å | 1.00Å | |
| C27 | H48 | sing | 1.09Å | 1.10Å | |
| C27 | H49 | sing | 1.09Å | 1.10Å | |
| C27 | H50 | sing | 1.09Å | 1.10Å | |
| C28 | H51 | sing | 1.09Å | 1.10Å | |
| C28 | H52 | sing | 1.09Å | 1.10Å | |
| C28 | H53 | sing | 1.09Å | 1.10Å | |
| C29 | H54 | sing | 1.09Å | 1.10Å | |
| C30 | H55 | sing | 1.09Å | 1.10Å | |
| C30 | H56 | sing | 1.09Å | 1.10Å | |
| C33 | H57 | sing | 1.08Å | 1.08Å | |
| C34 | H58 | sing | 1.08Å | 1.08Å | |
| C35 | H59 | sing | 1.08Å | 1.08Å | |
| C36 | H60 | sing | 1.08Å | 1.08Å | |
| C37 | H61 | sing | 1.08Å | 1.08Å | |
| C38 | H62 | sing | 1.08Å | 1.08Å | |
| C39 | H63 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N6 | C39 | C38 | 116.2° | 114.5° |
| C39 | N6 | C32 | 110.2° | 117.1° |
| N6 | C39 | H63 | 121.9° | 122.8° |
| C39 | C38 | S1 | 110.0° | 107.9° |
| C39 | C38 | H62 | 125.0° | 126.0° |
| C38 | C39 | H63 | 121.9° | 122.7° |
| N6 | C32 | C29 | 119.2° | 124.9° |
| N6 | C32 | S1 | 114.2° | 110.2° |
| C35 | C36 | C37 | 120.1° | 120.0° |
| C36 | C35 | C34 | 119.7° | 120.0° |
| C36 | C35 | H59 | 120.1° | 120.0° |
| C35 | C36 | H60 | 119.9° | 120.0° |
| C36 | C37 | C31 | 120.9° | 120.0° |
| C37 | C36 | H60 | 119.9° | 120.0° |
| C36 | C37 | H61 | 119.6° | 120.0° |
| C35 | C34 | C33 | 120.2° | 120.0° |
| C35 | C34 | H58 | 119.9° | 120.0° |
| C34 | C35 | H59 | 120.2° | 119.9° |
| C37 | C31 | C33 | 118.3° | 120.0° |
| C37 | C31 | C30 | 121.0° | 120.0° |
| C31 | C37 | H61 | 119.5° | 120.0° |
| C34 | C33 | C31 | 120.8° | 120.0° |
| C34 | C33 | H57 | 119.6° | 120.0° |
| C33 | C34 | H58 | 119.9° | 120.0° |
| C33 | C31 | C30 | 120.6° | 119.9° |
| C31 | C33 | H57 | 119.6° | 120.0° |
| C31 | C30 | C29 | 113.4° | 109.4° |
| C31 | C30 | H55 | 108.5° | 109.5° |
| C31 | C30 | H56 | 108.5° | 109.5° |
| C30 | C29 | C32 | 115.7° | 109.5° |
| C30 | C29 | N2 | 113.9° | 109.5° |
| C30 | C29 | H54 | 102.0° | 109.5° |
| C29 | C30 | H55 | 108.5° | 109.5° |
| C29 | C30 | H56 | 108.5° | 109.4° |
| C38 | S1 | C32 | 89.3° | 90.3° |
| S1 | C38 | H62 | 124.9° | 126.1° |
| C29 | C32 | S1 | 126.6° | 125.0° |
| C32 | C29 | N2 | 117.6° | 109.4° |
| C32 | C29 | H54 | 101.7° | 109.5° |
| C29 | N2 | C8 | 130.0° | 120.1° |
| C29 | N2 | H10 | 115.0° | 120.0° |
| N2 | C29 | H54 | 102.5° | 109.5° |
| N2 | C8 | O2 | 125.6° | 119.9° |
| N2 | C8 | C7 | 110.9° | 120.1° |
| C8 | N2 | H10 | 115.0° | 120.0° |
| O2 | C8 | C7 | 123.6° | 120.0° |
| C8 | C7 | C9 | 110.7° | 109.5° |
| C8 | C7 | C6 | 114.0° | 109.5° |
| C8 | C7 | H9 | 105.2° | 109.4° |
| C3 | C2 | C1 | 104.9° | 103.0° |
| C2 | C3 | C4 | 104.0° | 101.5° |
| C3 | C2 | H2 | 110.6° | 110.7° |
| C3 | C2 | H3 | 110.6° | 110.8° |
| C2 | C3 | H7 | 110.8° | 111.0° |
| C2 | C3 | H8 | 110.8° | 111.1° |
| C2 | C1 | C6 | 118.9° | 109.9° |
| C2 | C1 | N1 | 103.2° | 107.2° |
| C1 | C2 | H2 | 110.6° | 110.7° |
| C1 | C2 | H3 | 110.6° | 110.7° |
| C2 | C1 | H6 | 104.4° | 110.0° |
| C9 | C7 | C6 | 115.5° | 109.5° |
| C9 | C7 | H9 | 105.3° | 109.5° |
| C7 | C9 | H11 | 109.5° | 109.4° |
| C7 | C9 | H12 | 109.5° | 109.5° |
| C7 | C9 | H13 | 109.5° | 109.5° |
| C7 | C6 | C1 | 116.8° | 109.5° |
| C7 | C6 | O1 | 110.7° | 109.5° |
| C7 | C6 | H1 | 103.8° | 109.4° |
| C6 | C7 | H9 | 105.0° | 109.4° |
| C25 | O1 | C6 | 116.5° | 114.0° |
| O1 | C25 | H42 | 109.5° | 109.5° |
| O1 | C25 | H43 | 109.5° | 109.5° |
