NOF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C12 | sing | 1.48Å | 1.48Å | Aromatic |
| N1 | IR1 | sing | 2.11Å | 2.11Å | |
| N1 | C18 | doub | 1.45Å | 1.45Å | Aromatic |
| N3 | C26 | sing | 1.41Å | 1.41Å | |
| N3 | C29 | sing | 1.40Å | 1.40Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C5 | C6 | sing | 1.51Å | 1.51Å | |
| C5 | C7 | sing | 1.37Å | 1.37Å | |
| C5 | C3 | sing | 1.34Å | 1.34Å | |
| C5 | IR1 | sing | 2.24Å | 2.24Å | |
| C7 | C8 | sing | 1.50Å | 1.50Å | |
| C7 | C9 | sing | 1.41Å | 1.41Å | |
| C7 | IR1 | sing | 2.22Å | 2.22Å | |
| C10 | C9 | sing | 1.50Å | 1.50Å | |
| C13 | C15 | sing | 1.46Å | 1.46Å | Aromatic |
| C13 | C11 | doub | 1.50Å | 1.50Å | Aromatic |
| C15 | C16 | doub | 1.49Å | 1.49Å | Aromatic |
| C17 | C14 | sing | 1.48Å | 1.48Å | Aromatic |
| C17 | C19 | doub | 1.48Å | 1.48Å | Aromatic |
| C20 | C21 | sing | 1.54Å | 1.54Å | |
| C20 | N2 | sing | 1.47Å | 1.47Å | |
| C20 | O1 | doub | 1.42Å | 1.42Å | |
| C21 | C22 | sing | 1.56Å | 1.56Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C24 | C23 | sing | 1.54Å | 1.54Å | |
| C24 | C25 | sing | 1.52Å | 1.52Å | |
| C26 | C28 | sing | 1.65Å | 1.65Å | |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| C28 | C27 | sing | 1.62Å | 1.62Å | |
| C28 | N4 | sing | 1.46Å | 1.46Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C1 | C3 | sing | 1.36Å | 1.36Å | |
| C1 | C9 | sing | 1.41Å | 1.41Å | |
| C1 | IR1 | sing | 2.26Å | 2.26Å | |
| C3 | IR1 | sing | 2.27Å | 2.27Å | |
| C9 | IR1 | sing | 2.28Å | 2.28Å | |
| C11 | C12 | sing | 1.54Å | 1.54Å | Aromatic |
| C11 | N5 | sing | 1.46Å | 1.46Å | |
| C12 | C14 | doub | 1.49Å | 1.49Å | Aromatic |
| IR1 | N5 | sing | 2.14Å | 2.14Å | |
| C14 | C16 | sing | 1.47Å | 1.47Å | Aromatic |
| C16 | N2 | sing | 1.47Å | 1.47Å | |
| C18 | C19 | sing | 1.47Å | 1.47Å | Aromatic |
| C25 | S1 | sing | 1.85Å | 1.85Å | |
| S1 | C27 | sing | 1.69Å | 1.69Å | |
| N4 | C29 | sing | 1.27Å | 1.27Å | |
| C29 | O2 | doub | 1.34Å | 1.34Å | |
| N5 | C30 | sing | 1.54Å | 1.54Å | |
| C30 | O3 | doub | 1.25Å | 1.25Å | |
| C30 | O4 | sing | 1.47Å | 1.47Å | |
| O4 | C31 | sing | 1.46Å | 1.46Å | |
| C31 | C32 | sing | 1.56Å | 1.56Å | |
| C31 | C33 | sing | 1.55Å | 1.55Å | |
| C31 | C34 | sing | 1.54Å | 1.54Å | |
| IR1 | CL46 | sing | 2.76Å | 2.76Å | |
| N3 | H1 | sing | 1.00Å | 1.00Å | |
| C4 | H2 | sing | 1.10Å | 1.10Å | |
| C4 | H3 | sing | 1.10Å | 1.10Å | |
| C4 | H4 | sing | 1.10Å | 1.10Å | |
| C6 | H5 | sing | 1.10Å | 1.10Å | |
| C6 | H6 | sing | 1.10Å | 1.10Å | |
| C6 | H7 | sing | 1.10Å | 1.10Å | |
| C8 | H8 | sing | 1.10Å | 1.10Å | |
| C8 | H9 | sing | 1.10Å | 1.10Å | |
| C8 | H10 | sing | 1.10Å | 1.10Å | |
| C10 | H11 | sing | 1.10Å | 1.10Å | |
| C10 | H12 | sing | 1.10Å | 1.10Å | |
| C10 | H13 | sing | 1.10Å | 1.10Å | |
| C13 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C17 | H16 | sing | 1.08Å | 1.08Å | |
| C21 | H17 | sing | 1.10Å | 1.10Å | |
| C21 | H18 | sing | 1.10Å | 1.10Å | |
| C22 | H19 | sing | 1.10Å | 1.10Å | |
| C22 | H20 | sing | 1.10Å | 1.10Å | |
| C24 | H21 | sing | 1.10Å | 1.10Å | |
| C24 | H22 | sing | 1.10Å | 1.10Å | |
| C26 | H23 | sing | 1.10Å | 1.10Å | |
| C28 | H24 | sing | 1.10Å | 1.10Å | |
| C2 | H25 | sing | 1.10Å | 1.10Å | |
| C2 | H26 | sing | 1.10Å | 1.10Å | |
| C2 | H27 | sing | 1.10Å | 1.10Å | |
| C18 | H28 | sing | 1.08Å | 1.08Å | |
| C19 | H29 | sing | 1.08Å | 1.08Å | |
| N2 | H30 | sing | 1.00Å | 1.00Å | |
| C23 | H31 | sing | 1.10Å | 1.10Å | |
| C23 | H32 | sing | 1.10Å | 1.10Å | |
| C25 | H33 | sing | 1.10Å | 1.10Å | |
| C27 | H34 | sing | 1.10Å | 1.10Å | |
| C27 | H35 | sing | 1.10Å | 1.10Å | |
| N4 | H36 | sing | 1.00Å | 1.00Å | |
| C32 | H37 | sing | 1.10Å | 1.10Å | |
| C32 | H38 | sing | 1.10Å | 1.10Å | |
| C32 | H39 | sing | 1.10Å | 1.10Å | |
| C33 | H40 | sing | 1.10Å | 1.10Å | |
| C33 | H41 | sing | 1.10Å | 1.10Å | |
| C33 | H42 | sing | 1.10Å | 1.10Å | |
