GMR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | C27 | doub | 1.22Å | 1.22Å | |
| C25 | C28 | sing | 1.53Å | 1.50Å | |
| C25 | C26 | sing | 1.51Å | 1.51Å | |
| C28 | N10 | sing | 1.46Å | 1.46Å | |
| C27 | N10 | sing | 1.35Å | 1.34Å | |
| C27 | N9 | sing | 1.35Å | 1.42Å | |
| C19 | N9 | sing | 1.47Å | 1.46Å | |
| C19 | C20 | sing | 1.51Å | 1.50Å | |
| C26 | C33 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
| C33 | C31 | sing | 1.38Å | 1.38Å | Aromatic |
| N9 | C23 | sing | 1.35Å | 1.39Å | |
| C32 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C29 | sing | 1.51Å | 1.51Å | |
| C20 | C21 | doub | 1.33Å | 1.34Å | |
| C31 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | O5 | doub | 1.22Å | 1.23Å | |
| C23 | C21 | sing | 1.47Å | 1.46Å | |
| C21 | C24 | sing | 1.51Å | 1.50Å | |
| C30 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | S1 | sing | 1.76Å | 1.76Å | |
| O4 | S1 | doub | 1.42Å | 1.43Å | |
| C24 | C34 | sing | 1.53Å | 1.52Å | |
| S1 | N8 | sing | 1.66Å | 1.65Å | |
| S1 | O3 | doub | 1.42Å | 1.43Å | |
| N8 | C18 | sing | 1.35Å | 1.40Å | |
| C15 | C12 | sing | 1.53Å | 1.53Å | |
| C15 | C13 | sing | 1.53Å | 1.53Å | |
| O2 | C18 | doub | 1.22Å | 1.23Å | |
| C18 | N7 | sing | 1.35Å | 1.38Å | |
| N7 | C12 | sing | 1.47Å | 1.46Å | |
| C12 | C16 | sing | 1.53Å | 1.52Å | |
| C13 | C11 | sing | 1.53Å | 1.52Å | |
| C16 | C14 | sing | 1.53Å | 1.52Å | |
| C11 | C14 | sing | 1.53Å | 1.51Å | |
| C11 | C17 | sing | 1.53Å | 1.53Å | |
| N7 | H1 | sing | 0.97Å | 1.00Å | |
| N8 | H2 | sing | 0.97Å | 1.00Å | |
| N10 | H3 | sing | 0.97Å | 1.00Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H8 | sing | 1.09Å | 1.10Å | |
| C14 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C24 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C28 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C30 | H28 | sing | 1.08Å | 1.08Å | |
| C31 | H29 | sing | 1.08Å | 1.08Å | |
| C32 | H30 | sing | 1.08Å | 1.08Å | |
| C33 | H31 | sing | 1.08Å | 1.08Å | |
| C34 | H32 | sing | 1.09Å | 1.10Å | |
| C34 | H33 | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | C27 | N10 | 124.9° | 120.0° |
| O6 | C27 | N9 | 120.5° | 120.0° |
| C28 | C25 | C26 | 114.6° | 109.5° |
| C25 | C28 | N10 | 112.5° | 109.5° |
| C28 | C25 | H21 | 108.2° | 109.5° |
| C28 | C25 | H22 | 108.2° | 109.4° |
| C25 | C28 | H23 | 108.7° | 109.5° |
| C25 | C28 | H24 | 108.7° | 109.4° |
| C25 | C26 | C33 | 120.0° | 120.0° |
| C25 | C26 | C32 | 121.7° | 120.0° |
| C26 | C25 | H21 | 108.2° | 109.4° |
| C26 | C25 | H22 | 108.2° | 109.5° |
