0EI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C35 | N7 | sing | 1.47Å | 1.46Å | |
| C33 | N7 | sing | 1.47Å | 1.47Å | |
| C33 | C32 | sing | 1.53Å | 1.52Å | |
| N7 | C34 | sing | 1.47Å | 1.46Å | |
| C32 | C31 | sing | 1.53Å | 1.53Å | |
| C31 | C | sing | 1.51Å | 1.51Å | |
| C | N | sing | 1.35Å | 1.35Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| N | C1 | sing | 1.40Å | 1.42Å | |
| C1 | C2 | doub | 1.39Å | 1.39Å | Aromatic |
| C1 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
| C14 | C13 | doub | 1.37Å | 1.39Å | Aromatic |
| C3 | C4 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | C4 | sing | 1.39Å | 1.40Å | Aromatic |
| C13 | C12 | sing | 1.51Å | 1.51Å | |
| C4 | N1 | sing | 1.36Å | 1.45Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C11 | C10 | sing | 1.51Å | 1.51Å | |
| N1 | N2 | doub | 1.22Å | 1.29Å | |
| C10 | C5 | doub | 1.39Å | 1.40Å | Aromatic |
| C10 | C9 | sing | 1.39Å | 1.40Å | Aromatic |
| N2 | C5 | sing | 1.33Å | 1.46Å | |
| C5 | C6 | sing | 1.42Å | 1.40Å | Aromatic |
| S | C27 | sing | 1.81Å | 1.80Å | |
| S | C26 | sing | 1.76Å | 1.75Å | |
| C28 | N5 | sing | 1.47Å | 1.47Å | |
| C9 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C7 | doub | 1.37Å | 1.38Å | Aromatic |
| N5 | C26 | sing | 1.36Å | 1.38Å | Aromatic |
| N5 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | N4 | doub | 1.31Å | 1.31Å | Aromatic |
| C8 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C8 | N3 | sing | 1.39Å | 1.41Å | |
| C16 | C17 | doub | 1.40Å | 1.39Å | Aromatic |
| C16 | C15 | sing | 1.39Å | 1.41Å | Aromatic |
| C18 | C17 | sing | 1.47Å | 1.48Å | |
| C18 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| N3 | C15 | sing | 1.39Å | 1.38Å | |
| N4 | C19 | sing | 1.35Å | 1.38Å | Aromatic |
| C17 | C29 | sing | 1.40Å | 1.38Å | Aromatic |
| C15 | N6 | doub | 1.33Å | 1.34Å | Aromatic |
| C29 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| N6 | C30 | sing | 1.32Å | 1.34Å | Aromatic |
| C19 | C20 | sing | 1.48Å | 1.48Å | |
| C25 | C20 | doub | 1.40Å | 1.39Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.39Å | 1.39Å | Aromatic |
| C24 | C23 | doub | 1.39Å | 1.37Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | C22 | sing | 1.39Å | 1.37Å | Aromatic |
| C23 | F | sing | 1.35Å | 1.36Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| N3 | H2 | sing | 0.97Å | 1.00Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C22 | H4 | sing | 1.08Å | 1.08Å | |
| C21 | H5 | sing | 1.08Å | 1.08Å | |
| C24 | H6 | sing | 1.08Å | 1.08Å | |
| C25 | H7 | sing | 1.08Å | 1.08Å | |
| C27 | H8 | sing | 1.09Å | 1.10Å | |