| C34 | H43 | sing | 1.10Å | 1.10Å | |
| C34 | H44 | sing | 1.10Å | 1.10Å | |
| C34 | H45 | sing | 1.10Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | N1 | IR1 | 101.0° | 101.0° |
| C12 | N1 | C18 | 124.3° | 124.3° |
| N1 | C12 | C11 | 122.3° | 122.3° |
| N1 | C12 | C14 | 118.3° | 118.3° |
| IR1 | N1 | C18 | 134.6° | 134.6° |
| N1 | IR1 | C5 | 146.6° | 146.6° |
| N1 | IR1 | C7 | 136.3° | 136.3° |
| N1 | IR1 | C1 | 88.9° | 88.9° |
| N1 | IR1 | C3 | 113.3° | 113.3° |
| N1 | IR1 | C9 | 100.6° | 100.6° |
| N1 | IR1 | N5 | 93.9° | 93.9° |
| N1 | IR1 | CL46 | 95.2° | 95.2° |
| N1 | C18 | C19 | 116.1° | 116.1° |
| N1 | C18 | H28 | 122.0° | 122.0° |
| C26 | N3 | C29 | 108.5° | 108.5° |
| N3 | C26 | C28 | 107.0° | 107.0° |
| N3 | C26 | C25 | 113.0° | 113.0° |
| C26 | N3 | H1 | 125.8° | 125.8° |
| N3 | C26 | H23 | 109.9° | 109.9° |
| N3 | C29 | N4 | 110.7° | 110.7° |
| N3 | C29 | O2 | 122.2° | 122.2° |
| C29 | N3 | H1 | 125.7° | 125.7° |
| C4 | C3 | C5 | 122.4° | 122.4° |
| C4 | C3 | C1 | 127.5° | 127.5° |
| C4 | C3 | IR1 | 121.8° | 121.8° |
| C3 | C4 | H2 | 109.5° | 109.5° |
| C3 | C4 | H3 | 109.4° | 109.4° |
| C3 | C4 | H4 | 109.5° | 109.5° |
| C6 | C5 | C7 | 130.0° | 130.0° |
| C6 | C5 | C3 | 120.1° | 120.1° |
| C6 | C5 | IR1 | 118.9° | 118.9° |
| C5 | C6 | H5 | 109.5° | 109.5° |
| C5 | C6 | H6 | 109.4° | 109.5° |
| C5 | C6 | H7 | 109.5° | 109.5° |
| C7 | C5 | C3 | 109.9° | 109.9° |
| C7 | C5 | IR1 | 71.5° | 71.5° |
| C5 | C7 | C8 | 129.6° | 129.6° |
| C5 | C7 | C9 | 106.3° | 106.3° |
| C5 | C7 | IR1 | 72.8° | 72.8° |
| C3 | C5 | IR1 | 74.1° | 74.1° |
| C5 | C3 | C1 | 110.1° | 110.1° |
| C5 | C3 | IR1 | 71.4° | 71.4° |
| C5 | IR1 | C7 | 35.7° | 35.7° |
| C5 | IR1 | C1 | 58.7° | 58.7° |
| C5 | IR1 | C3 | 34.5° | 34.5° |
| C5 | IR1 | C9 | 58.8° | 58.8° |
| C5 | IR1 | N5 | 114.9° | 114.9° |
| C5 | IR1 | CL46 | 96.1° | 96.1° |
| C8 | C7 | C9 | 123.9° | 123.9° |
| C8 | C7 | IR1 | 121.4° | 121.4° |
| C7 | C8 | H8 | 109.5° | 109.5° |
| C7 | C8 | H9 | 109.5° | 109.4° |
| C7 | C8 | H10 | 109.5° | 109.5° |
| C9 | C7 | IR1 | 74.2° | 74.2° |
| C7 | C9 | C10 | 127.3° | 127.3° |
| C7 | C9 | C1 | 107.0° | 107.0° |
| C7 | C9 | IR1 | 69.4° | 69.4° |
| C7 | IR1 | C1 | 60.7° | 60.7° |
| C7 | IR1 | C3 | 59.0° | 59.0° |
| C7 | IR1 | C9 | 36.4° | 36.4° |
| C7 | IR1 | N5 | 89.9° | 89.9° |
| C7 | IR1 | CL46 | 127.1° | 127.1° |
| C10 | C9 | C1 | 125.6° | 125.6° |
| C10 | C9 | IR1 | 122.4° | 122.4° |
| C9 | C10 | H11 | 109.5° | 109.5° |
| C9 | C10 | H12 | 109.5° | 109.5° |
| C9 | C10 | H13 | 109.5° | 109.5° |
| C15 | C13 | C11 | 118.2° | 118.2° |
| C13 | C15 | C16 | 121.9° | 121.9° |
| C15 | C13 | H14 | 120.9° | 120.9° |
| C13 | C15 | H15 | 119.0° | 119.0° |
| C13 | C11 | C12 | 120.1° | 120.1° |
| C13 | C11 | N5 | 117.7° | 117.7° |
| C11 | C13 | H14 | 120.9° | 120.9° |
| C15 | C16 | C14 | 120.8° | 120.8° |
| C15 | C16 | N2 | 116.1° | 116.1° |
| C16 | C15 | H15 | 119.0° | 119.0° |
| C14 | C17 | C19 | 119.7° | 119.7° |
| C17 | C14 | C12 | 119.0° | 119.0° |
| C17 | C14 | C16 | 121.6° | 121.6° |
| C14 | C17 | H16 | 120.2° | 120.2° |
| C17 | C19 | C18 | 122.6° | 122.6° |
| C19 | C17 | H16 | 120.2° | 120.2° |
| C17 | C19 | H29 | 118.7° | 118.7° |
| C21 | C20 | N2 | 118.7° | 118.7° |
| C21 | C20 | O1 | 121.5° | 121.5° |
| C20 | C21 | C22 | 106.3° | 106.3° |
| C20 | C21 | H17 | 110.2° | 110.2° |
| C20 | C21 | H18 | 110.3° | 110.3° |
| N2 | C20 | O1 | 119.5° | 119.5° |
| C20 | N2 | C16 | 113.2° | 113.2° |
| C20 | N2 | H30 | 123.4° | 123.4° |
| C21 | C22 | C23 | 108.0° | 108.0° |
| C22 | C21 | H17 | 110.2° | 110.2° |
| C22 | C21 | H18 | 110.3° | 110.3° |
| C21 | C22 | H19 | 109.9° | 109.9° |
| C21 | C22 | H20 | 109.8° | 109.8° |
| C22 | C23 | C24 | 111.8° | 111.8° |
| C23 | C22 | H19 | 109.8° | 109.8° |
| C23 | C22 | H20 | 109.8° | 109.8° |
| C22 | C23 | H31 | 108.9° | 108.9° |
| C22 | C23 | H32 | 108.9° | 108.9° |