| O1 | C25 | H44 | 109.5° | 109.5° |
| C3 | C4 | N1 | 103.2° | 104.8° |
| C3 | C4 | H4 | 111.0° | 110.4° |
| C3 | C4 | H5 | 111.0° | 110.4° |
| C4 | C3 | H7 | 110.8° | 111.0° |
| C4 | C3 | H8 | 110.8° | 111.0° |
| C6 | C1 | N1 | 119.1° | 109.9° |
| C1 | C6 | O1 | 115.0° | 109.5° |
| C1 | C6 | H1 | 104.0° | 109.5° |
| C6 | C1 | H6 | 104.5° | 109.9° |
| C1 | N1 | C4 | 111.7° | 108.7° |
| C1 | N1 | C5 | 122.9° | 125.7° |
| N1 | C1 | H6 | 105.1° | 109.9° |
| O1 | C6 | H1 | 105.0° | 109.4° |
| C4 | N1 | C5 | 125.4° | 125.6° |
| N1 | C4 | H4 | 111.0° | 110.3° |
| N1 | C4 | H5 | 111.0° | 110.4° |
| N1 | C5 | O4 | 119.6° | 120.0° |
| N1 | C5 | C10 | 120.8° | 120.0° |
| O4 | C5 | C10 | 119.5° | 120.0° |
| C5 | C10 | C11 | 114.8° | 109.4° |
| C5 | C10 | H14 | 108.1° | 109.5° |
| C5 | C10 | H15 | 108.1° | 109.5° |
| C10 | C11 | O3 | 110.8° | 109.5° |
| C10 | C11 | C12 | 120.2° | 109.4° |
| C11 | C10 | H14 | 108.1° | 109.5° |
| C11 | C10 | H15 | 108.1° | 109.5° |
| C10 | C11 | H16 | 103.9° | 109.4° |
| O3 | C11 | C12 | 111.9° | 109.5° |
| C11 | O3 | C24 | 115.1° | 114.0° |
| O3 | C11 | H16 | 104.9° | 109.5° |
| C11 | C12 | C16 | 126.3° | 109.5° |
| C11 | C12 | N3 | 110.8° | 109.5° |
| C12 | C11 | H16 | 103.2° | 109.5° |
| C11 | C12 | H17 | 101.1° | 109.5° |
| C19 | C16 | C12 | 121.3° | 109.5° |
| C19 | C16 | C17 | 112.3° | 109.5° |
| C19 | C16 | H20 | 103.0° | 109.5° |
| C16 | C19 | H26 | 109.5° | 109.5° |
| C16 | C19 | H27 | 109.5° | 109.5° |
| C16 | C19 | H28 | 109.5° | 109.5° |
| O3 | C24 | H39 | 109.5° | 109.5° |
| O3 | C24 | H40 | 109.4° | 109.5° |
| O3 | C24 | H41 | 109.4° | 109.4° |
| C16 | C12 | N3 | 111.7° | 109.4° |
| C12 | C16 | C17 | 112.2° | 109.5° |
| C16 | C12 | H17 | 101.2° | 109.5° |
| C12 | C16 | H20 | 102.4° | 109.5° |
| C12 | N3 | C23 | 109.5° | 120.0° |
| C12 | N3 | C13 | 133.7° | 120.0° |
| N3 | C12 | H17 | 101.4° | 109.5° |
| C16 | C17 | C18 | 114.2° | 109.5° |
| C17 | C16 | H20 | 102.9° | 109.5° |
| C16 | C17 | H21 | 108.3° | 109.4° |
| C16 | C17 | H22 | 108.3° | 109.5° |
| C18 | C17 | H21 | 108.3° | 109.5° |
| C18 | C17 | H22 | 108.3° | 109.4° |
| C17 | C18 | H23 | 109.5° | 109.5° |
| C17 | C18 | H24 | 109.5° | 109.4° |
| C17 | C18 | H25 | 109.5° | 109.5° |
| C21 | C20 | C14 | 113.4° | 109.5° |
| C21 | C20 | C22 | 111.2° | 109.5° |
| C21 | C20 | H29 | 105.5° | 109.4° |
| C20 | C21 | H30 | 109.5° | 109.5° |
| C20 | C21 | H31 | 109.5° | 109.5° |
| C20 | C21 | H32 | 109.5° | 109.5° |
| C23 | N3 | C13 | 116.5° | 120.0° |
| N3 | C23 | H36 | 109.5° | 109.5° |
| N3 | C23 | H37 | 109.5° | 109.5° |
| N3 | C23 | H38 | 109.5° | 109.5° |
| N3 | C13 | C14 | 123.1° | 120.0° |
| N3 | C13 | O5 | 120.3° | 120.0° |
| C14 | C20 | C22 | 115.4° | 109.5° |
| C20 | C14 | C13 | 113.2° | 109.5° |
| C20 | C14 | N4 | 111.0° | 109.5° |
| C20 | C14 | H18 | 108.3° | 109.4° |
| C14 | C20 | H29 | 105.0° | 109.5° |
| C22 | C20 | H29 | 105.2° | 109.5° |
| C20 | C22 | H33 | 109.5° | 109.5° |
| C20 | C22 | H34 | 109.5° | 109.4° |
| C20 | C22 | H35 | 109.5° | 109.5° |
| C13 | C14 | N4 | 106.0° | 109.5° |
| C14 | C13 | O5 | 116.5° | 120.0° |
| C13 | C14 | H18 | 108.6° | 109.5° |
| C14 | N4 | C15 | 124.1° | 120.0° |
| N4 | C14 | H18 | 109.6° | 109.5° |
| C14 | N4 | H19 | 118.0° | 120.0° |
| O6 | C15 | N4 | 124.2° | 120.0° |
| O6 | C15 | C26 | 119.6° | 120.0° |