| C27 | H9 | sing | 1.09Å | 1.10Å | |
| C27 | H10 | sing | 1.09Å | 1.10Å | |
| C28 | H11 | sing | 1.09Å | 1.10Å | |
| C28 | H12 | sing | 1.09Å | 1.10Å | |
| C28 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.08Å | 1.08Å | |
| C29 | H15 | sing | 1.08Å | 1.08Å | |
| C30 | H16 | sing | 1.08Å | 1.08Å | |
| C7 | H17 | sing | 1.08Å | 1.08Å | |
| C9 | H18 | sing | 1.08Å | 1.08Å | |
| C11 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.08Å | 1.08Å | |
| C14 | H24 | sing | 1.08Å | 1.08Å | |
| N | H25 | sing | 0.97Å | 1.00Å | |
| C31 | H26 | sing | 1.09Å | 1.10Å | |
| C31 | H27 | sing | 1.09Å | 1.10Å | |
| C32 | H28 | sing | 1.09Å | 1.10Å | |
| C32 | H29 | sing | 1.09Å | 1.10Å | |
| C33 | H30 | sing | 1.09Å | 1.10Å | |
| C33 | H31 | sing | 1.09Å | 1.10Å | |
| C35 | H33 | sing | 1.09Å | 1.10Å | |
| C35 | H34 | sing | 1.09Å | 1.10Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C34 | H36 | sing | 1.09Å | 1.10Å | |
| C34 | H37 | sing | 1.09Å | 1.10Å | |
| C34 | H38 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C35 | N7 | C33 | 110.8° | 111.0° |
| C35 | N7 | C34 | 109.9° | 111.0° |
| N7 | C35 | H33 | 109.5° | 109.5° |
| N7 | C35 | H34 | 109.5° | 109.5° |
| N7 | C35 | H35 | 109.5° | 109.5° |
| N7 | C33 | C32 | 113.9° | 109.5° |
| C33 | N7 | C34 | 111.0° | 111.0° |
| N7 | C33 | H30 | 108.3° | 109.5° |
| N7 | C33 | H31 | 108.4° | 109.5° |
| C33 | C32 | C31 | 111.7° | 109.4° |
| C33 | C32 | H28 | 108.9° | 109.5° |
| C33 | C32 | H29 | 108.9° | 109.4° |
| C32 | C33 | H30 | 108.4° | 109.5° |
| C32 | C33 | H31 | 108.4° | 109.4° |
| N7 | C34 | H36 | 109.5° | 109.5° |
| N7 | C34 | H37 | 109.4° | 109.5° |
| N7 | C34 | H38 | 109.5° | 109.4° |
| C32 | C31 | C | 113.6° | 109.4° |
| C32 | C31 | H26 | 108.4° | 109.5° |
| C32 | C31 | H27 | 108.4° | 109.5° |
| C31 | C32 | H28 | 108.9° | 109.5° |
| C31 | C32 | H29 | 108.9° | 109.5° |
| C31 | C | N | 114.4° | 120.0° |
| C31 | C | O | 121.7° | 120.0° |
| C | C31 | H26 | 108.4° | 109.5° |
| C | C31 | H27 | 108.4° | 109.5° |
| N | C | O | 123.8° | 120.0° |
| C | N | C1 | 127.9° | 120.0° |
| C | N | H25 | 116.0° | 119.9° |
| N | C1 | C2 | 119.1° | 119.8° |
| N | C1 | C14 | 121.3° | 119.8° |
| C1 | N | H25 | 116.0° | 120.1° |
| C2 | C1 | C14 | 119.5° | 120.4° |
| C1 | C2 | C3 | 120.3° | 120.2° |
| C1 | C2 | H1 | 119.8° | 119.9° |
| C1 | C14 | C13 | 120.9° | 119.5° |
| C1 | C14 | H24 | 119.5° | 120.2° |
| C2 | C3 | C4 | 120.4° | 119.4° |
| C3 | C2 | H1 | 119.9° | 119.9° |
| C2 | C3 | H23 | 119.8° | 120.3° |
| C14 | C13 | C4 | 118.9° | 120.2° |
| C14 | C13 | C12 | 118.8° | 121.0° |