| C28 | N10 | C27 | 117.7° | 120.0° |
| C28 | N10 | H3 | 121.2° | 120.1° |
| N10 | C28 | H23 | 108.7° | 109.5° |
| N10 | C28 | H24 | 108.7° | 109.5° |
| N10 | C27 | N9 | 114.6° | 120.0° |
| C27 | N10 | H3 | 121.1° | 119.9° |
| C27 | N9 | C19 | 118.7° | 126.3° |
| C27 | N9 | C23 | 130.0° | 126.3° |
| N9 | C19 | C20 | 101.6° | 105.8° |
| C19 | N9 | C23 | 111.3° | 107.4° |
| N9 | C19 | H17 | 111.4° | 110.2° |
| N9 | C19 | H18 | 111.4° | 110.2° |
| C19 | C20 | C29 | 118.4° | 126.5° |
| C19 | C20 | C21 | 111.6° | 107.0° |
| C20 | C19 | H17 | 111.4° | 110.2° |
| C20 | C19 | H18 | 111.4° | 110.2° |
| C33 | C26 | C32 | 118.3° | 120.0° |
| C26 | C33 | C31 | 121.3° | 120.0° |
| C26 | C33 | H31 | 119.3° | 120.0° |
| C26 | C32 | C30 | 121.1° | 120.0° |
| C26 | C32 | H30 | 119.5° | 120.0° |
| C33 | C31 | C22 | 119.5° | 120.0° |
| C33 | C31 | H29 | 120.3° | 119.9° |
| C31 | C33 | H31 | 119.3° | 120.0° |
| N9 | C23 | O5 | 123.8° | 125.0° |
| N9 | C23 | C21 | 106.9° | 110.0° |
| C32 | C30 | C22 | 119.4° | 120.0° |
| C32 | C30 | H28 | 120.3° | 120.0° |
| C30 | C32 | H30 | 119.4° | 120.0° |
| C29 | C20 | C21 | 130.0° | 126.6° |
| C20 | C29 | H25 | 109.5° | 109.5° |
| C20 | C29 | H26 | 109.5° | 109.5° |
| C20 | C29 | H27 | 109.5° | 109.4° |
| C20 | C21 | C23 | 108.5° | 109.8° |
| C20 | C21 | C24 | 128.2° | 125.0° |
| C31 | C22 | C30 | 120.3° | 120.0° |
| C31 | C22 | S1 | 119.3° | 120.0° |
| C22 | C31 | H29 | 120.3° | 120.0° |
| O5 | C23 | C21 | 129.3° | 125.0° |
| C23 | C21 | C24 | 123.2° | 125.1° |
| C21 | C24 | C34 | 112.9° | 109.5° |
| C21 | C24 | H19 | 108.6° | 109.5° |
| C21 | C24 | H20 | 108.6° | 109.5° |
| C30 | C22 | S1 | 120.3° | 120.0° |
| C22 | C30 | H28 | 120.3° | 120.0° |
| C22 | S1 | O4 | 108.3° | 106.4° |
| C22 | S1 | N8 | 105.4° | 107.2° |
| C22 | S1 | O3 | 108.3° | 106.4° |
| O4 | S1 | N8 | 103.0° | 106.4° |
| O4 | S1 | O3 | 119.2° | 123.2° |
| C34 | C24 | H19 | 108.6° | 109.4° |
| C34 | C24 | H20 | 108.6° | 109.4° |
| C24 | C34 | H32 | 109.5° | 109.4° |
| C24 | C34 | H33 | 109.5° | 109.5° |
| C24 | C34 | H34 | 109.5° | 109.5° |
| N8 | S1 | O3 | 111.7° | 106.4° |
| S1 | N8 | C18 | 136.8° | 120.0° |
| S1 | N8 | H2 | 111.6° | 119.9° |
| N8 | C18 | O2 | 112.6° | 120.0° |
| N8 | C18 | N7 | 126.4° | 120.0° |
| C18 | N8 | H2 | 111.6° | 120.0° |
| C12 | C15 | C13 | 112.7° | 109.5° |
| C15 | C12 | N7 | 111.6° | 109.5° |
| C15 | C12 | C16 | 111.3° | 109.5° |
| C15 | C12 | H5 | 107.3° | 109.5° |
| C12 | C15 | H10 | 108.7° | 109.5° |
| C12 | C15 | H11 | 108.7° | 109.5° |
| C15 | C13 | C11 | 111.7° | 109.5° |