| C23 | C24 | C25 | 114.7° | 114.7° |
| C23 | C24 | H21 | 108.2° | 108.2° |
| C23 | C24 | H22 | 108.1° | 108.1° |
| C24 | C23 | H31 | 108.9° | 108.9° |
| C24 | C23 | H32 | 108.9° | 108.9° |
| C24 | C25 | C26 | 115.8° | 115.8° |
| C24 | C25 | S1 | 116.2° | 116.2° |
| C25 | C24 | H21 | 108.2° | 108.2° |
| C25 | C24 | H22 | 108.2° | 108.2° |
| C24 | C25 | H33 | 109.3° | 109.3° |
| C28 | C26 | C25 | 111.7° | 111.7° |
| C26 | C28 | C27 | 101.2° | 101.2° |
| C26 | C28 | N4 | 95.1° | 95.1° |
| C28 | C26 | H23 | 106.8° | 106.8° |
| C26 | C28 | H24 | 114.1° | 114.1° |
| C26 | C25 | S1 | 99.8° | 99.8° |
| C25 | C26 | H23 | 108.2° | 108.2° |
| C26 | C25 | H33 | 109.2° | 109.2° |
| C27 | C28 | N4 | 111.3° | 111.3° |
| C28 | C27 | S1 | 110.2° | 110.2° |
| C27 | C28 | H24 | 114.7° | 114.7° |
| C28 | C27 | H34 | 109.3° | 109.3° |
| C28 | C27 | H35 | 109.3° | 109.3° |
| C28 | N4 | C29 | 118.6° | 118.6° |
| N4 | C28 | H24 | 117.6° | 117.6° |
| C28 | N4 | H36 | 120.7° | 120.7° |
| C2 | C1 | C3 | 126.1° | 126.1° |
| C2 | C1 | C9 | 126.9° | 126.9° |
| C2 | C1 | IR1 | 126.5° | 126.5° |
| C1 | C2 | H25 | 109.5° | 109.5° |
| C1 | C2 | H26 | 109.5° | 109.5° |
| C1 | C2 | H27 | 109.5° | 109.5° |
| C3 | C1 | C9 | 106.4° | 106.4° |
| C3 | C1 | IR1 | 72.8° | 72.8° |
| C1 | C3 | IR1 | 72.3° | 72.3° |
| C9 | C1 | IR1 | 72.6° | 72.6° |
| C1 | C9 | IR1 | 71.2° | 71.2° |
| C1 | IR1 | C3 | 34.9° | 34.9° |
| C1 | IR1 | C9 | 36.2° | 36.2° |
| C1 | IR1 | N5 | 137.1° | 137.1° |
| C1 | IR1 | CL46 | 122.6° | 122.6° |
| C3 | IR1 | C9 | 58.3° | 58.3° |
| C3 | IR1 | N5 | 147.9° | 147.9° |
| C3 | IR1 | CL46 | 94.5° | 94.5° |
| C9 | IR1 | N5 | 101.8° | 101.8° |
| C9 | IR1 | CL46 | 152.2° | 152.2° |
| C12 | C11 | N5 | 122.2° | 122.2° |
| C11 | C12 | C14 | 119.4° | 119.4° |
| C11 | N5 | IR1 | 100.5° | 100.5° |
| C11 | N5 | C30 | 112.2° | 112.2° |
| C12 | C14 | C16 | 119.4° | 119.4° |
| IR1 | N5 | C30 | 115.9° | 115.9° |
| N5 | IR1 | CL46 | 99.7° | 99.7° |
| C14 | C16 | N2 | 122.8° | 122.8° |
| C16 | N2 | H30 | 123.4° | 123.4° |
| C19 | C18 | H28 | 121.9° | 121.9° |
| C18 | C19 | H29 | 118.7° | 118.7° |
| C25 | S1 | C27 | 92.7° | 92.7° |
| S1 | C25 | H33 | 105.7° | 105.7° |
| S1 | C27 | H34 | 109.3° | 109.3° |
| S1 | C27 | H35 | 109.3° | 109.3° |
| N4 | C29 | O2 | 126.9° | 126.9° |
| C29 | N4 | H36 | 120.7° | 120.7° |
| N5 | C30 | O3 | 120.1° | 120.1° |
| N5 | C30 | O4 | 119.3° | 119.3° |
| O3 | C30 | O4 | 115.3° | 115.3° |
| C30 | O4 | C31 | 120.4° | 120.4° |
| O4 | C31 | C32 | 113.6° | 113.6° |
| O4 | C31 | C33 | 114.4° | 114.4° |
| O4 | C31 | C34 | 104.5° | 104.5° |
| C32 | C31 | C33 | 108.8° | 108.8° |
| C32 | C31 | C34 | 110.0° | 110.0° |
| C31 | C32 | H37 | 109.5° | 109.5° |
| C31 | C32 | H38 | 109.5° | 109.5° |
| C31 | C32 | H39 | 109.5° | 109.5° |
| C33 | C31 | C34 | 105.0° | 105.0° |
| C31 | C33 | H40 | 109.5° | 109.5° |
| C31 | C33 | H41 | 109.4° | 109.4° |
| C31 | C33 | H42 | 109.4° | 109.5° |
| C31 | C34 | H43 | 109.5° | 109.5° |
| C31 | C34 | H44 | 109.5° | 109.5° |
| C31 | C34 | H45 | 109.5° | 109.5° |
| H2 | C4 | H3 | 109.5° | 109.4° |
| H2 | C4 | H4 | 109.5° | 109.4° |
| H3 | C4 | H4 | 109.5° | 109.5° |
| H5 | C6 | H6 | 109.5° | 109.5° |
| H5 | C6 | H7 | 109.5° | 109.5° |
| H6 | C6 | H7 | 109.5° | 109.5° |
| H8 | C8 | H9 | 109.4° | 109.5° |
| H8 | C8 | H10 | 109.5° | 109.5° |
| H9 | C8 | H10 | 109.5° | 109.5° |
| H11 | C10 | H12 | 109.5° | 109.5° |
| H11 | C10 | H13 | 109.5° | 109.5° |
| H12 | C10 | H13 | 109.4° | 109.4° |
| H17 | C21 | H18 | 109.5° | 109.5° |
| H19 | C22 | H20 | 109.5° | 109.5° |
| H21 | C24 | H22 | 109.5° | 109.5° |
| H25 | C2 | H26 | 109.5° | 109.5° |
| H25 | C2 | H27 | 109.5° | 109.5° |
| H26 | C2 | H27 | 109.4° | 109.4° |
| H31 | C23 | H32 | 109.5° | 109.5° |
| H34 | C27 | H35 | 109.5° | 109.5° |
| H37 | C32 | H38 | 109.4° | 109.5° |
| H37 | C32 | H39 | 109.5° | 109.5° |
| H38 | C32 | H39 | 109.4° | 109.4° |