| N4 | C15 | C26 | 116.2° | 120.0° |
| C15 | N4 | H19 | 118.0° | 120.0° |
| C15 | C26 | N5 | 110.0° | 109.5° |
| C15 | C26 | C27 | 108.4° | 109.5° |
| C15 | C26 | C28 | 110.4° | 109.5° |
| N5 | C26 | C27 | 109.3° | 109.5° |
| N5 | C26 | C28 | 107.7° | 109.5° |
| C26 | N5 | H45 | 109.5° | 111.0° |
| C26 | N5 | H46 | 109.5° | 111.0° |
| C27 | C26 | C28 | 110.9° | 109.4° |
| C26 | C27 | H48 | 109.5° | 109.5° |
| C26 | C27 | H49 | 109.5° | 109.5° |
| C26 | C27 | H50 | 109.5° | 109.4° |
| C26 | C28 | H51 | 109.5° | 109.5° |
| C26 | C28 | H52 | 109.5° | 109.5° |
| C26 | C28 | H53 | 109.5° | 109.5° |
| H2 | C2 | H3 | 109.5° | 110.8° |
| H4 | C4 | H5 | 109.5° | 110.4° |
| H7 | C3 | H8 | 109.5° | 110.9° |
| H11 | C9 | H12 | 109.5° | 109.4° |
| H11 | C9 | H13 | 109.5° | 109.5° |
| H12 | C9 | H13 | 109.5° | 109.5° |
| H14 | C10 | H15 | 109.5° | 109.5° |
| H21 | C17 | H22 | 109.5° | 109.5° |
| H23 | C18 | H24 | 109.5° | 109.5° |
| H23 | C18 | H25 | 109.5° | 109.5° |
| H24 | C18 | H25 | 109.4° | 109.5° |
| H26 | C19 | H27 | 109.5° | 109.5° |
| H26 | C19 | H28 | 109.5° | 109.4° |
| H27 | C19 | H28 | 109.5° | 109.5° |
| H30 | C21 | H31 | 109.5° | 109.4° |
| H30 | C21 | H32 | 109.5° | 109.5° |
| H31 | C21 | H32 | 109.4° | 109.5° |
| H33 | C22 | H34 | 109.5° | 109.5° |
| H33 | C22 | H35 | 109.4° | 109.5° |
| H34 | C22 | H35 | 109.5° | 109.5° |
| H36 | C23 | H37 | 109.5° | 109.5° |
| H36 | C23 | H38 | 109.5° | 109.5° |
| H37 | C23 | H38 | 109.5° | 109.5° |
| H39 | C24 | H40 | 109.4° | 109.5° |
| H39 | C24 | H41 | 109.5° | 109.4° |
| H40 | C24 | H41 | 109.5° | 109.5° |
| H42 | C25 | H43 | 109.5° | 109.5° |
| H42 | C25 | H44 | 109.5° | 109.4° |
| H43 | C25 | H44 | 109.5° | 109.5° |
| H45 | N5 | H46 | 109.4° | 111.0° |
| H48 | C27 | H49 | 109.4° | 109.5° |
| H48 | C27 | H50 | 109.4° | 109.5° |
| H49 | C27 | H50 | 109.5° | 109.4° |
| H51 | C28 | H52 | 109.5° | 109.4° |
| H51 | C28 | H53 | 109.5° | 109.5° |
| H52 | C28 | H53 | 109.5° | 109.5° |
| H55 | C30 | H56 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N6 | C39 | C38 | H63 | 180.0° | 179.9° |
| N6 | C39 | C38 | S1 | 0.1° | 0.0° |
| C39 | N6 | C32 | C29 | 178.5° | 180.0° |
| C39 | N6 | C32 | S1 | 0.5° | 0.0° |
| N6 | C39 | C38 | H62 | 179.9° | 179.9° |
| C38 | C39 | N6 | C32 | 0.2° | 0.0° |
| C39 | C38 | S1 | H62 | 180.0° | 179.9° |
| C39 | C38 | S1 | C32 | 0.3° | 0.0° |
| N6 | C32 | C29 | C30 | 124.3° | 105.0° |
| N6 | C32 | S1 | C38 | 0.5° | 0.0° |
| N6 | C32 | C29 | S1 | 178.9° | 180.0° |
| N6 | C32 | C29 | N2 | 96.3° | 135.0° |
| N6 | C32 | C29 | H54 | 14.7° | 15.0° |
| C32 | N6 | C39 | H63 | 179.7° | 180.0° |
| C35 | C36 | C37 | H60 | 180.0° | 179.7° |
| C36 | C35 | C34 | H59 | 180.0° | 179.9° |
| C35 | C36 | C37 | C31 | 1.0° | 0.6° |
| C36 | C35 | C34 | C33 | 0.8° | 0.0° |
| C36 | C35 | C34 | H58 | 179.2° | 179.9° |
| C35 | C36 | C37 | H61 | 178.9° | 180.0° |
| C37 | C36 | C35 | C34 | 0.4° | 0.3° |
| C36 | C37 | C31 | H61 | 180.0° | 179.4° |
| C36 | C37 | C31 | C33 | 2.1° | 0.6° |
| C36 | C37 | C31 | C30 | 174.5° | 179.7° |
| C37 | C36 | C35 | H59 | 179.6° | 179.8° |
| C35 | C34 | C33 | H58 | 180.0° | 179.9° |
| C35 | C34 | C33 | C31 | 0.3° | 0.0° |
| C35 | C34 | C33 | H57 | 179.7° | 180.0° |
| C34 | C35 | C36 | H60 | 179.6° | 180.0° |
| C37 | C31 | C33 | C34 | 1.7° | 0.3° |