| C13 | C14 | H24 | 119.6° | 120.3° |
| C3 | C4 | C13 | 119.9° | 120.3° |
| C3 | C4 | N1 | 116.8° | 122.5° |
| C4 | C3 | H23 | 119.8° | 120.3° |
| C4 | C13 | C12 | 122.2° | 118.8° |
| C13 | C4 | N1 | 123.1° | 117.2° |
| C13 | C12 | C11 | 110.4° | 107.7° |
| C13 | C12 | H21 | 109.2° | 109.8° |
| C13 | C12 | H22 | 109.2° | 109.8° |
| C4 | N1 | N2 | 136.4° | 128.6° |
| C12 | C11 | C10 | 114.0° | 111.4° |
| C12 | C11 | H19 | 108.3° | 109.1° |
| C12 | C11 | H20 | 108.3° | 109.0° |
| C11 | C12 | H21 | 109.2° | 109.9° |
| C11 | C12 | H22 | 109.2° | 109.8° |
| C11 | C10 | C5 | 123.2° | 125.1° |
| C11 | C10 | C9 | 117.7° | 114.8° |
| C10 | C11 | H19 | 108.3° | 109.2° |
| C10 | C11 | H20 | 108.3° | 109.1° |
| N1 | N2 | C5 | 139.9° | 148.6° |
| C5 | C10 | C9 | 118.6° | 120.0° |
| C10 | C5 | N2 | 127.6° | 128.1° |
| C10 | C5 | C6 | 119.7° | 117.8° |
| C10 | C9 | C8 | 120.9° | 121.5° |
| C10 | C9 | H18 | 119.6° | 119.3° |
| N2 | C5 | C6 | 110.4° | 114.1° |
| C5 | C6 | C7 | 120.3° | 121.7° |
| C5 | C6 | H3 | 119.8° | 119.1° |
| C27 | S | C26 | 100.3° | 100.0° |
| S | C27 | H8 | 109.5° | 109.4° |
| S | C27 | H9 | 109.5° | 109.5° |
| S | C27 | H10 | 109.4° | 109.5° |
| S | C26 | N5 | 121.5° | 125.4° |
| S | C26 | N4 | 126.1° | 125.4° |
| C28 | N5 | C26 | 124.0° | 126.5° |
| C28 | N5 | C18 | 126.2° | 126.4° |
| N5 | C28 | H11 | 109.5° | 109.4° |
| N5 | C28 | H12 | 109.5° | 109.5° |
| N5 | C28 | H13 | 109.5° | 109.5° |
| C9 | C8 | C7 | 119.5° | 119.2° |
| C9 | C8 | N3 | 121.9° | 120.4° |
| C8 | C9 | H18 | 119.5° | 119.3° |
| C6 | C7 | C8 | 120.2° | 119.8° |
| C7 | C6 | H3 | 119.9° | 119.2° |
| C6 | C7 | H17 | 119.9° | 120.1° |
| C26 | N5 | C18 | 106.4° | 107.1° |
| N5 | C26 | N4 | 112.3° | 109.2° |
| N5 | C18 | C17 | 123.4° | 126.9° |
| N5 | C18 | C19 | 105.3° | 106.3° |
| C26 | N4 | C19 | 105.7° | 109.6° |
| C7 | C8 | N3 | 118.4° | 120.4° |
| C8 | C7 | H17 | 119.9° | 120.1° |
| C8 | N3 | C15 | 131.2° | 119.9° |
| C8 | N3 | H2 | 114.4° | 120.0° |
| C17 | C16 | C15 | 117.8° | 118.9° |
| C16 | C17 | C18 | 120.6° | 120.9° |
| C16 | C17 | C29 | 119.0° | 118.2° |
| C17 | C16 | H14 | 121.1° | 120.6° |
| C16 | C15 | N3 | 123.8° | 119.6° |
| C16 | C15 | N6 | 123.1° | 120.7° |
| C15 | C16 | H14 | 121.1° | 120.5° |
| C17 | C18 | C19 | 131.1° | 126.9° |
| C18 | C17 | C29 | 120.3° | 120.9° |
| C18 | C19 | N4 | 110.3° | 107.7° |
| C18 | C19 | C20 | 130.3° | 126.1° |
| N3 | C15 | N6 | 113.0° | 119.7° |
| C15 | N3 | H2 | 114.4° | 120.0° |
| N4 | C19 | C20 | 119.4° | 126.1° |
| C17 | C29 | C30 | 118.8° | 119.2° |
| C17 | C29 | H15 | 120.6° | 120.4° |
| C15 | N6 | C30 | 117.3° | 122.0° |