| C15 | C13 | H6 | 108.9° | 109.5° |
| C15 | C13 | H7 | 108.9° | 109.5° |
| C13 | C15 | H10 | 108.7° | 109.4° |
| C13 | C15 | H11 | 108.7° | 109.4° |
| O2 | C18 | N7 | 121.0° | 120.0° |
| C18 | N7 | C12 | 126.3° | 120.0° |
| C18 | N7 | H1 | 116.8° | 119.9° |
| N7 | C12 | C16 | 111.1° | 109.5° |
| C12 | N7 | H1 | 116.8° | 120.1° |
| N7 | C12 | H5 | 108.1° | 109.5° |
| C12 | C16 | C14 | 112.6° | 109.5° |
| C16 | C12 | H5 | 107.3° | 109.4° |
| C12 | C16 | H12 | 108.7° | 109.5° |
| C12 | C16 | H13 | 108.7° | 109.5° |
| C13 | C11 | C14 | 109.0° | 109.5° |
| C13 | C11 | C17 | 112.3° | 109.5° |
| C13 | C11 | H4 | 107.7° | 109.5° |
| C11 | C13 | H6 | 108.9° | 109.4° |
| C11 | C13 | H7 | 108.9° | 109.5° |
| C16 | C14 | C11 | 111.5° | 109.5° |
| C16 | C14 | H8 | 108.9° | 109.5° |
| C16 | C14 | H9 | 109.0° | 109.4° |
| C14 | C16 | H12 | 108.7° | 109.5° |
| C14 | C16 | H13 | 108.7° | 109.4° |
| C14 | C11 | C17 | 112.2° | 109.4° |
| C14 | C11 | H4 | 107.7° | 109.5° |
| C11 | C14 | H8 | 109.0° | 109.5° |
| C11 | C14 | H9 | 108.9° | 109.5° |
| C17 | C11 | H4 | 107.6° | 109.5° |
| C11 | C17 | H14 | 109.5° | 109.5° |
| C11 | C17 | H15 | 109.4° | 109.4° |
| C11 | C17 | H16 | 109.4° | 109.4° |
| H6 | C13 | H7 | 109.5° | 109.5° |
| H8 | C14 | H9 | 109.5° | 109.4° |
| H10 | C15 | H11 | 109.5° | 109.5° |
| H12 | C16 | H13 | 109.5° | 109.5° |
| H14 | C17 | H15 | 109.5° | 109.5° |
| H14 | C17 | H16 | 109.5° | 109.5° |
| H15 | C17 | H16 | 109.5° | 109.5° |
| H17 | C19 | H18 | 109.4° | 110.2° |
| H19 | C24 | H20 | 109.5° | 109.5° |
| H21 | C25 | H22 | 109.5° | 109.5° |
| H23 | C28 | H24 | 109.4° | 109.4° |
| H25 | C29 | H26 | 109.5° | 109.5° |
| H25 | C29 | H27 | 109.5° | 109.5° |
| H26 | C29 | H27 | 109.5° | 109.4° |
| H32 | C34 | H33 | 109.5° | 109.5° |
| H32 | C34 | H34 | 109.5° | 109.5° |
| H33 | C34 | H34 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | C27 | N10 | C28 | 31.2° | 0.0° |
| O6 | C27 | N10 | N9 | 176.9° | 180.0° |
| O6 | C27 | N9 | C19 | 1.9° | 0.2° |
| O6 | C27 | N9 | C23 | 178.8° | 180.0° |
| O6 | C27 | N10 | H3 | 148.8° | 180.0° |
| C28 | C25 | C26 | H21 | 120.8° | 120.0° |
| C28 | C25 | C26 | H22 | 120.7° | 120.0° |
| C25 | C28 | N10 | H23 | 120.5° | 120.1° |
| C25 | C28 | N10 | H24 | 120.5° | 120.0° |
| C25 | C28 | N10 | C27 | 134.4° | 180.0° |
| C28 | C25 | C26 | C33 | 158.0° | 90.0° |
| C28 | C25 | C26 | C32 | 23.1° | 90.3° |
| C25 | C28 | N10 | H3 | 45.6° | 0.1° |
| C28 | C25 | H21 | H22 | 117.7° | 120.0° |
| C25 | C28 | H23 | H24 | 118.6° | 120.0° |
| C26 | C25 | C28 | N10 | 57.6° | 180.0° |