| C37 | C31 | C33 | C30 | 176.6° | 179.7° |
| C37 | C31 | C30 | C29 | 11.7° | 90.3° |
| C37 | C31 | C30 | H55 | 108.9° | 149.7° |
| C37 | C31 | C30 | H56 | 132.3° | 29.6° |
| C37 | C31 | C33 | H57 | 178.3° | 179.7° |
| C31 | C37 | C36 | H60 | 178.9° | 179.7° |
| C34 | C33 | C31 | H57 | 180.0° | 180.0° |
| C34 | C33 | C31 | C30 | 174.9° | 180.0° |
| C33 | C34 | C35 | H59 | 179.2° | 179.9° |
| C33 | C31 | C30 | C29 | 164.8° | 90.0° |
| C33 | C31 | C30 | H55 | 74.6° | 29.9° |
| C33 | C31 | C30 | H56 | 44.2° | 150.0° |
| C31 | C33 | C34 | H58 | 179.7° | 179.9° |
| C33 | C31 | C37 | H61 | 177.9° | 180.0° |
| C31 | C30 | C29 | H55 | 120.6° | 120.0° |
| C31 | C30 | C29 | H56 | 120.6° | 120.0° |
| C31 | C30 | C29 | C32 | 163.0° | 175.0° |
| C31 | C30 | C29 | N2 | 56.1° | 65.0° |
| C31 | C30 | C29 | H54 | 53.6° | 55.0° |
| C31 | C30 | H55 | H56 | 118.2° | 120.1° |
| C30 | C31 | C33 | H57 | 5.2° | 0.1° |
| C30 | C31 | C37 | H61 | 5.5° | 0.3° |
| C30 | C29 | C32 | N2 | 139.4° | 120.0° |
| C30 | C29 | C32 | H54 | 109.6° | 120.0° |
| C30 | C29 | C32 | S1 | 56.9° | 75.0° |
| C30 | C29 | N2 | H54 | 109.3° | 120.0° |
| C30 | C29 | N2 | C8 | 30.5° | 155.0° |
| C30 | C29 | N2 | H10 | 149.5° | 25.0° |
| C29 | C30 | H55 | H56 | 118.2° | 120.0° |
| C38 | S1 | C32 | C29 | 178.4° | 180.0° |
| S1 | C38 | C39 | H63 | 179.9° | 180.0° |
| C32 | C29 | N2 | H54 | 110.6° | 120.0° |
| C32 | C29 | N2 | C8 | 109.6° | 85.1° |
| C32 | C29 | N2 | H10 | 70.4° | 95.0° |
| C32 | C29 | C30 | H55 | 42.4° | 65.0° |
| C32 | C29 | C30 | H56 | 76.4° | 55.0° |
| S1 | C32 | C29 | N2 | 82.5° | 45.0° |
| S1 | C32 | C29 | H54 | 166.4° | 165.0° |
| C32 | S1 | C38 | H62 | 179.7° | 179.9° |
| C29 | N2 | C8 | H10 | 180.0° | 179.9° |
| C29 | N2 | C8 | O2 | 3.3° | 0.1° |
| C29 | N2 | C8 | C7 | 177.2° | 180.0° |
| N2 | C29 | C30 | H55 | 176.7° | 55.0° |
| N2 | C29 | C30 | H56 | 64.5° | 175.0° |
| N2 | C8 | O2 | C7 | 179.5° | 180.0° |
| N2 | C8 | C7 | C9 | 138.1° | 72.0° |
| N2 | C8 | C7 | C6 | 89.6° | 167.9° |
| N2 | C8 | C7 | H9 | 24.9° | 48.0° |
| C8 | N2 | C29 | H54 | 139.8° | 34.9° |
| O2 | C8 | C7 | C9 | 42.3° | 108.0° |
| O2 | C8 | C7 | C6 | 90.0° | 12.1° |
| O2 | C8 | C7 | H9 | 155.5° | 132.1° |
| O2 | C8 | N2 | H10 | 176.8° | 180.0° |
| C8 | C7 | C9 | C6 | 131.4° | 120.1° |
| C8 | C7 | C9 | H9 | 113.2° | 120.0° |
| C8 | C7 | C6 | H9 | 114.6° | 120.0° |
| C8 | C7 | C6 | C1 | 13.5° | 68.9° |
| C8 | C7 | C6 | O1 | 147.7° | 171.1° |
| C8 | C7 | C6 | H1 | 100.1° | 51.1° |
| C7 | C8 | N2 | H10 | 2.8° | 0.1° |
| C8 | C7 | C9 | H11 | 180.0° | 66.6° |
| C8 | C7 | C9 | H12 | 60.0° | 53.3° |
| C8 | C7 | C9 | H13 | 60.0° | 173.3° |
| C3 | C2 | C1 | H2 | 119.3° | 118.3° |
| C3 | C2 | C1 | H3 | 119.3° | 118.4° |
| C2 | C3 | C4 | H7 | 119.1° | 118.0° |
| C2 | C3 | C4 | H8 | 119.1° | 118.1° |
| C3 | C2 | C1 | C6 | 110.9° | 141.6° |
| C3 | C2 | C1 | N1 | 23.5° | 22.2° |
| C2 | C3 | C4 | N1 | 33.5° | 37.0° |
| C3 | C2 | H2 | H3 | 122.1° | 123.3° |
| C2 | C3 | C4 | H4 | 152.5° | 81.8° |
| C2 | C3 | C4 | H5 | 85.5° | 155.9° |
| C3 | C2 | C1 | H6 | 133.2° | 97.2° |
| C2 | C3 | H7 | H8 | 122.5° | 124.0° |
| C2 | C1 | C6 | C7 | 82.6° | 64.5° |
| C1 | C2 | C3 | C4 | 35.7° | 35.5° |
| C2 | C1 | C6 | N1 | 127.3° | 117.8° |
| C2 | C1 | C6 | H6 | 115.9° | 121.2° |
| C2 | C1 | N1 | H6 | 109.1° | 119.5° |