| H40 | C33 | H41 | 109.5° | 109.5° |
| H40 | C33 | H42 | 109.5° | 109.4° |
| H41 | C33 | H42 | 109.5° | 109.5° |
| H43 | C34 | H44 | 109.4° | 109.4° |
| H43 | C34 | H45 | 109.5° | 109.5° |
| H44 | C34 | H45 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | N1 | IR1 | C18 | 175.3° | 175.3° |
| C12 | N1 | IR1 | C5 | 149.5° | 149.5° |
| C12 | N1 | IR1 | C7 | 92.8° | 92.8° |
| N1 | C12 | C11 | C13 | 178.5° | 178.5° |
| N1 | C12 | C14 | C17 | 1.9° | 1.9° |
| C12 | N1 | IR1 | C1 | 136.1° | 136.1° |
| C12 | N1 | IR1 | C3 | 161.6° | 161.6° |
| C12 | N1 | IR1 | C9 | 101.7° | 101.7° |
| N1 | C12 | C11 | C14 | 178.9° | 178.9° |
| N1 | C12 | C11 | N5 | 4.0° | 4.0° |
| C12 | N1 | IR1 | N5 | 1.1° | 1.1° |
| N1 | C12 | C14 | C16 | 178.7° | 178.7° |
| C12 | N1 | C18 | C19 | 4.3° | 4.3° |
| C12 | N1 | IR1 | CL46 | 101.2° | 101.2° |
| C12 | N1 | C18 | H28 | 175.7° | 175.7° |
| N1 | IR1 | C3 | C4 | 74.7° | 74.7° |
| N1 | IR1 | C5 | C6 | 135.9° | 135.9° |
| N1 | IR1 | C7 | C5 | 128.0° | 128.0° |
| N1 | IR1 | C3 | C5 | 168.2° | 168.2° |
| N1 | IR1 | C5 | C1 | 15.8° | 15.8° |
| N1 | IR1 | C5 | C9 | 58.3° | 58.3° |
| N1 | IR1 | C5 | N5 | 147.3° | 147.3° |
| N1 | IR1 | C5 | CL46 | 109.0° | 109.0° |
| N1 | IR1 | C7 | C8 | 105.7° | 105.7° |
| N1 | IR1 | C9 | C7 | 169.7° | 169.7° |
| N1 | IR1 | C7 | C1 | 51.8° | 51.8° |
| N1 | IR1 | C7 | C3 | 92.3° | 92.3° |
| N1 | IR1 | C7 | N5 | 95.5° | 95.5° |
| N1 | IR1 | C7 | CL46 | 162.3° | 162.3° |
| N1 | IR1 | C9 | C10 | 47.7° | 47.7° |
| N1 | IR1 | C1 | C2 | 13.6° | 13.6° |
| N1 | IR1 | C3 | C1 | 49.0° | 49.0° |
| N1 | IR1 | C9 | C1 | 73.1° | 73.1° |
| N1 | IR1 | C1 | N5 | 94.6° | 94.6° |
| N1 | IR1 | C1 | CL46 | 95.4° | 95.4° |
| N1 | IR1 | C3 | C9 | 88.3° | 88.3° |
| N1 | IR1 | C3 | N5 | 146.1° | 146.1° |
| N1 | IR1 | C3 | CL46 | 97.6° | 97.6° |
| N1 | IR1 | C9 | N5 | 96.3° | 96.3° |
| N1 | IR1 | C9 | CL46 | 123.6° | 123.6° |
| IR1 | N1 | C12 | C11 | 1.0° | 1.0° |
| N1 | IR1 | N5 | C11 | 2.8° | 2.8° |
| IR1 | N1 | C12 | C14 | 179.9° | 179.9° |
| N1 | IR1 | N5 | CL46 | 95.9° | 95.9° |
| IR1 | N1 | C18 | C19 | 178.7° | 178.7° |
| N1 | IR1 | N5 | C30 | 118.3° | 118.3° |
| IR1 | N1 | C18 | H28 | 1.3° | 1.3° |
| C18 | N1 | IR1 | C5 | 35.2° | 35.2° |
| C18 | N1 | IR1 | C7 | 91.9° | 91.9° |
| N1 | C18 | C19 | C17 | 2.4° | 2.4° |
| C18 | N1 | IR1 | C1 | 48.6° | 48.6° |
| C18 | N1 | IR1 | C3 | 23.1° | 23.1° |
| C18 | N1 | IR1 | C9 | 83.0° | 83.0° |
| C18 | N1 | C12 | C11 | 177.0° | 177.0° |
| C18 | N1 | C12 | C14 | 4.1° | 4.1° |
| C18 | N1 | IR1 | N5 | 174.2° | 174.2° |
| N1 | C18 | C19 | H28 | 180.0° | 180.0° |
| C18 | N1 | IR1 | CL46 | 74.1° | 74.1° |
| N1 | C18 | C19 | H29 | 177.6° | 177.6° |
| C26 | N3 | C29 | H1 | 180.0° | 180.0° |
| N3 | C26 | C25 | C24 | 43.1° | 43.1° |
| N3 | C26 | C28 | C25 | 124.2° | 124.2° |
| N3 | C26 | C28 | H23 | 117.7° | 117.6° |
| N3 | C26 | C25 | H23 | 122.0° | 121.9° |
| N3 | C26 | C28 | C27 | 111.3° | 111.3° |
| N3 | C26 | C28 | N4 | 1.6° | 1.6° |
| N3 | C26 | C25 | S1 | 82.5° | 82.5° |
| C26 | N3 | C29 | N4 | 3.5° | 3.5° |
| C26 | N3 | C29 | O2 | 179.0° | 179.0° |
| N3 | C26 | C28 | H24 | 125.0° | 125.0° |
| N3 | C26 | C25 | H33 | 166.9° | 166.9° |
| C29 | N3 | C26 | C28 | 3.0° | 3.0° |
| C29 | N3 | C26 | C25 | 126.4° | 126.4° |
| N3 | C29 | N4 | C28 | 2.5° | 2.5° |
| N3 | C29 | N4 | O2 | 175.3° | 175.3° |
| C29 | N3 | C26 | H23 | 112.6° | 112.6° |
| N3 | C29 | N4 | H36 | 177.5° | 177.5° |
| C4 | C3 | C5 | C6 | 1.8° | 1.8° |
| C4 | C3 | C5 | C7 | 179.4° | 179.4° |
| C4 | C3 | C5 | C1 | 178.7° | 178.7° |
| C4 | C3 | C5 | IR1 | 116.4° | 116.4° |
| C4 | C3 | IR1 | C7 | 154.1° | 154.1° |
| C4 | C3 | C1 | C2 | 6.1° | 6.1° |
| C4 | C3 | C1 | IR1 | 116.9° | 116.9° |
| C4 | C3 | C1 | C9 | 177.8° | 177.8° |
| C4 | C3 | IR1 | C9 | 162.9° | 162.9° |
| C4 | C3 | IR1 | N5 | 139.3° | 139.3° |
| C4 | C3 | IR1 | CL46 | 22.9° | 22.9° |
| C3 | C4 | H2 | H3 | 120.0° | 120.0° |