| C29 | C30 | N6 | 124.0° | 121.0° |
| C30 | C29 | H15 | 120.6° | 120.5° |
| C29 | C30 | H16 | 118.0° | 119.5° |
| N6 | C30 | H16 | 118.0° | 119.5° |
| C19 | C20 | C25 | 120.5° | 120.1° |
| C19 | C20 | C21 | 120.8° | 120.1° |
| C20 | C25 | C24 | 120.9° | 119.9° |
| C25 | C20 | C21 | 118.7° | 119.8° |
| C20 | C25 | H7 | 119.5° | 120.0° |
| C25 | C24 | C23 | 118.3° | 120.1° |
| C25 | C24 | H6 | 120.8° | 120.0° |
| C24 | C25 | H7 | 119.6° | 120.1° |
| C20 | C21 | C22 | 120.8° | 119.9° |
| C20 | C21 | H5 | 119.6° | 120.1° |
| C24 | C23 | C22 | 122.9° | 120.2° |
| C24 | C23 | F | 118.5° | 119.9° |
| C23 | C24 | H6 | 120.9° | 119.9° |
| C21 | C22 | C23 | 118.4° | 120.1° |
| C21 | C22 | H4 | 120.8° | 120.0° |
| C22 | C21 | H5 | 119.6° | 120.0° |
| C22 | C23 | F | 118.6° | 119.9° |
| C23 | C22 | H4 | 120.8° | 119.9° |
| H8 | C27 | H9 | 109.5° | 109.4° |
| H8 | C27 | H10 | 109.5° | 109.5° |
| H9 | C27 | H10 | 109.5° | 109.5° |
| H11 | C28 | H12 | 109.4° | 109.5° |
| H11 | C28 | H13 | 109.5° | 109.5° |
| H12 | C28 | H13 | 109.5° | 109.5° |
| H19 | C11 | H20 | 109.5° | 109.0° |
| H21 | C12 | H22 | 109.5° | 109.8° |
| H26 | C31 | H27 | 109.5° | 109.5° |
| H28 | C32 | H29 | 109.4° | 109.6° |
| H30 | C33 | H31 | 109.5° | 109.5° |
| H33 | C35 | H34 | 109.5° | 109.4° |
| H33 | C35 | H35 | 109.4° | 109.5° |
| H34 | C35 | H35 | 109.4° | 109.4° |
| H36 | C34 | H37 | 109.5° | 109.4° |
| H36 | C34 | H38 | 109.5° | 109.5° |
| H37 | C34 | H38 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C35 | N7 | C33 | C34 | 122.4° | 124.0° |
| C35 | N7 | C33 | C32 | 152.0° | 170.0° |
| C35 | N7 | C33 | H30 | 31.4° | 50.0° |
| C35 | N7 | C33 | H31 | 87.3° | 70.0° |
| N7 | C35 | H33 | H34 | 120.0° | 120.0° |
| N7 | C35 | H33 | H35 | 120.0° | 120.0° |
| N7 | C35 | H34 | H35 | 120.0° | 120.0° |
| C35 | N7 | C34 | H36 | 180.0° | 176.0° |
| C35 | N7 | C34 | H37 | 60.0° | 56.1° |
| C35 | N7 | C34 | H38 | 60.0° | 64.0° |
| N7 | C33 | C32 | H30 | 120.6° | 120.0° |
| N7 | C33 | C32 | H31 | 120.7° | 120.0° |
| N7 | C33 | C32 | C31 | 59.4° | 180.0° |
| N7 | C33 | C32 | H28 | 61.0° | 60.0° |
| N7 | C33 | C32 | H29 | 179.7° | 60.1° |
| N7 | C33 | H30 | H31 | 118.0° | 120.0° |
| C33 | N7 | C35 | H33 | 180.0° | 60.0° |
| C33 | N7 | C35 | H34 | 60.0° | 180.0° |
| C33 | N7 | C35 | H35 | 60.0° | 60.0° |
| C33 | N7 | C34 | H36 | 57.1° | 60.0° |
| C33 | N7 | C34 | H37 | 62.9° | 179.9° |
| C33 | N7 | C34 | H38 | 177.1° | 60.0° |
| C32 | C33 | N7 | C34 | 85.6° | 66.0° |
| C33 | C32 | C31 | H28 | 120.4° | 120.0° |
| C33 | C32 | C31 | H29 | 120.3° | 119.9° |
| C33 | C32 | C31 | C | 152.9° | 180.0° |