| C25 | C26 | C33 | C32 | 178.9° | 179.7° |
| C25 | C26 | C33 | C31 | 178.2° | 180.0° |
| C25 | C26 | C32 | C30 | 178.2° | 180.0° |
| C26 | C25 | H21 | H22 | 117.7° | 120.0° |
| C26 | C25 | C28 | H23 | 62.9° | 60.0° |
| C26 | C25 | C28 | H24 | 178.1° | 60.0° |
| C25 | C26 | C32 | H30 | 1.8° | 0.3° |
| C25 | C26 | C33 | H31 | 1.8° | 0.3° |
| C28 | N10 | C27 | H3 | 180.0° | 180.0° |
| C28 | N10 | C27 | N9 | 145.7° | 180.0° |
| N10 | C28 | C25 | H21 | 63.2° | 60.1° |
| N10 | C28 | C25 | H22 | 178.3° | 60.0° |
| N10 | C28 | H23 | H24 | 118.6° | 120.0° |
| N10 | C27 | N9 | C19 | 178.9° | 179.7° |
| N10 | C27 | N9 | C23 | 1.7° | 0.0° |
| C27 | N10 | C28 | H23 | 105.1° | 60.0° |
| C27 | N10 | C28 | H24 | 14.0° | 60.0° |
| C27 | N9 | C19 | C23 | 179.5° | 179.8° |
| C27 | N9 | C19 | C20 | 178.4° | 179.8° |
| C27 | N9 | C23 | O5 | 1.5° | 0.2° |
| C27 | N9 | C23 | C21 | 179.2° | 179.8° |
| N9 | C27 | N10 | H3 | 34.3° | 0.0° |
| C27 | N9 | C19 | H17 | 59.7° | 61.1° |
| C27 | N9 | C19 | H18 | 62.8° | 60.7° |
| N9 | C19 | C20 | H17 | 118.7° | 119.1° |
| N9 | C19 | C20 | H18 | 118.7° | 119.1° |
| N9 | C19 | C20 | C29 | 174.8° | 180.0° |
| N9 | C19 | C20 | C21 | 3.9° | 0.0° |
| C19 | N9 | C23 | O5 | 179.2° | 180.0° |
| C19 | N9 | C23 | C21 | 0.2° | 0.0° |
| N9 | C19 | H17 | H18 | 123.7° | 121.8° |
| C20 | C19 | N9 | C23 | 2.1° | 0.0° |
| C19 | C20 | C29 | C21 | 178.4° | 180.0° |
| C19 | C20 | C21 | C23 | 4.3° | 0.0° |
| C19 | C20 | C21 | C24 | 178.6° | 180.0° |
| C20 | C19 | H17 | H18 | 123.7° | 121.8° |
| C19 | C20 | C29 | H25 | 180.0° | 0.0° |
| C19 | C20 | C29 | H26 | 60.0° | 120.1° |
| C19 | C20 | C29 | H27 | 60.0° | 120.0° |
| C26 | C33 | C31 | H31 | 180.0° | 179.6° |
| C33 | C26 | C32 | C30 | 0.7° | 0.2° |
| C26 | C33 | C31 | C22 | 0.0° | 0.1° |
| C33 | C26 | C25 | H21 | 37.2° | 150.0° |
| C33 | C26 | C25 | H22 | 81.3° | 30.0° |
| C26 | C33 | C31 | H29 | 180.0° | 179.9° |
| C33 | C26 | C32 | H30 | 179.3° | 180.0° |
| C32 | C26 | C33 | C31 | 0.8° | 0.3° |
| C26 | C32 | C30 | H30 | 180.0° | 179.8° |
| C26 | C32 | C30 | C22 | 0.0° | 0.1° |
| C32 | C26 | C25 | H21 | 143.9° | 29.7° |
| C32 | C26 | C25 | H22 | 97.6° | 149.7° |
| C26 | C32 | C30 | H28 | 180.0° | 180.0° |
| C32 | C26 | C33 | H31 | 179.2° | 179.9° |
| C33 | C31 | C22 | H29 | 180.0° | 180.0° |
| C33 | C31 | C22 | C30 | 0.7° | 0.2° |
| C33 | C31 | C22 | S1 | 178.0° | 180.0° |
| N9 | C23 | C21 | C20 | 2.8° | 0.0° |
| N9 | C23 | O5 | C21 | 179.2° | 180.0° |
| N9 | C23 | C21 | C24 | 179.9° | 180.0° |
| C23 | N9 | C19 | H17 | 120.8° | 119.1° |
| C23 | N9 | C19 | H18 | 116.7° | 119.1° |