| C2 | C1 | C6 | O1 | 49.6° | 55.5° |
| C2 | C1 | N1 | C4 | 2.5° | 1.0° |
| C2 | C1 | N1 | C5 | 178.2° | 178.9° |
| C2 | C1 | C6 | H1 | 163.9° | 175.5° |
| C1 | C2 | H2 | H3 | 122.1° | 123.2° |
| C1 | C2 | C3 | H7 | 83.4° | 153.5° |
| C1 | C2 | C3 | H8 | 154.9° | 82.5° |
| C9 | C7 | C6 | H9 | 115.5° | 120.0° |
| C9 | C7 | C6 | C1 | 143.4° | 171.1° |
| C9 | C7 | C6 | O1 | 82.4° | 51.0° |
| C9 | C7 | C6 | H1 | 29.8° | 68.9° |
| C7 | C9 | H11 | H12 | 120.0° | 120.0° |
| C7 | C9 | H11 | H13 | 120.0° | 120.0° |
| C7 | C9 | H12 | H13 | 120.0° | 120.1° |
| C7 | C6 | O1 | C25 | 37.7° | 102.8° |
| C7 | C6 | C1 | O1 | 132.2° | 120.1° |
| C7 | C6 | C1 | H1 | 113.6° | 120.0° |
| C7 | C6 | C1 | N1 | 150.1° | 177.7° |
| C7 | C6 | O1 | H1 | 111.4° | 120.0° |
| C7 | C6 | C1 | H6 | 33.3° | 56.6° |
| C6 | C7 | C9 | H11 | 48.5° | 53.5° |
| C6 | C7 | C9 | H12 | 71.5° | 173.4° |
| C6 | C7 | C9 | H13 | 168.6° | 66.6° |
| C25 | O1 | C6 | C1 | 97.3° | 137.1° |
| C25 | O1 | C6 | H1 | 149.1° | 17.1° |
| O1 | C25 | H42 | H43 | 120.0° | 120.0° |
| O1 | C25 | H42 | H44 | 120.0° | 120.0° |
| O1 | C25 | H43 | H44 | 120.0° | 120.0° |
| C3 | C4 | N1 | C1 | 19.3° | 24.1° |
| C3 | C4 | N1 | H4 | 119.0° | 118.8° |
| C3 | C4 | N1 | H5 | 119.0° | 118.8° |
| C3 | C4 | N1 | C5 | 160.0° | 155.8° |
| C4 | C3 | C2 | H2 | 83.5° | 153.9° |
| C4 | C3 | C2 | H3 | 155.0° | 82.9° |
| C3 | C4 | H4 | H5 | 122.9° | 122.3° |
| C4 | C3 | H7 | H8 | 122.5° | 123.9° |
| C6 | C1 | N1 | H6 | 116.5° | 121.1° |
| C1 | C6 | O1 | H1 | 113.6° | 120.0° |
| C6 | C1 | N1 | C4 | 131.8° | 118.4° |
| C6 | C1 | N1 | C5 | 47.4° | 61.7° |
| C6 | C1 | C2 | H2 | 129.8° | 100.0° |
| C6 | C1 | C2 | H3 | 8.3° | 23.2° |
| C1 | C6 | C7 | H9 | 101.1° | 51.1° |
| N1 | C1 | C6 | O1 | 77.7° | 62.3° |
| C1 | N1 | C4 | C5 | 179.2° | 179.9° |
| C1 | N1 | C5 | O4 | 3.7° | 0.0° |
| C1 | N1 | C5 | C10 | 174.0° | 180.0° |
| N1 | C1 | C6 | H1 | 36.5° | 57.7° |
| N1 | C1 | C2 | H2 | 95.7° | 140.5° |
| N1 | C1 | C2 | H3 | 142.8° | 96.2° |
| C1 | N1 | C4 | H4 | 138.3° | 94.7° |
| C1 | N1 | C4 | H5 | 99.7° | 143.0° |
| O1 | C6 | C1 | H6 | 165.5° | 176.7° |
| O1 | C6 | C7 | H9 | 33.1° | 68.9° |
| C6 | O1 | C25 | H42 | 180.0° | 54.4° |
| C6 | O1 | C25 | H43 | 60.0° | 174.5° |
| C6 | O1 | C25 | H44 | 60.0° | 65.5° |
| C4 | N1 | C5 | O4 | 175.5° | 179.9° |
| C4 | N1 | C5 | C10 | 6.9° | 0.1° |
| N1 | C4 | H4 | H5 | 122.9° | 122.3° |
| C4 | N1 | C1 | H6 | 111.6° | 120.6° |
| N1 | C4 | C3 | H7 | 85.7° | 155.1° |
| N1 | C4 | C3 | H8 | 152.6° | 81.1° |
| N1 | C5 | O4 | C10 | 177.6° | 180.0° |
| N1 | C5 | C10 | C11 | 155.0° | 174.1° |
| C5 | N1 | C4 | H4 | 41.0° | 85.4° |
| C5 | N1 | C4 | H5 | 81.0° | 37.0° |
| C5 | N1 | C1 | H6 | 69.1° | 59.4° |
| N1 | C5 | C10 | H14 | 34.2° | 65.8° |
| N1 | C5 | C10 | H15 | 84.2° | 54.2° |
| O4 | C5 | C10 | C11 | 27.4° | 5.9° |
| O4 | C5 | C10 | H14 | 148.2° | 114.2° |
| O4 | C5 | C10 | H15 | 93.4° | 125.8° |
| C5 | C10 | C11 | H14 | 120.8° | 120.0° |
| C5 | C10 | C11 | H15 | 120.8° | 120.0° |
| C5 | C10 | C11 | O3 | 58.4° | 78.8° |
| C5 | C10 | C11 | C12 | 168.5° | 161.2° |
| C5 | C10 | H14 | H15 | 117.5° | 120.0° |
| C5 | C10 | C11 | H16 | 53.8° | 41.2° |
| C10 | C11 | O3 | C12 | 137.2° | 120.0° |
| C10 | C11 | O3 | H16 | 111.6° | 120.0° |
| C10 | C11 | C12 | H16 | 115.0° | 120.0° |
| C10 | C11 | O3 | C24 | 120.4° | 88.5° |