| C33 | C32 | C31 | H26 | 86.5° | 60.0° |
| C33 | C32 | C31 | H27 | 32.3° | 60.1° |
| C33 | C32 | H28 | H29 | 119.0° | 120.0° |
| C32 | C33 | H30 | H31 | 118.0° | 120.0° |
| C34 | N7 | C33 | H30 | 153.8° | 174.0° |
| C34 | N7 | C33 | H31 | 35.0° | 54.0° |
| C34 | N7 | C35 | H33 | 57.0° | 63.9° |
| C34 | N7 | C35 | H34 | 63.0° | 56.0° |
| C34 | N7 | C35 | H35 | 177.0° | 176.0° |
| N7 | C34 | H36 | H37 | 120.0° | 120.0° |
| N7 | C34 | H36 | H38 | 120.0° | 120.0° |
| N7 | C34 | H37 | H38 | 120.0° | 120.0° |
| C32 | C31 | C | H26 | 120.6° | 120.0° |
| C32 | C31 | C | H27 | 120.6° | 120.0° |
| C32 | C31 | C | N | 140.4° | 180.0° |
| C32 | C31 | C | O | 39.5° | 0.0° |
| C32 | C31 | H26 | H27 | 118.2° | 120.0° |
| C31 | C32 | H28 | H29 | 119.0° | 120.1° |
| C31 | C32 | C33 | H30 | 180.0° | 60.0° |
| C31 | C32 | C33 | H31 | 61.3° | 60.0° |
| C31 | C | N | O | 180.0° | 180.0° |
| C31 | C | N | C1 | 176.2° | 175.8° |
| C31 | C | N | H25 | 3.7° | 4.3° |
| C | C31 | H26 | H27 | 118.1° | 120.0° |
| C | C31 | C32 | H28 | 32.5° | 60.1° |
| C | C31 | C32 | H29 | 86.8° | 60.1° |
| C | N | C1 | H25 | 180.0° | 180.0° |
| C | N | C1 | C2 | 178.9° | 144.7° |
| C | N | C1 | C14 | 1.6° | 35.3° |
| N | C | C31 | H26 | 19.8° | 60.0° |
| N | C | C31 | H27 | 98.9° | 60.0° |
| O | C | N | C1 | 3.8° | 4.2° |
| O | C | N | H25 | 176.3° | 175.8° |
| O | C | C31 | H26 | 160.2° | 120.0° |
| O | C | C31 | H27 | 81.1° | 120.0° |
| N | C1 | C2 | C14 | 177.3° | 180.0° |
| N | C1 | C2 | C3 | 174.9° | 179.9° |
| N | C1 | C14 | C13 | 175.7° | 179.9° |
| N | C1 | C2 | H1 | 5.0° | 0.2° |
| N | C1 | C14 | H24 | 4.2° | 0.0° |
| C1 | C2 | C3 | H1 | 180.0° | 179.9° |
| C2 | C1 | C14 | C13 | 1.5° | 0.1° |
| C1 | C2 | C3 | C4 | 1.4° | 0.0° |
| C1 | C2 | C3 | H23 | 178.6° | 179.9° |
| C2 | C1 | C14 | H24 | 178.6° | 180.0° |
| C2 | C1 | N | H25 | 1.2° | 35.3° |
| C14 | C1 | C2 | C3 | 2.3° | 0.1° |
| C1 | C14 | C13 | H24 | 180.0° | 179.9° |
| C1 | C14 | C13 | C4 | 0.3° | 0.5° |
| C1 | C14 | C13 | C12 | 179.5° | 179.1° |
| C14 | C1 | C2 | H1 | 177.7° | 179.8° |
| C14 | C1 | N | H25 | 178.4° | 144.7° |
| C2 | C3 | C4 | H23 | 180.0° | 180.0° |
| C2 | C3 | C4 | C13 | 0.4° | 0.4° |
| C2 | C3 | C4 | N1 | 175.1° | 179.6° |
| C14 | C13 | C4 | C3 | 1.3° | 0.6° |
| C14 | C13 | C4 | C12 | 179.8° | 179.6° |
| C14 | C13 | C4 | N1 | 175.6° | 179.4° |
| C14 | C13 | C12 | C11 | 102.4° | 81.3° |
| C14 | C13 | C12 | H21 | 137.5° | 38.3° |
| C14 | C13 | C12 | H22 | 17.8° | 159.2° |
| C3 | C4 | C13 | N1 | 174.3° | 180.0° |
| C3 | C4 | C13 | C12 | 178.6° | 179.0° |
| C3 | C4 | N1 | N2 | 138.8° | 132.3° |