| C32 | C30 | C22 | C31 | 0.8° | 0.3° |
| C32 | C30 | C22 | H28 | 180.0° | 180.0° |
| C32 | C30 | C22 | S1 | 177.9° | 180.0° |
| C29 | C20 | C21 | C23 | 174.2° | 180.0° |
| C29 | C20 | C21 | C24 | 2.9° | 0.0° |
| C29 | C20 | C19 | H17 | 56.0° | 60.9° |
| C29 | C20 | C19 | H18 | 66.5° | 60.9° |
| C20 | C29 | H25 | H26 | 120.0° | 120.0° |
| C20 | C29 | H25 | H27 | 120.0° | 120.0° |
| C20 | C29 | H26 | H27 | 120.0° | 119.9° |
| C20 | C21 | C23 | O5 | 176.5° | 180.0° |
| C20 | C21 | C23 | C24 | 177.3° | 180.0° |
| C20 | C21 | C24 | C34 | 65.4° | 95.0° |
| C21 | C20 | C19 | H17 | 122.7° | 119.1° |
| C21 | C20 | C19 | H18 | 114.8° | 119.1° |
| C20 | C21 | C24 | H19 | 174.1° | 145.0° |
| C20 | C21 | C24 | H20 | 55.2° | 25.0° |
| C21 | C20 | C29 | H25 | 1.6° | 180.0° |
| C21 | C20 | C29 | H26 | 118.4° | 60.0° |
| C21 | C20 | C29 | H27 | 121.6° | 59.9° |
| C31 | C22 | C30 | S1 | 178.7° | 179.7° |
| C31 | C22 | S1 | O4 | 58.3° | 23.3° |
| C31 | C22 | S1 | N8 | 51.5° | 90.3° |
| C31 | C22 | S1 | O3 | 171.1° | 156.2° |
| C31 | C22 | C30 | H28 | 179.2° | 179.7° |
| C22 | C31 | C33 | H31 | 180.0° | 179.7° |
| O5 | C23 | C21 | C24 | 0.8° | 0.0° |
| C23 | C21 | C24 | C34 | 117.9° | 85.0° |
| C23 | C21 | C24 | H19 | 2.6° | 35.0° |
| C23 | C21 | C24 | H20 | 121.6° | 155.0° |
| C21 | C24 | C34 | H19 | 120.5° | 120.0° |
| C21 | C24 | C34 | H20 | 120.5° | 120.0° |
| C21 | C24 | H19 | H20 | 118.4° | 120.1° |
| C21 | C24 | C34 | H32 | 180.0° | 60.0° |
| C21 | C24 | C34 | H33 | 60.0° | 60.0° |
| C21 | C24 | C34 | H34 | 60.0° | 180.0° |
| C30 | C22 | S1 | O4 | 120.4° | 156.5° |
| C30 | C22 | S1 | N8 | 129.8° | 90.0° |
| C30 | C22 | S1 | O3 | 10.2° | 23.6° |
| C30 | C22 | C31 | H29 | 179.3° | 179.8° |
| C22 | C30 | C32 | H30 | 180.0° | 179.7° |
| C22 | S1 | O4 | N8 | 111.4° | 114.1° |
| C22 | S1 | O4 | O3 | 124.3° | 122.9° |
| C22 | S1 | N8 | O3 | 117.4° | 113.5° |
| C22 | S1 | N8 | C18 | 65.4° | 64.9° |
| C22 | S1 | N8 | H2 | 114.7° | 115.0° |
| S1 | C22 | C30 | H28 | 2.1° | 0.0° |
| S1 | C22 | C31 | H29 | 2.0° | 0.0° |
| O4 | S1 | N8 | O3 | 129.2° | 132.9° |
| O4 | S1 | N8 | C18 | 178.8° | 48.6° |
| O4 | S1 | N8 | H2 | 1.2° | 131.5° |
| C34 | C24 | H19 | H20 | 118.5° | 119.9° |
| C24 | C34 | H32 | H33 | 120.0° | 120.0° |
| C24 | C34 | H32 | H34 | 120.0° | 120.0° |
| C24 | C34 | H33 | H34 | 120.0° | 120.0° |
| S1 | N8 | C18 | H2 | 180.0° | 179.9° |
| S1 | N8 | C18 | O2 | 170.5° | 0.1° |
| S1 | N8 | C18 | N7 | 7.7° | 180.0° |
| O3 | S1 | N8 | C18 | 52.0° | 178.5° |
| O3 | S1 | N8 | H2 | 128.0° | 1.4° |