| C10 | C11 | C12 | C16 | 10.4° | 74.6° |
| C10 | C11 | C12 | N3 | 150.7° | 165.5° |
| C11 | C10 | H14 | H15 | 117.6° | 120.0° |
| C10 | C11 | C12 | H17 | 102.4° | 45.4° |
| O3 | C11 | C12 | H16 | 112.3° | 120.0° |
| O3 | C11 | C12 | C16 | 122.2° | 45.4° |
| O3 | C11 | C12 | N3 | 18.1° | 74.6° |
| O3 | C11 | C10 | H14 | 62.4° | 161.1° |
| O3 | C11 | C10 | H15 | 179.2° | 41.1° |
| O3 | C11 | C12 | H17 | 124.9° | 165.4° |
| C11 | O3 | C24 | H39 | 180.0° | 179.1° |
| C11 | O3 | C24 | H40 | 60.0° | 59.1° |
| C11 | O3 | C24 | H41 | 60.0° | 61.0° |
| C11 | C12 | C16 | C19 | 19.2° | 66.9° |
| C12 | C11 | O3 | C24 | 102.5° | 151.6° |
| C11 | C12 | C16 | N3 | 140.0° | 120.0° |
| C11 | C12 | C16 | H17 | 112.8° | 120.1° |
| C11 | C12 | N3 | H17 | 106.6° | 120.1° |
| C11 | C12 | C16 | C17 | 117.5° | 173.1° |
| C11 | C12 | N3 | C23 | 96.2° | 55.5° |
| C11 | C12 | N3 | C13 | 90.0° | 124.4° |
| C12 | C11 | C10 | H14 | 70.7° | 41.1° |
| C12 | C11 | C10 | H15 | 47.7° | 78.9° |
| C11 | C12 | C16 | H20 | 132.9° | 53.2° |
| C19 | C16 | C12 | C17 | 136.7° | 120.0° |
| C19 | C16 | C12 | H20 | 113.7° | 120.0° |
| C19 | C16 | C12 | N3 | 120.8° | 173.2° |
| C19 | C16 | C17 | H20 | 110.0° | 120.0° |
| C19 | C16 | C17 | C18 | 144.8° | 159.5° |
| C19 | C16 | C12 | H17 | 132.0° | 53.2° |
| C19 | C16 | C17 | H21 | 24.1° | 39.4° |
| C19 | C16 | C17 | H22 | 94.5° | 80.6° |
| C16 | C19 | H26 | H27 | 120.0° | 120.1° |
| C16 | C19 | H26 | H28 | 120.0° | 120.0° |
| C16 | C19 | H27 | H28 | 120.0° | 120.0° |
| C24 | O3 | C11 | H16 | 8.8° | 31.5° |
| O3 | C24 | H39 | H40 | 120.0° | 120.1° |
| O3 | C24 | H39 | H41 | 120.0° | 119.9° |
| O3 | C24 | H40 | H41 | 120.0° | 120.0° |
| C16 | C12 | N3 | H17 | 107.1° | 120.0° |
| C12 | C16 | C17 | H20 | 109.3° | 120.0° |
| C12 | C16 | C17 | C18 | 74.5° | 80.5° |
| C16 | C12 | N3 | C23 | 117.5° | 64.5° |
| C16 | C12 | N3 | C13 | 56.4° | 115.6° |
| C16 | C12 | C11 | H16 | 125.4° | 165.4° |
| C12 | C16 | C17 | H21 | 164.8° | 159.5° |
| C12 | C16 | C17 | H22 | 46.2° | 39.4° |
| C12 | C16 | C19 | H26 | 180.0° | 158.5° |
| C12 | C16 | C19 | H27 | 60.0° | 81.5° |
| C12 | C16 | C19 | H28 | 60.0° | 38.5° |
| N3 | C12 | C16 | C17 | 102.5° | 53.2° |
| C12 | N3 | C23 | C13 | 175.0° | 179.9° |
| C12 | N3 | C13 | C14 | 17.8° | 176.1° |
| C12 | N3 | C13 | O5 | 161.2° | 3.8° |
| N3 | C12 | C11 | H16 | 94.3° | 45.5° |
| N3 | C12 | C16 | H20 | 7.1° | 66.8° |
| C12 | N3 | C23 | H36 | 180.0° | 96.6° |
| C12 | N3 | C23 | H37 | 60.0° | 23.4° |
| C12 | N3 | C23 | H38 | 60.0° | 143.4° |
| C16 | C17 | C18 | H21 | 120.7° | 120.0° |
| C16 | C17 | C18 | H22 | 120.7° | 120.0° |
| C17 | C16 | C12 | H17 | 4.7° | 66.8° |
| C16 | C17 | H21 | H22 | 117.9° | 120.0° |
| C16 | C17 | C18 | H23 | 180.0° | 79.8° |
| C16 | C17 | C18 | H24 | 60.0° | 40.2° |
| C16 | C17 | C18 | H25 | 60.0° | 160.2° |
| C17 | C16 | C19 | H26 | 43.3° | 38.5° |
| C17 | C16 | C19 | H27 | 163.4° | 158.5° |
| C17 | C16 | C19 | H28 | 76.7° | 81.5° |
| C18 | C17 | C16 | H20 | 34.8° | 39.4° |
| C18 | C17 | H21 | H22 | 117.8° | 120.0° |
| C17 | C18 | H23 | H24 | 120.0° | 120.0° |
| C17 | C18 | H23 | H25 | 120.0° | 120.1° |
| C17 | C18 | H24 | H25 | 120.0° | 120.0° |
| C21 | C20 | C14 | C22 | 130.0° | 120.0° |
| C21 | C20 | C14 | H29 | 114.6° | 120.0° |
| C21 | C20 | C22 | H29 | 113.7° | 120.0° |