| C3 | C4 | H2 | H4 | 120.0° | 120.0° |
| C3 | C4 | H3 | H4 | 120.0° | 120.0° |
| C6 | C5 | C7 | C3 | 177.3° | 177.3° |
| C6 | C5 | C7 | IR1 | 112.6° | 112.6° |
| C6 | C5 | C3 | IR1 | 114.6° | 114.6° |
| C6 | C5 | C7 | C8 | 4.3° | 4.3° |
| C6 | C5 | C7 | C9 | 179.8° | 179.8° |
| C6 | C5 | C3 | C1 | 176.9° | 176.9° |
| C6 | C5 | IR1 | C1 | 151.7° | 151.7° |
| C6 | C5 | IR1 | C9 | 165.8° | 165.8° |
| C6 | C5 | IR1 | N5 | 76.7° | 76.7° |
| C6 | C5 | IR1 | CL46 | 26.9° | 26.9° |
| C5 | C6 | H5 | H6 | 120.0° | 120.0° |
| C5 | C6 | H5 | H7 | 120.0° | 120.0° |
| C5 | C6 | H6 | H7 | 120.0° | 120.0° |
| C7 | C5 | C3 | IR1 | 63.1° | 63.1° |
| C5 | C7 | C8 | C9 | 175.3° | 175.3° |
| C5 | C7 | C8 | IR1 | 93.2° | 93.2° |
| C5 | C7 | C9 | IR1 | 66.2° | 66.2° |
| C5 | C7 | C9 | C10 | 178.1° | 178.1° |
| C7 | C5 | C3 | C1 | 0.7° | 0.7° |
| C5 | C7 | C9 | C1 | 4.6° | 4.6° |
| C5 | C7 | IR1 | C1 | 76.2° | 76.2° |
| C7 | C5 | IR1 | N5 | 49.4° | 49.4° |
| C7 | C5 | IR1 | CL46 | 153.1° | 153.1° |
| C7 | C5 | C6 | H5 | 180.0° | 180.0° |
| C7 | C5 | C6 | H6 | 60.0° | 60.0° |
| C7 | C5 | C6 | H7 | 60.0° | 60.0° |
| C5 | C7 | C8 | H8 | 180.0° | 180.0° |
| C5 | C7 | C8 | H9 | 60.0° | 60.0° |
| C5 | C7 | C8 | H10 | 60.0° | 60.0° |
| C3 | C5 | C7 | C8 | 178.4° | 178.4° |
| C3 | C5 | C7 | C9 | 2.5° | 2.5° |
| C5 | C3 | C1 | C2 | 175.2° | 175.2° |
| C5 | C3 | C1 | IR1 | 61.8° | 61.8° |
| C5 | C3 | C1 | C9 | 3.6° | 3.6° |
| C5 | C3 | IR1 | C9 | 79.9° | 79.9° |
| C3 | C5 | IR1 | N5 | 167.3° | 167.3° |
| C3 | C5 | IR1 | CL46 | 89.1° | 89.1° |
| C5 | C3 | C4 | H2 | 180.0° | 180.0° |
| C5 | C3 | C4 | H3 | 60.0° | 60.0° |
| C5 | C3 | C4 | H4 | 60.0° | 60.0° |
| C3 | C5 | C6 | H5 | 2.9° | 2.9° |
| C3 | C5 | C6 | H6 | 117.1° | 117.1° |
| C3 | C5 | C6 | H7 | 122.9° | 122.9° |
| C5 | IR1 | C9 | C10 | 160.7° | 160.7° |
| C5 | IR1 | C1 | C2 | 157.8° | 157.8° |
| C5 | IR1 | C9 | C1 | 78.4° | 78.4° |
| C5 | IR1 | C1 | N5 | 94.0° | 94.0° |
| C5 | IR1 | C1 | CL46 | 76.0° | 76.0° |
| C5 | IR1 | C9 | N5 | 112.1° | 112.1° |
| C5 | IR1 | C9 | CL46 | 28.0° | 28.0° |
| C5 | IR1 | N5 | C11 | 159.9° | 159.9° |
| C5 | IR1 | N5 | CL46 | 101.4° | 101.4° |
| C5 | IR1 | N5 | C30 | 79.0° | 79.0° |
| IR1 | C5 | C6 | H5 | 90.6° | 90.6° |
| IR1 | C5 | C6 | H6 | 29.5° | 29.4° |
| IR1 | C5 | C6 | H7 | 149.4° | 149.4° |
| C8 | C7 | C9 | IR1 | 117.5° | 117.5° |
| C8 | C7 | C9 | C10 | 1.9° | 1.9° |
| C8 | C7 | C9 | C1 | 179.2° | 179.2° |
| C8 | C7 | IR1 | C1 | 157.5° | 157.5° |
| C8 | C7 | IR1 | C3 | 162.0° | 162.0° |
| C8 | C7 | IR1 | N5 | 10.1° | 10.1° |
| C8 | C7 | IR1 | CL46 | 92.0° | 92.0° |
| C7 | C8 | H8 | H9 | 120.0° | 120.0° |
| C7 | C8 | H8 | H10 | 120.0° | 120.0° |
| C7 | C8 | H9 | H10 | 120.0° | 120.0° |
| C7 | C9 | C10 | C1 | 176.8° | 176.8° |
| C7 | C9 | C10 | IR1 | 87.7° | 87.7° |
| C7 | C9 | C1 | C2 | 176.5° | 176.5° |
| C7 | C9 | C1 | C3 | 5.0° | 5.0° |
| C7 | C9 | C1 | IR1 | 60.5° | 60.5° |
| C7 | C9 | IR1 | C3 | 79.4° | 79.4° |
| C9 | C7 | IR1 | N5 | 110.3° | 110.3° |
| C9 | C7 | IR1 | CL46 | 147.5° | 147.5° |
| C9 | C7 | C8 | H8 | 4.7° | 4.7° |
| C9 | C7 | C8 | H9 | 115.3° | 115.3° |
| C9 | C7 | C8 | H10 | 124.7° | 124.7° |
| C7 | C9 | C10 | H11 | 180.0° | 180.0° |
| C7 | C9 | C10 | H12 | 60.0° | 60.0° |
| C7 | C9 | C10 | H13 | 60.0° | 60.0° |
| C7 | IR1 | C1 | C2 | 160.7° | 160.7° |
| C7 | IR1 | C3 | C1 | 82.2° | 82.2° |
| C7 | IR1 | C1 | N5 | 52.5° | 52.5° |
| C7 | IR1 | C1 | CL46 | 117.5° | 117.5° |
| C7 | IR1 | C3 | N5 | 14.9° | 14.9° |
| C7 | IR1 | C3 | CL46 | 131.2° | 131.2° |
| C7 | IR1 | N5 | C11 | 133.6° | 133.6° |
| C7 | IR1 | N5 | CL46 | 127.7° | 127.7° |
| C7 | IR1 | N5 | C30 | 105.3° | 105.3° |
| IR1 | C7 | C8 | H8 | 86.8° | 86.8° |
| IR1 | C7 | C8 | H9 | 153.2° | 153.2° |
| IR1 | C7 | C8 | H10 | 33.2° | 33.2° |
| C10 | C9 | C1 | C2 | 6.1° | 6.1° |
| C10 | C9 | C1 | C3 | 177.7° | 177.7° |
| C10 | C9 | C1 | IR1 | 116.9° | 116.9° |