| N8 | C18 | O2 | N7 | 178.3° | 179.9° |
| N8 | C18 | N7 | C12 | 1.2° | 179.9° |
| N8 | C18 | N7 | H1 | 178.8° | 0.1° |
| C12 | C15 | C13 | H10 | 120.5° | 120.0° |
| C12 | C15 | C13 | H11 | 120.5° | 120.0° |
| C15 | C12 | N7 | C18 | 133.0° | 85.0° |
| C15 | C12 | N7 | C16 | 124.8° | 120.0° |
| C15 | C12 | N7 | H5 | 117.7° | 120.0° |
| C15 | C12 | C16 | H5 | 117.1° | 120.0° |
| C12 | C15 | C13 | C11 | 54.7° | 60.0° |
| C15 | C12 | C16 | C14 | 50.3° | 60.0° |
| C15 | C12 | N7 | H1 | 47.0° | 95.1° |
| C12 | C15 | C13 | H6 | 175.1° | 60.0° |
| C12 | C15 | C13 | H7 | 65.6° | 180.0° |
| C12 | C15 | H10 | H11 | 118.5° | 120.1° |
| C15 | C12 | C16 | H12 | 170.8° | 180.0° |
| C15 | C12 | C16 | H13 | 70.2° | 60.0° |
| C13 | C15 | C12 | N7 | 74.9° | 60.0° |
| C13 | C15 | C12 | C16 | 49.8° | 60.0° |
| C15 | C13 | C11 | H6 | 120.4° | 120.0° |
| C15 | C13 | C11 | H7 | 120.3° | 120.0° |
| C15 | C13 | C11 | C14 | 58.1° | 60.0° |
| C15 | C13 | C11 | C17 | 176.9° | 180.0° |
| C15 | C13 | C11 | H4 | 58.6° | 60.0° |
| C13 | C15 | C12 | H5 | 166.9° | 180.0° |
| C15 | C13 | H6 | H7 | 119.0° | 120.0° |
| C13 | C15 | H10 | H11 | 118.5° | 120.0° |
| O2 | C18 | N7 | C12 | 179.2° | 0.1° |
| O2 | C18 | N7 | H1 | 0.8° | 180.0° |
| O2 | C18 | N8 | H2 | 9.6° | 180.0° |
| C18 | N7 | C12 | H1 | 180.0° | 179.9° |
| C18 | N7 | C12 | C16 | 102.2° | 155.0° |
| N7 | C18 | N8 | H2 | 172.3° | 0.1° |
| C18 | N7 | C12 | H5 | 15.3° | 35.0° |
| N7 | C12 | C16 | H5 | 118.0° | 120.0° |
| N7 | C12 | C16 | C14 | 74.6° | 60.0° |
| N7 | C12 | C15 | H10 | 164.6° | 180.0° |
| N7 | C12 | C15 | H11 | 45.6° | 60.0° |
| N7 | C12 | C16 | H12 | 45.8° | 60.0° |
| N7 | C12 | C16 | H13 | 164.9° | 180.0° |
| C12 | C16 | C14 | H12 | 120.4° | 120.0° |
| C12 | C16 | C14 | H13 | 120.5° | 120.0° |
| C12 | C16 | C14 | C11 | 55.8° | 60.0° |
| C16 | C12 | N7 | H1 | 77.8° | 25.0° |
| C12 | C16 | C14 | H8 | 64.5° | 180.0° |
| C12 | C16 | C14 | H9 | 176.1° | 60.0° |
| C16 | C12 | C15 | H10 | 70.7° | 59.9° |
| C16 | C12 | C15 | H11 | 170.3° | 180.0° |
| C12 | C16 | H12 | H13 | 118.6° | 120.0° |
| C13 | C11 | C14 | C16 | 58.6° | 60.0° |
| C13 | C11 | C14 | C17 | 125.0° | 120.0° |
| C13 | C11 | C14 | H4 | 116.6° | 120.0° |
| C13 | C11 | C17 | H4 | 118.4° | 120.0° |
| C11 | C13 | H6 | H7 | 119.0° | 120.0° |
| C13 | C11 | C14 | H8 | 61.7° | 180.0° |
| C13 | C11 | C14 | H9 | 178.9° | 60.0° |
| C11 | C13 | C15 | H10 | 65.7° | 60.0° |
| C11 | C13 | C15 | H11 | 175.2° | 180.0° |
| C13 | C11 | C17 | H14 | 180.0° | 180.0° |
| C13 | C11 | C17 | H15 | 60.0° | 60.0° |
| C13 | C11 | C17 | H16 | 60.0° | 60.0° |