| C21 | C20 | C14 | C13 | 55.7° | 61.9° |
| C21 | C20 | C14 | N4 | 174.7° | 178.1° |
| C21 | C20 | C14 | H18 | 64.9° | 58.1° |
| C20 | C21 | H30 | H31 | 120.0° | 120.0° |
| C20 | C21 | H30 | H32 | 120.0° | 120.1° |
| C20 | C21 | H31 | H32 | 120.0° | 120.1° |
| C21 | C20 | C22 | H33 | 180.0° | 180.0° |
| C21 | C20 | C22 | H34 | 60.0° | 60.0° |
| C21 | C20 | C22 | H35 | 60.0° | 60.0° |
| C23 | N3 | C13 | C14 | 155.7° | 4.0° |
| C23 | N3 | C13 | O5 | 25.3° | 176.1° |
| C23 | N3 | C12 | H17 | 10.4° | 175.6° |
| N3 | C23 | H36 | H37 | 120.0° | 120.0° |
| N3 | C23 | H36 | H38 | 120.0° | 120.0° |
| N3 | C23 | H37 | H38 | 120.0° | 120.0° |
| N3 | C13 | C14 | C20 | 119.8° | 103.7° |
| N3 | C13 | C14 | O5 | 179.0° | 179.9° |
| N3 | C13 | C14 | N4 | 118.3° | 136.3° |
| C13 | N3 | C12 | H17 | 163.4° | 4.4° |
| N3 | C13 | C14 | H18 | 0.6° | 16.2° |
| C13 | N3 | C23 | H36 | 5.0° | 83.3° |
| C13 | N3 | C23 | H37 | 115.0° | 156.7° |
| C13 | N3 | C23 | H38 | 125.0° | 36.7° |
| C14 | C20 | C22 | H29 | 115.2° | 120.0° |
| C20 | C14 | C13 | N4 | 121.9° | 120.0° |
| C20 | C14 | C13 | H18 | 120.4° | 119.9° |
| C20 | C14 | N4 | H18 | 119.6° | 119.9° |
| C20 | C14 | C13 | O5 | 59.2° | 76.4° |
| C20 | C14 | N4 | C15 | 143.9° | 85.0° |
| C20 | C14 | N4 | H19 | 36.1° | 95.1° |
| C14 | C20 | C21 | H30 | 180.0° | 54.9° |
| C14 | C20 | C21 | H31 | 60.0° | 174.9° |
| C14 | C20 | C21 | H32 | 60.0° | 65.1° |
| C14 | C20 | C22 | H33 | 49.0° | 60.0° |
| C14 | C20 | C22 | H34 | 71.1° | 180.0° |
| C14 | C20 | C22 | H35 | 168.9° | 60.0° |
| C22 | C20 | C14 | C13 | 74.3° | 178.1° |
| C22 | C20 | C14 | N4 | 44.7° | 58.0° |
| C22 | C20 | C14 | H18 | 165.1° | 62.0° |
| C22 | C20 | C21 | H30 | 47.9° | 65.1° |
| C22 | C20 | C21 | H31 | 72.1° | 54.8° |
| C22 | C20 | C21 | H32 | 167.9° | 174.9° |
| C20 | C22 | H33 | H34 | 120.0° | 120.0° |
| C20 | C22 | H33 | H35 | 120.0° | 120.0° |
| C20 | C22 | H34 | H35 | 120.0° | 120.0° |
| C13 | C14 | N4 | H18 | 117.0° | 120.1° |
| C13 | C14 | N4 | C15 | 92.7° | 155.0° |
| C13 | C14 | N4 | H19 | 87.3° | 24.9° |
| C13 | C14 | C20 | H29 | 170.3° | 58.1° |
| N4 | C14 | C13 | O5 | 62.7° | 43.6° |
| C14 | N4 | C15 | O6 | 7.3° | 0.0° |
| C14 | N4 | C15 | H19 | 180.0° | 179.9° |
| C14 | N4 | C15 | C26 | 173.1° | 179.9° |
| N4 | C14 | C20 | H29 | 70.6° | 62.0° |
| O5 | C13 | C14 | H18 | 179.6° | 163.7° |
| O6 | C15 | N4 | C26 | 179.6° | 180.0° |
| O6 | C15 | C26 | N5 | 72.8° | 145.0° |
| O6 | C15 | C26 | C27 | 46.7° | 24.9° |
| O6 | C15 | C26 | C28 | 168.5° | 95.0° |
| O6 | C15 | N4 | H19 | 172.7° | 180.0° |
| N4 | C15 | C26 | N5 | 106.9° | 35.0° |
| N4 | C15 | C26 | C27 | 133.6° | 155.0° |
| N4 | C15 | C26 | C28 | 11.9° | 85.0° |
| C15 | N4 | C14 | H18 | 24.3° | 34.9° |
| C15 | C26 | N5 | C27 | 118.9° | 120.1° |
| C15 | C26 | N5 | C28 | 120.4° | 120.0° |
| C15 | C26 | C27 | C28 | 121.4° | 120.0° |
| C26 | C15 | N4 | H19 | 6.9° | 0.0° |
| C15 | C26 | N5 | H45 | 180.0° | 60.1° |
| C15 | C26 | N5 | H46 | 60.0° | 63.9° |
| C15 | C26 | C27 | H48 | 180.0° | 180.0° |
| C15 | C26 | C27 | H49 | 60.0° | 59.9° |
| C15 | C26 | C27 | H50 | 60.0° | 60.0° |
| C15 | C26 | C28 | H51 | 180.0° | 60.0° |
| C15 | C26 | C28 | H52 | 60.0° | 60.0° |
| C15 | C26 | C28 | H53 | 60.0° | 180.0° |
| N5 | C26 | C27 | C28 | 118.6° | 120.0° |
| C26 | N5 | H45 | H46 | 120.0° | 124.0° |