| C10 | C9 | IR1 | C3 | 158.7° | 158.7° |
| C10 | C9 | IR1 | N5 | 48.6° | 48.6° |
| C10 | C9 | IR1 | CL46 | 171.3° | 171.3° |
| C9 | C10 | H11 | H12 | 120.0° | 120.0° |
| C9 | C10 | H11 | H13 | 120.0° | 120.0° |
| C9 | C10 | H12 | H13 | 120.0° | 120.0° |
| C15 | C13 | C11 | H14 | 180.0° | 180.0° |
| C13 | C15 | C16 | H15 | 180.0° | 180.0° |
| C15 | C13 | C11 | C12 | 1.9° | 1.9° |
| C15 | C13 | C11 | N5 | 179.4° | 179.4° |
| C13 | C15 | C16 | C14 | 4.6° | 4.6° |
| C13 | C15 | C16 | N2 | 178.0° | 178.0° |
| C11 | C13 | C15 | C16 | 4.3° | 4.3° |
| C13 | C11 | C12 | N5 | 177.4° | 177.4° |
| C13 | C11 | C12 | C14 | 0.3° | 0.3° |
| C13 | C11 | N5 | IR1 | 178.3° | 178.3° |
| C13 | C11 | N5 | C30 | 57.9° | 57.9° |
| C11 | C13 | C15 | H15 | 175.7° | 175.7° |
| C15 | C16 | C14 | C17 | 178.4° | 178.4° |
| C15 | C16 | N2 | C20 | 45.5° | 45.5° |
| C15 | C16 | C14 | C12 | 2.2° | 2.2° |
| C15 | C16 | C14 | N2 | 172.9° | 172.9° |
| C16 | C15 | C13 | H14 | 175.7° | 175.7° |
| C15 | C16 | N2 | H30 | 134.6° | 134.6° |
| C14 | C17 | C19 | H16 | 180.0° | 180.0° |
| C17 | C14 | C12 | C11 | 179.2° | 179.2° |
| C17 | C14 | C12 | C16 | 179.4° | 179.4° |
| C17 | C14 | C16 | N2 | 5.5° | 5.5° |
| C14 | C17 | C19 | C18 | 0.5° | 0.5° |
| C14 | C17 | C19 | H29 | 179.5° | 179.5° |
| C19 | C17 | C14 | C12 | 0.2° | 0.2° |
| C19 | C17 | C14 | C16 | 179.6° | 179.6° |
| C17 | C19 | C18 | H29 | 180.0° | 180.0° |
| C17 | C19 | C18 | H28 | 177.6° | 177.6° |
| C21 | C20 | N2 | O1 | 174.4° | 174.4° |
| C20 | C21 | C22 | H17 | 119.5° | 119.5° |
| C20 | C21 | C22 | H18 | 119.5° | 119.5° |
| C20 | C21 | C22 | C23 | 59.3° | 59.3° |
| C21 | C20 | N2 | C16 | 176.0° | 176.0° |
| C20 | C21 | H17 | H18 | 121.5° | 121.5° |
| C20 | C21 | C22 | H19 | 60.5° | 60.5° |
| C20 | C21 | C22 | H20 | 179.0° | 179.0° |
| C21 | C20 | N2 | H30 | 4.1° | 4.1° |
| N2 | C20 | C21 | C22 | 140.5° | 140.5° |
| C20 | N2 | C16 | C14 | 141.3° | 141.3° |
| C20 | N2 | C16 | H30 | 180.0° | 180.0° |
| N2 | C20 | C21 | H17 | 100.0° | 100.0° |
| N2 | C20 | C21 | H18 | 21.0° | 21.0° |
| O1 | C20 | C21 | C22 | 45.2° | 45.2° |
| O1 | C20 | N2 | C16 | 9.6° | 9.6° |
| O1 | C20 | C21 | H17 | 74.3° | 74.3° |
| O1 | C20 | C21 | H18 | 164.7° | 164.7° |
| O1 | C20 | N2 | H30 | 170.4° | 170.4° |
| C21 | C22 | C23 | H19 | 119.8° | 119.8° |
| C21 | C22 | C23 | H20 | 119.7° | 119.7° |
| C21 | C22 | C23 | C24 | 173.3° | 173.3° |
| C22 | C21 | H17 | H18 | 121.5° | 121.5° |
| C21 | C22 | H19 | H20 | 120.7° | 120.7° |
| C21 | C22 | C23 | H31 | 52.9° | 52.9° |
| C21 | C22 | C23 | H32 | 66.4° | 66.4° |
| C22 | C23 | C24 | H31 | 120.4° | 120.4° |
| C22 | C23 | C24 | H32 | 120.4° | 120.4° |
| C22 | C23 | C24 | C25 | 175.1° | 175.1° |
| C23 | C22 | C21 | H17 | 178.8° | 178.8° |
| C23 | C22 | C21 | H18 | 60.2° | 60.2° |
| C23 | C22 | H19 | H20 | 120.7° | 120.7° |
| C22 | C23 | C24 | H21 | 64.2° | 64.2° |
| C22 | C23 | C24 | H22 | 54.3° | 54.3° |
| C22 | C23 | H31 | H32 | 119.0° | 119.0° |
| C23 | C24 | C25 | H21 | 120.8° | 120.8° |
| C23 | C24 | C25 | H22 | 120.8° | 120.8° |
| C23 | C24 | C25 | C26 | 161.5° | 161.5° |
| C23 | C24 | C25 | S1 | 81.8° | 81.8° |
| C24 | C23 | C22 | H19 | 66.9° | 66.9° |
| C24 | C23 | C22 | H20 | 53.5° | 53.5° |
| C23 | C24 | H21 | H22 | 117.6° | 117.6° |
| C24 | C23 | H31 | H32 | 118.9° | 118.9° |
| C23 | C24 | C25 | H33 | 37.7° | 37.7° |
| C24 | C25 | C26 | C28 | 163.8° | 163.8° |
| C24 | C25 | C26 | S1 | 125.5° | 125.5° |
| C24 | C25 | C26 | H33 | 123.9° | 123.9° |
| C24 | C25 | S1 | H33 | 121.4° | 121.4° |
| C24 | C25 | S1 | C27 | 171.3° | 171.3° |
| C25 | C24 | H21 | H22 | 117.6° | 117.6° |
| C24 | C25 | C26 | H23 | 78.9° | 78.8° |
| C25 | C24 | C23 | H31 | 54.7° | 54.7° |
| C25 | C24 | C23 | H32 | 64.6° | 64.6° |
| C28 | C26 | C25 | H23 | 117.3° | 117.4° |
| C26 | C28 | C27 | N4 | 100.1° | 100.1° |
| C26 | C28 | C27 | H24 | 123.4° | 123.4° |