| C16 | C14 | C11 | H8 | 120.3° | 120.0° |
| C16 | C14 | C11 | H9 | 120.3° | 120.0° |
| C16 | C14 | C11 | C17 | 176.3° | 180.0° |
| C16 | C14 | C11 | H4 | 58.0° | 60.0° |
| C14 | C16 | C12 | H5 | 167.4° | 180.0° |
| C16 | C14 | H8 | H9 | 119.1° | 119.9° |
| C14 | C16 | H12 | H13 | 118.6° | 120.0° |
| C14 | C11 | C17 | H4 | 118.4° | 120.0° |
| C14 | C11 | C13 | H6 | 178.4° | 60.0° |
| C14 | C11 | C13 | H7 | 62.2° | 180.0° |
| C11 | C14 | H8 | H9 | 119.0° | 120.0° |
| C11 | C14 | C16 | H12 | 176.2° | 179.9° |
| C11 | C14 | C16 | H13 | 64.7° | 60.0° |
| C14 | C11 | C17 | H14 | 56.8° | 60.0° |
| C14 | C11 | C17 | H15 | 176.8° | 180.0° |
| C14 | C11 | C17 | H16 | 63.2° | 60.0° |
| C17 | C11 | C13 | H6 | 56.6° | 60.0° |
| C17 | C11 | C13 | H7 | 62.8° | 60.0° |
| C17 | C11 | C14 | H8 | 63.3° | 60.0° |
| C17 | C11 | C14 | H9 | 56.0° | 60.0° |
| C11 | C17 | H14 | H15 | 120.0° | 119.9° |
| C11 | C17 | H14 | H16 | 120.0° | 120.0° |
| C11 | C17 | H15 | H16 | 119.9° | 119.9° |
| H1 | N7 | C12 | H5 | 164.7° | 144.9° |
| H3 | N10 | C28 | H23 | 74.9° | 120.0° |
| H3 | N10 | C28 | H24 | 166.0° | 120.0° |
| H4 | C11 | C13 | H6 | 61.8° | 180.0° |
| H4 | C11 | C13 | H7 | 178.9° | 60.0° |
| H4 | C11 | C14 | H8 | 178.3° | 60.0° |
| H4 | C11 | C14 | H9 | 62.3° | 180.0° |
| H4 | C11 | C17 | H14 | 61.6° | 60.0° |
| H4 | C11 | C17 | H15 | 58.4° | 60.0° |
| H4 | C11 | C17 | H16 | 178.4° | 180.0° |
| H5 | C12 | C15 | H10 | 46.4° | 60.0° |
| H5 | C12 | C15 | H11 | 72.6° | 60.0° |
| H5 | C12 | C16 | H12 | 72.1° | 60.0° |
| H5 | C12 | C16 | H13 | 46.9° | 60.1° |
| H6 | C13 | C15 | H10 | 54.6° | 179.9° |
| H6 | C13 | C15 | H11 | 64.4° | 60.0° |
| H7 | C13 | C15 | H10 | 174.0° | 60.0° |
| H7 | C13 | C15 | H11 | 54.9° | 60.0° |
| H8 | C14 | C16 | H12 | 55.9° | 60.0° |
| H8 | C14 | C16 | H13 | 175.0° | 60.0° |
| H9 | C14 | C16 | H12 | 63.5° | 59.9° |
| H9 | C14 | C16 | H13 | 55.6° | 180.0° |
| H14 | C17 | H15 | H16 | 120.0° | 120.1° |
| H19 | C24 | C34 | H32 | 59.5° | 179.9° |
| H19 | C24 | C34 | H33 | 179.5° | 60.0° |
| H19 | C24 | C34 | H34 | 60.5° | 60.0° |
| H20 | C24 | C34 | H32 | 59.5° | 60.0° |
| H20 | C24 | C34 | H33 | 60.5° | 180.0° |
| H20 | C24 | C34 | H34 | 179.5° | 60.0° |
| H21 | C25 | C28 | H23 | 176.4° | 60.0° |
| H21 | C25 | C28 | H24 | 57.3° | 180.0° |
| H22 | C25 | C28 | H23 | 57.9° | 180.0° |
| H22 | C25 | C28 | H24 | 61.2° | 60.0° |
| H25 | C29 | H26 | H27 | 120.0° | 120.1° |
| H28 | C30 | C32 | H30 | 0.0° | 0.3° |
| H29 | C31 | C33 | H31 | 0.1° | 0.3° |
| H32 | C34 | H33 | H34 | 120.0° | 120.0° |