| C4 | C3 | C2 | H1 | 178.6° | 179.9° |
| C4 | C13 | C12 | C11 | 77.8° | 98.3° |
| C13 | C4 | N1 | N2 | 46.7° | 47.7° |
| C4 | C13 | C12 | H21 | 42.4° | 142.1° |
| C4 | C13 | C12 | H22 | 162.1° | 21.2° |
| C13 | C4 | C3 | H23 | 179.6° | 179.7° |
| C4 | C13 | C14 | H24 | 179.7° | 179.6° |
| C12 | C13 | C4 | N1 | 4.2° | 1.0° |
| C13 | C12 | C11 | H21 | 120.1° | 119.6° |
| C13 | C12 | C11 | H22 | 120.1° | 119.6° |
| C13 | C12 | C11 | C10 | 108.0° | 96.8° |
| C13 | C12 | C11 | H19 | 131.3° | 23.8° |
| C13 | C12 | C11 | H20 | 12.7° | 142.7° |
| C13 | C12 | H21 | H22 | 119.6° | 120.9° |
| C12 | C13 | C14 | H24 | 0.5° | 0.8° |
| C4 | N1 | N2 | C5 | 6.0° | 10.5° |
| N1 | C4 | C3 | H23 | 4.9° | 0.3° |
| C12 | C11 | C10 | H19 | 120.7° | 120.5° |
| C12 | C11 | C10 | H20 | 120.7° | 120.4° |
| C12 | C11 | C10 | C5 | 63.8° | 21.7° |
| C12 | C11 | C10 | C9 | 124.0° | 159.3° |
| C12 | C11 | H19 | H20 | 117.9° | 119.0° |
| C11 | C12 | H21 | H22 | 119.6° | 120.9° |
| C11 | C10 | C5 | C9 | 172.1° | 179.0° |
| C11 | C10 | C5 | N2 | 35.7° | 3.1° |
| C11 | C10 | C5 | C6 | 163.0° | 178.0° |
| C11 | C10 | C9 | C8 | 168.1° | 178.4° |
| C11 | C10 | C9 | H18 | 11.9° | 1.6° |
| C10 | C11 | H19 | H20 | 117.9° | 119.1° |
| C10 | C11 | C12 | H21 | 12.1° | 143.6° |
| C10 | C11 | C12 | H22 | 131.8° | 22.8° |
| N1 | N2 | C5 | C10 | 33.0° | 43.8° |
| N1 | N2 | C5 | C6 | 164.3° | 137.3° |
| C10 | C5 | N2 | C6 | 162.7° | 178.9° |
| C5 | C10 | C9 | C8 | 4.5° | 0.7° |
| C10 | C5 | C6 | C7 | 6.7° | 0.6° |
| C10 | C5 | C6 | H3 | 173.3° | 179.4° |
| C5 | C10 | C9 | H18 | 175.5° | 179.3° |
| C5 | C10 | C11 | H19 | 175.5° | 98.8° |
| C5 | C10 | C11 | H20 | 56.9° | 142.1° |
| C9 | C10 | C5 | N2 | 152.1° | 177.9° |
| C9 | C10 | C5 | C6 | 9.2° | 1.0° |
| C10 | C9 | C8 | H18 | 180.0° | 179.9° |
| C10 | C9 | C8 | C7 | 2.7° | 0.1° |
| C10 | C9 | C8 | N3 | 178.5° | 179.9° |
| C9 | C10 | C11 | H19 | 3.3° | 80.2° |
| C9 | C10 | C11 | H20 | 115.4° | 38.8° |
| N2 | C5 | C6 | C7 | 157.5° | 178.4° |
| N2 | C5 | C6 | H3 | 22.5° | 1.5° |
| C5 | C6 | C7 | H3 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 0.6° | 0.0° |
| C5 | C6 | C7 | H17 | 179.4° | 179.9° |
| C27 | S | C26 | N5 | 84.6° | 180.0° |
| C27 | S | C26 | N4 | 97.3° | 0.1° |
| S | C27 | H8 | H9 | 120.0° | 120.0° |
| S | C27 | H8 | H10 | 120.0° | 120.0° |
| S | C27 | H9 | H10 | 120.0° | 120.1° |
| S | C26 | N5 | C28 | 21.8° | 0.1° |
| S | C26 | N5 | N4 | 178.3° | 179.9° |
| S | C26 | N5 | C18 | 178.1° | 180.0° |
| S | C26 | N4 | C19 | 178.0° | 180.0° |
| C26 | S | C27 | H8 | 180.0° | 179.9° |
| C26 | S | C27 | H9 | 60.0° | 60.0° |