| C26 | C28 | N4 | H24 | 120.7° | 120.7° |
| C28 | C26 | C25 | S1 | 38.3° | 38.3° |
| C26 | C28 | C27 | S1 | 22.3° | 22.3° |
| C26 | C28 | N4 | C29 | 0.5° | 0.5° |
| C28 | C26 | N3 | H1 | 176.9° | 176.9° |
| C28 | C26 | C25 | H33 | 72.3° | 72.3° |
| C26 | C28 | C27 | H34 | 97.7° | 97.7° |
| C26 | C28 | C27 | H35 | 142.4° | 142.4° |
| C26 | C28 | N4 | H36 | 179.5° | 179.5° |
| C25 | C26 | C28 | C27 | 12.9° | 12.9° |
| C25 | C26 | C28 | N4 | 125.8° | 125.8° |
| C26 | C25 | S1 | H33 | 113.3° | 113.3° |
| C26 | C25 | S1 | C27 | 46.0° | 46.0° |
| C25 | C26 | N3 | H1 | 53.5° | 53.5° |
| C26 | C25 | C24 | H21 | 40.7° | 40.7° |
| C26 | C25 | C24 | H22 | 77.8° | 77.8° |
| C25 | C26 | C28 | H24 | 110.9° | 110.9° |
| C27 | C28 | N4 | H24 | 135.2° | 135.2° |
| C28 | C27 | S1 | C25 | 41.4° | 41.4° |
| C28 | C27 | S1 | H34 | 120.1° | 120.1° |
| C28 | C27 | S1 | H35 | 120.1° | 120.1° |
| C27 | C28 | N4 | C29 | 104.6° | 104.6° |
| C27 | C28 | C26 | H23 | 131.0° | 131.1° |
| C28 | C27 | H34 | H35 | 119.7° | 119.7° |
| C27 | C28 | N4 | H36 | 75.3° | 75.3° |
| N4 | C28 | C27 | S1 | 77.7° | 77.7° |
| C28 | N4 | C29 | H36 | 180.0° | 180.0° |
| C28 | N4 | C29 | O2 | 177.8° | 177.8° |
| N4 | C28 | C26 | H23 | 116.1° | 116.0° |
| N4 | C28 | C27 | H34 | 162.2° | 162.2° |
| N4 | C28 | C27 | H35 | 42.4° | 42.4° |
| C2 | C1 | C3 | C9 | 171.6° | 171.6° |
| C2 | C1 | C3 | IR1 | 123.0° | 123.0° |
| C2 | C1 | C9 | IR1 | 123.0° | 123.0° |
| C2 | C1 | IR1 | N5 | 108.2° | 108.2° |
| C2 | C1 | IR1 | CL46 | 81.8° | 81.8° |
| C1 | C2 | H25 | H26 | 120.0° | 120.0° |
| C1 | C2 | H25 | H27 | 120.0° | 120.0° |
| C1 | C2 | H26 | H27 | 120.0° | 120.0° |
| C3 | C1 | C9 | IR1 | 65.5° | 65.5° |
| C3 | C1 | IR1 | N5 | 129.3° | 129.3° |
| C3 | C1 | IR1 | CL46 | 40.7° | 40.7° |
| C1 | C3 | C4 | H2 | 1.5° | 1.5° |
| C1 | C3 | C4 | H3 | 118.5° | 118.5° |
| C1 | C3 | C4 | H4 | 121.5° | 121.5° |
| C3 | C1 | C2 | H25 | 180.0° | 180.0° |
| C3 | C1 | C2 | H26 | 60.0° | 60.0° |
| C3 | C1 | C2 | H27 | 60.0° | 60.0° |
| C9 | C1 | IR1 | N5 | 15.3° | 15.3° |
| C9 | C1 | IR1 | CL46 | 154.7° | 154.7° |
| C1 | C9 | C10 | H11 | 3.2° | 3.2° |
| C1 | C9 | C10 | H12 | 123.2° | 123.2° |
| C1 | C9 | C10 | H13 | 116.8° | 116.8° |
| C9 | C1 | C2 | H25 | 10.0° | 10.0° |
| C9 | C1 | C2 | H26 | 130.1° | 130.1° |
| C9 | C1 | C2 | H27 | 110.0° | 110.0° |
| C1 | IR1 | N5 | C11 | 89.8° | 89.8° |
| C1 | IR1 | N5 | CL46 | 171.5° | 171.5° |
| C1 | IR1 | N5 | C30 | 149.1° | 149.1° |
| IR1 | C1 | C2 | H25 | 85.2° | 85.2° |
| IR1 | C1 | C2 | H26 | 34.9° | 34.9° |
| IR1 | C1 | C2 | H27 | 154.8° | 154.8° |
| C3 | IR1 | C9 | N5 | 152.7° | 152.7° |
| C3 | IR1 | C9 | CL46 | 12.6° | 12.6° |
| C3 | IR1 | N5 | C11 | 146.3° | 146.3° |
| C3 | IR1 | N5 | CL46 | 115.0° | 115.0° |
| C3 | IR1 | N5 | C30 | 92.6° | 92.6° |
| IR1 | C3 | C4 | H2 | 92.9° | 92.9° |
| IR1 | C3 | C4 | H3 | 27.0° | 27.0° |
| IR1 | C3 | C4 | H4 | 147.0° | 147.0° |
| C9 | IR1 | N5 | C11 | 98.9° | 98.9° |
| C9 | IR1 | N5 | CL46 | 162.3° | 162.3° |
| C9 | IR1 | N5 | C30 | 140.0° | 140.0° |
| IR1 | C9 | C10 | H11 | 92.3° | 92.3° |
| IR1 | C9 | C10 | H12 | 147.6° | 147.6° |
| IR1 | C9 | C10 | H13 | 27.7° | 27.7° |
| C12 | C11 | N5 | IR1 | 4.2° | 4.2° |
| C11 | C12 | C14 | C16 | 0.2° | 0.2° |
| C12 | C11 | N5 | C30 | 119.6° | 119.6° |
| C12 | C11 | C13 | H14 | 178.1° | 178.1° |
| N5 | C11 | C12 | C14 | 177.1° | 177.1° |
| C11 | N5 | IR1 | C30 | 121.1° | 121.1° |
| C11 | N5 | C30 | O3 | 147.3° | 147.3° |
| C11 | N5 | C30 | O4 | 5.8° | 5.8° |
| C11 | N5 | IR1 | CL46 | 98.7° | 98.7° |
| N5 | C11 | C13 | H14 | 0.6° | 0.6° |
| C12 | C14 | C16 | N2 | 175.1° | 175.1° |
| C12 | C14 | C17 | H16 | 179.8° | 179.8° |
| IR1 | N5 | C30 | O3 | 32.7° | 32.7° |
| IR1 | N5 | C30 | O4 | 120.4° | 120.4° |
| C14 | C16 | C15 | H15 | 175.4° | 175.4° |
| C16 | C14 | C17 | H16 | 0.4° | 0.4° |
| C14 | C16 | N2 | H30 | 38.7° | 38.7° |
| N2 | C16 | C15 | H15 | 2.1° | 2.1° |