| N5 | C26 | C27 | H48 | 60.1° | 60.0° |
| N5 | C26 | C27 | H49 | 59.9° | 180.0° |
| N5 | C26 | C27 | H50 | 179.9° | 60.1° |
| N5 | C26 | C28 | H51 | 59.9° | 60.0° |
| N5 | C26 | C28 | H52 | 179.9° | 180.0° |
| N5 | C26 | C28 | H53 | 60.2° | 60.0° |
| C27 | C26 | N5 | H45 | 61.1° | 60.0° |
| C27 | C26 | N5 | H46 | 179.0° | 176.0° |
| C26 | C27 | H48 | H49 | 120.0° | 120.1° |
| C26 | C27 | H48 | H50 | 120.0° | 120.0° |
| C26 | C27 | H49 | H50 | 120.0° | 119.9° |
| C27 | C26 | C28 | H51 | 59.7° | 180.0° |
| C27 | C26 | C28 | H52 | 60.3° | 60.0° |
| C27 | C26 | C28 | H53 | 179.8° | 60.0° |
| C28 | C26 | N5 | H45 | 59.6° | 180.0° |
| C28 | C26 | N5 | H46 | 60.4° | 56.1° |
| C28 | C26 | C27 | H48 | 58.5° | 60.0° |
| C28 | C26 | C27 | H49 | 178.5° | 60.1° |
| C28 | C26 | C27 | H50 | 61.4° | 180.0° |
| C26 | C28 | H51 | H52 | 120.0° | 120.0° |
| C26 | C28 | H51 | H53 | 120.0° | 120.0° |
| C26 | C28 | H52 | H53 | 120.0° | 120.0° |
| H1 | C6 | C1 | H6 | 80.3° | 63.3° |
| H1 | C6 | C7 | H9 | 145.3° | 171.1° |
| H2 | C2 | C1 | H6 | 13.9° | 21.1° |
| H2 | C2 | C3 | H7 | 157.4° | 88.1° |
| H2 | C2 | C3 | H8 | 35.6° | 35.8° |
| H3 | C2 | C1 | H6 | 107.6° | 144.3° |
| H3 | C2 | C3 | H7 | 35.9° | 35.1° |
| H3 | C2 | C3 | H8 | 85.9° | 159.1° |
| H4 | C4 | C3 | H7 | 33.3° | 36.2° |
| H4 | C4 | C3 | H8 | 88.4° | 160.1° |
| H5 | C4 | C3 | H7 | 155.3° | 86.1° |
| H5 | C4 | C3 | H8 | 33.6° | 37.8° |
| H9 | C7 | C9 | H11 | 66.8° | 173.4° |
| H9 | C7 | C9 | H12 | 173.2° | 66.7° |
| H9 | C7 | C9 | H13 | 53.2° | 53.4° |
| H10 | N2 | C29 | H54 | 40.2° | 145.0° |
| H11 | C9 | H12 | H13 | 120.0° | 120.0° |
| H14 | C10 | C11 | H16 | 174.6° | 78.8° |
| H15 | C10 | C11 | H16 | 66.9° | 161.1° |
| H16 | C11 | C12 | H17 | 12.6° | 74.5° |
| H17 | C12 | C16 | H20 | 114.3° | 173.2° |
| H18 | C14 | N4 | H19 | 155.7° | 145.0° |
| H18 | C14 | C20 | H29 | 49.8° | 178.0° |
| H20 | C16 | C17 | H21 | 85.9° | 80.6° |
| H20 | C16 | C17 | H22 | 155.5° | 159.4° |
| H20 | C16 | C19 | H26 | 66.7° | 81.5° |
| H20 | C16 | C19 | H27 | 53.4° | 38.5° |
| H20 | C16 | C19 | H28 | 173.3° | 158.5° |
| H21 | C17 | C18 | H23 | 59.3° | 160.3° |
| H21 | C17 | C18 | H24 | 179.3° | 79.8° |
| H21 | C17 | C18 | H25 | 60.7° | 40.2° |
| H22 | C17 | C18 | H23 | 59.3° | 40.2° |
| H22 | C17 | C18 | H24 | 60.7° | 160.2° |
| H22 | C17 | C18 | H25 | 179.3° | 79.8° |
| H23 | C18 | H24 | H25 | 120.0° | 120.0° |
| H26 | C19 | H27 | H28 | 120.0° | 119.9° |
| H29 | C20 | C21 | H30 | 65.7° | 174.9° |
| H29 | C20 | C21 | H31 | 174.3° | 65.1° |
| H29 | C20 | C21 | H32 | 54.4° | 54.9° |
| H29 | C20 | C22 | H33 | 66.3° | 60.0° |
| H29 | C20 | C22 | H34 | 173.7° | 60.0° |
| H29 | C20 | C22 | H35 | 53.7° | 179.9° |
| H30 | C21 | H31 | H32 | 120.0° | 119.9° |
| H33 | C22 | H34 | H35 | 120.0° | 120.0° |
| H36 | C23 | H37 | H38 | 120.0° | 120.0° |
| H39 | C24 | H40 | H41 | 120.0° | 120.0° |
| H42 | C25 | H43 | H44 | 120.0° | 119.9° |
| H48 | C27 | H49 | H50 | 120.0° | 120.0° |
| H51 | C28 | H52 | H53 | 120.0° | 120.0° |
| H54 | C29 | C30 | H55 | 67.0° | 175.0° |
| H54 | C29 | C30 | H56 | 174.2° | 65.0° |
| H57 | C33 | C34 | H58 | 0.3° | 0.1° |
| H58 | C34 | C35 | H59 | 0.8° | 0.0° |
| H59 | C35 | C36 | H60 | 0.4° | 0.1° |
| H60 | C36 | C37 | H61 | 1.1° | 0.3° |
| H62 | C38 | C39 | H63 | 0.1° | 0.1° |