| C26 | S | C27 | H10 | 60.0° | 60.0° |
| C28 | N5 | C26 | C18 | 160.2° | 180.0° |
| C28 | N5 | C26 | N4 | 159.9° | 180.0° |
| C28 | N5 | C18 | C17 | 23.5° | 0.0° |
| C28 | N5 | C18 | C19 | 159.4° | 180.0° |
| N5 | C28 | H11 | H12 | 120.0° | 120.0° |
| N5 | C28 | H11 | H13 | 120.0° | 120.0° |
| N5 | C28 | H12 | H13 | 120.0° | 120.0° |
| C9 | C8 | C7 | C6 | 5.3° | 0.3° |
| C9 | C8 | C7 | N3 | 176.0° | 180.0° |
| C9 | C8 | N3 | C15 | 11.8° | 144.9° |
| C9 | C8 | N3 | H2 | 168.2° | 35.0° |
| C9 | C8 | C7 | H17 | 174.7° | 179.6° |
| C6 | C7 | C8 | H17 | 180.0° | 179.9° |
| C6 | C7 | C8 | N3 | 178.7° | 179.7° |
| C26 | N5 | C18 | C17 | 176.9° | 180.0° |
| C26 | N5 | C18 | C19 | 0.2° | 0.0° |
| N5 | C26 | N4 | C19 | 0.2° | 0.0° |
| C26 | N5 | C28 | H11 | 180.0° | 90.0° |
| C26 | N5 | C28 | H12 | 60.0° | 150.0° |
| C26 | N5 | C28 | H13 | 60.0° | 30.0° |
| C18 | N5 | C26 | N4 | 0.2° | 0.0° |
| N5 | C18 | C17 | C16 | 37.6° | 135.3° |
| N5 | C18 | C17 | C19 | 176.3° | 180.0° |
| N5 | C18 | C19 | N4 | 0.1° | 0.0° |
| N5 | C18 | C17 | C29 | 145.8° | 45.0° |
| N5 | C18 | C19 | C20 | 178.4° | 180.0° |
| C18 | N5 | C28 | H11 | 23.8° | 90.1° |
| C18 | N5 | C28 | H12 | 143.8° | 29.9° |
| C18 | N5 | C28 | H13 | 96.2° | 150.0° |
| C26 | N4 | C19 | C18 | 0.0° | 0.0° |
| C26 | N4 | C19 | C20 | 178.5° | 179.9° |
| C7 | C8 | N3 | C15 | 172.4° | 35.1° |
| C7 | C8 | N3 | H2 | 7.6° | 144.9° |
| C8 | C7 | C6 | H3 | 179.4° | 180.0° |
| C7 | C8 | C9 | H18 | 177.3° | 180.0° |
| C8 | N3 | C15 | C16 | 14.6° | 175.7° |
| C8 | N3 | C15 | H2 | 180.0° | 180.0° |
| C8 | N3 | C15 | N6 | 164.7° | 4.3° |
| N3 | C8 | C7 | H17 | 1.3° | 0.3° |
| N3 | C8 | C9 | H18 | 1.4° | 0.0° |
| C17 | C16 | C15 | H14 | 180.0° | 180.0° |
| C16 | C17 | C18 | C29 | 176.6° | 179.8° |
| C16 | C17 | C18 | C19 | 146.1° | 44.8° |
| C17 | C16 | C15 | N3 | 179.5° | 180.0° |
| C17 | C16 | C15 | N6 | 1.2° | 0.0° |
| C16 | C17 | C29 | C30 | 1.2° | 0.2° |
| C16 | C17 | C29 | H15 | 178.8° | 179.7° |
| C15 | C16 | C17 | C18 | 174.8° | 180.0° |
| C16 | C15 | N3 | N6 | 179.4° | 180.0° |
| C15 | C16 | C17 | C29 | 1.8° | 0.2° |
| C16 | C15 | N6 | C30 | 0.0° | 0.2° |
| C16 | C15 | N3 | H2 | 165.3° | 4.2° |
| C17 | C18 | C19 | N4 | 176.7° | 180.0° |
| C18 | C17 | C29 | C30 | 175.5° | 180.0° |
| C17 | C18 | C19 | C20 | 1.6° | 0.0° |
| C18 | C17 | C16 | H14 | 5.2° | 0.0° |
| C18 | C17 | C29 | H15 | 4.5° | 0.1° |
| C18 | C19 | N4 | C20 | 178.5° | 180.0° |
| C19 | C18 | C17 | C29 | 30.5° | 135.0° |
| C18 | C19 | C20 | C25 | 128.3° | 145.0° |
| C18 | C19 | C20 | C21 | 49.8° | 35.7° |
| N3 | C15 | N6 | C30 | 179.4° | 179.7° |