| C18 | C19 | C17 | H16 | 179.5° | 179.5° |
| S1 | C25 | C24 | H21 | 157.4° | 157.4° |
| S1 | C25 | C24 | H22 | 38.9° | 38.9° |
| S1 | C25 | C26 | H23 | 155.6° | 155.6° |
| C25 | S1 | C27 | H34 | 78.7° | 78.7° |
| C25 | S1 | C27 | H35 | 161.5° | 161.5° |
| S1 | C27 | C28 | H24 | 145.7° | 145.7° |
| C27 | S1 | C25 | H33 | 67.3° | 67.3° |
| S1 | C27 | H34 | H35 | 119.7° | 119.7° |
| N4 | C29 | N3 | H1 | 176.5° | 176.5° |
| C29 | N4 | C28 | H24 | 120.2° | 120.2° |
| O2 | C29 | N3 | H1 | 0.9° | 0.9° |
| O2 | C29 | N4 | H36 | 2.2° | 2.2° |
| N5 | C30 | O3 | O4 | 154.1° | 154.1° |
| N5 | C30 | O4 | C31 | 100.1° | 100.1° |
| C30 | N5 | IR1 | CL46 | 22.4° | 22.4° |
| O3 | C30 | O4 | C31 | 54.2° | 54.2° |
| C30 | O4 | C31 | C32 | 63.1° | 63.1° |
| C30 | O4 | C31 | C33 | 62.7° | 62.7° |
| C30 | O4 | C31 | C34 | 177.0° | 177.0° |
| O4 | C31 | C32 | C33 | 128.6° | 128.6° |
| O4 | C31 | C32 | C34 | 116.8° | 116.8° |
| O4 | C31 | C33 | C34 | 114.0° | 114.0° |
| O4 | C31 | C32 | H37 | 180.0° | 180.0° |
| O4 | C31 | C32 | H38 | 60.0° | 60.0° |
| O4 | C31 | C32 | H39 | 60.0° | 60.0° |
| O4 | C31 | C33 | H40 | 180.0° | 180.0° |
| O4 | C31 | C33 | H41 | 60.0° | 60.0° |
| O4 | C31 | C33 | H42 | 60.0° | 60.0° |
| O4 | C31 | C34 | H43 | 180.0° | 180.0° |
| O4 | C31 | C34 | H44 | 60.0° | 60.0° |
| O4 | C31 | C34 | H45 | 60.0° | 60.0° |
| C32 | C31 | C33 | C34 | 117.8° | 117.8° |
| C31 | C32 | H37 | H38 | 120.0° | 120.0° |
| C31 | C32 | H37 | H39 | 120.0° | 120.0° |
| C31 | C32 | H38 | H39 | 120.0° | 120.0° |
| C32 | C31 | C33 | H40 | 51.8° | 51.8° |
| C32 | C31 | C33 | H41 | 68.2° | 68.2° |
| C32 | C31 | C33 | H42 | 171.8° | 171.7° |
| C32 | C31 | C34 | H43 | 57.7° | 57.7° |
| C32 | C31 | C34 | H44 | 177.6° | 177.6° |
| C32 | C31 | C34 | H45 | 62.3° | 62.3° |
| C33 | C31 | C32 | H37 | 51.4° | 51.3° |
| C33 | C31 | C32 | H38 | 171.4° | 171.4° |
| C33 | C31 | C32 | H39 | 68.7° | 68.7° |
| C31 | C33 | H40 | H41 | 120.0° | 120.0° |
| C31 | C33 | H40 | H42 | 120.0° | 120.0° |
| C31 | C33 | H41 | H42 | 120.0° | 120.0° |
| C33 | C31 | C34 | H43 | 59.3° | 59.3° |
| C33 | C31 | C34 | H44 | 60.7° | 60.7° |
| C33 | C31 | C34 | H45 | 179.3° | 179.3° |
| C34 | C31 | C32 | H37 | 63.2° | 63.2° |
| C34 | C31 | C32 | H38 | 56.8° | 56.8° |
| C34 | C31 | C32 | H39 | 176.8° | 176.8° |
| C34 | C31 | C33 | H40 | 66.0° | 66.0° |
| C34 | C31 | C33 | H41 | 174.0° | 174.0° |
| C34 | C31 | C33 | H42 | 54.0° | 54.0° |
| C31 | C34 | H43 | H44 | 120.0° | 120.0° |
| C31 | C34 | H43 | H45 | 120.0° | 120.0° |
| C31 | C34 | H44 | H45 | 120.0° | 120.0° |
| H1 | N3 | C26 | H23 | 67.5° | 67.5° |
| H2 | C4 | H3 | H4 | 120.0° | 119.9° |
| H5 | C6 | H6 | H7 | 120.0° | 120.0° |
| H8 | C8 | H9 | H10 | 120.0° | 120.0° |
| H11 | C10 | H12 | H13 | 120.0° | 120.0° |
| H14 | C13 | C15 | H15 | 4.3° | 4.3° |
| H16 | C17 | C19 | H29 | 0.5° | 0.5° |
| H17 | C21 | C22 | H19 | 59.0° | 59.0° |
| H17 | C21 | C22 | H20 | 61.5° | 61.5° |
| H18 | C21 | C22 | H19 | 180.0° | 180.0° |
| H18 | C21 | C22 | H20 | 59.5° | 59.5° |
| H19 | C22 | C23 | H31 | 172.7° | 172.7° |
| H19 | C22 | C23 | H32 | 53.4° | 53.4° |
| H20 | C22 | C23 | H31 | 66.8° | 66.8° |
| H20 | C22 | C23 | H32 | 173.9° | 173.9° |
| H21 | C24 | C23 | H31 | 175.5° | 175.5° |
| H21 | C24 | C23 | H32 | 56.2° | 56.2° |
| H21 | C24 | C25 | H33 | 83.1° | 83.1° |
| H22 | C24 | C23 | H31 | 66.1° | 66.1° |
| H22 | C24 | C23 | H32 | 174.7° | 174.7° |
| H22 | C24 | C25 | H33 | 158.4° | 158.4° |
| H23 | C26 | C28 | H24 | 7.3° | 7.3° |
| H23 | C26 | C25 | H33 | 45.0° | 45.0° |
| H24 | C28 | C27 | H34 | 25.6° | 25.6° |
| H24 | C28 | C27 | H35 | 94.2° | 94.2° |
| H24 | C28 | N4 | H36 | 59.9° | 59.9° |
| H25 | C2 | H26 | H27 | 120.0° | 120.0° |
| H28 | C18 | C19 | H29 | 2.4° | 2.4° |
| H37 | C32 | H38 | H39 | 120.0° | 120.0° |
| H40 | C33 | H41 | H42 | 120.0° | 120.0° |
| H43 | C34 | H44 | H45 | 120.0° | 120.0° |