| N3 | C15 | C16 | H14 | 0.6° | 0.0° |
| N4 | C19 | C20 | C25 | 49.9° | 35.0° |
| N4 | C19 | C20 | C21 | 132.0° | 144.3° |
| C17 | C29 | C30 | H15 | 180.0° | 179.9° |
| C17 | C29 | C30 | N6 | 0.1° | 0.1° |
| C29 | C17 | C16 | H14 | 178.2° | 179.8° |
| C17 | C29 | C30 | H16 | 179.9° | 180.0° |
| C15 | N6 | C30 | C29 | 0.7° | 0.3° |
| N6 | C15 | N3 | H2 | 15.3° | 175.8° |
| N6 | C15 | C16 | H14 | 178.7° | 180.0° |
| C15 | N6 | C30 | H16 | 179.3° | 179.8° |
| C29 | C30 | N6 | H16 | 180.0° | 180.0° |
| N6 | C30 | C29 | H15 | 179.9° | 180.0° |
| C19 | C20 | C25 | C21 | 178.1° | 179.3° |
| C19 | C20 | C25 | C24 | 176.7° | 180.0° |
| C19 | C20 | C21 | C22 | 176.8° | 179.7° |
| C19 | C20 | C21 | H5 | 3.2° | 0.2° |
| C19 | C20 | C25 | H7 | 3.3° | 0.8° |
| C20 | C25 | C24 | H7 | 180.0° | 179.3° |
| C20 | C25 | C24 | C23 | 0.2° | 0.4° |
| C25 | C20 | C21 | C22 | 1.3° | 0.5° |
| C25 | C20 | C21 | H5 | 178.7° | 179.5° |
| C20 | C25 | C24 | H6 | 179.8° | 179.5° |
| C24 | C25 | C20 | C21 | 1.4° | 0.7° |
| C25 | C24 | C23 | H6 | 180.0° | 179.9° |
| C25 | C24 | C23 | C22 | 1.2° | 0.1° |
| C25 | C24 | C23 | F | 177.4° | 179.8° |
| C20 | C21 | C22 | H5 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 0.0° | 0.1° |
| C20 | C21 | C22 | H4 | 180.0° | 180.0° |
| C21 | C20 | C25 | H7 | 178.5° | 180.0° |
| C24 | C23 | C22 | C21 | 1.3° | 0.4° |
| C24 | C23 | C22 | F | 178.6° | 179.6° |
| C24 | C23 | C22 | H4 | 178.7° | 179.7° |
| C23 | C24 | C25 | H7 | 179.8° | 179.7° |
| C21 | C22 | C23 | H4 | 180.0° | 179.9° |
| C21 | C22 | C23 | F | 177.3° | 180.0° |
| C23 | C22 | C21 | H5 | 180.0° | 179.9° |
| C22 | C23 | C24 | H6 | 178.8° | 180.0° |
| F | C23 | C22 | H4 | 2.7° | 0.1° |
| F | C23 | C24 | H6 | 2.6° | 0.3° |
| H1 | C2 | C3 | H23 | 1.4° | 0.1° |
| H3 | C6 | C7 | H17 | 0.6° | 0.1° |
| H4 | C22 | C21 | H5 | 0.0° | 0.0° |
| H6 | C24 | C25 | H7 | 0.2° | 0.2° |
| H8 | C27 | H9 | H10 | 120.0° | 120.0° |
| H11 | C28 | H12 | H13 | 120.0° | 120.0° |
| H15 | C29 | C30 | H16 | 0.1° | 0.1° |
| H19 | C11 | C12 | H21 | 108.5° | 95.8° |
| H19 | C11 | C12 | H22 | 11.2° | 143.3° |
| H20 | C11 | C12 | H21 | 132.8° | 23.2° |
| H20 | C11 | C12 | H22 | 107.5° | 97.7° |
| H26 | C31 | C32 | H28 | 153.1° | 180.0° |
| H26 | C31 | C32 | H29 | 33.8° | 59.9° |
| H27 | C31 | C32 | H28 | 88.1° | 59.9° |
| H27 | C31 | C32 | H29 | 152.6° | 180.0° |
| H28 | C32 | C33 | H30 | 59.7° | 179.9° |
| H28 | C32 | C33 | H31 | 178.4° | 59.9° |
| H29 | C32 | C33 | H30 | 59.7° | 60.0° |
| H29 | C32 | C33 | H31 | 59.0° | 180.0° |
| H33 | C35 | H34 | H35 | 119.9° | 120.0° |
| H36 | C34 | H37 | H38 | 120.0° | 120.0° |
