YA7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O2 | sing | 1.43Å | 1.43Å | |
| N35 | C34 | sing | 1.40Å | 1.39Å | |
| N35 | S36 | sing | 1.66Å | 1.66Å | |
| O39 | S36 | doub | 1.42Å | 1.43Å | |
| O2 | C3 | sing | 1.36Å | 1.36Å | |
| C34 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
| C34 | C33 | sing | 1.39Å | 1.39Å | Aromatic |
| C37 | S36 | sing | 1.81Å | 1.81Å | |
| C3 | N4 | sing | 1.32Å | 1.33Å | Aromatic |
| S36 | O38 | doub | 1.42Å | 1.42Å | |
| C33 | C6 | doub | 1.40Å | 1.39Å | Aromatic |
| N4 | C5 | doub | 1.32Å | 1.33Å | Aromatic |
| C31 | N30 | sing | 1.47Å | 1.46Å | |
| C31 | C32 | sing | 1.51Å | 1.51Å | |
| C6 | C5 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.48Å | 1.48Å | |
| N30 | C28 | sing | 1.34Å | 1.34Å | |
| C32 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
| C32 | C27 | sing | 1.40Å | 1.40Å | Aromatic |
| C7 | C8 | sing | 1.39Å | 1.40Å | Aromatic |
| C23 | C21 | sing | 1.53Å | 1.53Å | |
| C28 | C27 | sing | 1.48Å | 1.48Å | |
| C28 | O29 | doub | 1.22Å | 1.21Å | |
| C27 | C26 | doub | 1.40Å | 1.41Å | Aromatic |
| C8 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| C21 | O20 | sing | 1.43Å | 1.44Å | |
| C21 | C24 | sing | 1.53Å | 1.53Å | |
| C26 | C9 | sing | 1.39Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.48Å | 1.49Å | |
| O20 | C17 | sing | 1.43Å | 1.44Å | |
| C24 | N15 | sing | 1.47Å | 1.47Å | |
| C25 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C25 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.40Å | 1.41Å | Aromatic |
| C17 | C16 | sing | 1.53Å | 1.54Å | |
| C17 | C19 | sing | 1.53Å | 1.53Å | |
| N15 | C14 | sing | 1.39Å | 1.38Å | |
| N15 | C16 | sing | 1.47Å | 1.48Å | |
| C14 | N13 | doub | 1.32Å | 1.33Å | Aromatic |
| C11 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| N13 | C12 | sing | 1.32Å | 1.33Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å | |
| C11 | H6 | sing | 1.08Å | 1.08Å | |
| C12 | H7 | sing | 1.08Å | 1.08Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C19 | H11 | sing | 1.09Å | 1.10Å | |
| C19 | H12 | sing | 1.09Å | 1.10Å | |
| C19 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C31 | H20 | sing | 1.09Å | 1.10Å | |
| C33 | H21 | sing | 1.08Å | 1.08Å | |
| C37 | H22 | sing | 1.09Å | 1.10Å | |
| C37 | H23 | sing | 1.09Å | 1.10Å | |
| C37 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| N35 | H27 | sing | 0.97Å | 1.00Å | |
| C31 | H28 | sing | 1.09Å | 1.10Å | |
| N30 | H29 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | O2 | C3 | 119.1° | 117.0° |
| O2 | C1 | H1 | 109.5° | 109.5° |
| O2 | C1 | H2 | 109.4° | 109.5° |
| O2 | C1 | H3 | 109.5° | 109.5° |
| C34 | N35 | S36 | 120.2° | 120.0° |
| N35 | C34 | C3 | 123.1° | 120.4° |
| N35 | C34 | C33 | 117.4° | 120.4° |
| C34 | N35 | H27 | 106.7° | 120.0° |
| N35 | S36 | O39 | 105.1° | 104.3° |
| N35 | S36 | C37 | 104.1° | 104.4° |
| N35 | S36 | O38 | 105.2° | 104.3° |
| S36 | N35 | H27 | 106.7° | 120.0° |
| O39 | S36 | C37 | 110.2° | 110.5° |
| O39 | S36 | O38 | 121.7° | 121.0° |
| O2 | C3 | C34 | 119.8° | 119.6° |
| O2 | C3 | N4 | 120.7° | 119.6° |
| C3 | C34 | C33 | 119.5° | 119.1° |
| C34 | C3 | N4 | 119.5° | 120.8° |
| C34 | C33 | C6 | 119.7° | 118.3° |
| C34 | C33 | H21 | 120.1° | 120.8° |
| C37 | S36 | O38 | 109.0° | 110.5° |
| S36 | C37 | H22 | 109.5° | 109.5° |
| S36 | C37 | H23 | 109.5° | 109.5° |
| S36 | C37 | H24 | 109.5° | 109.4° |
| C3 | N4 | C5 | 122.4° | 121.8° |
| C33 | C6 | C5 | 118.0° | 119.1° |
| C33 | C6 | C7 | 117.7° | 120.4° |
| C6 | C33 | H21 | 120.2° | 120.9° |
| N4 | C5 | C6 | 120.9° | 120.8° |
| N4 | C5 | H4 | 119.5° | 119.6° |
| N30 | C31 | C32 | 106.3° | 106.2° |
| C31 | N30 | C28 | 108.8° | 108.8° |
| N30 | C31 | H20 | 110.2° | 110.1° |
| N30 | C31 | H28 | 110.2° | 110.1° |
| C31 | N30 | H29 | 125.6° | 125.6° |
| C31 | C32 | C7 | 133.7° | 133.1° |
| C31 | C32 | C27 | 106.4° | 106.5° |
| C32 | C31 | H20 | 110.2° | 109.9° |
| C32 | C31 | H28 | 110.3° | 110.4° |
| C5 | C6 | C7 | 124.3° | 120.5° |
| C6 | C5 | H4 | 119.5° | 119.6° |
| C6 | C7 | C32 | 121.7° | 120.0° |
| C6 | C7 | C8 | 118.8° | 120.1° |
| N30 | C28 | C27 | 110.7° | 110.3° |
| N30 | C28 | O29 | 124.3° | 124.8° |
| C28 | N30 | H29 | 125.6° | 125.6° |
| C7 | C32 | C27 | 119.9° | 120.5° |
| C32 | C7 | C8 | 119.5° | 119.9° |
| C32 | C27 | C28 | 107.8° | 108.3° |
| C32 | C27 | C26 | 120.2° | 119.6° |
| C7 | C8 | C9 | 121.4° | 119.9° |
| C7 | C8 | H5 | 119.3° | 120.1° |
| C23 | C21 | O20 | 111.0° | 109.5° |
| C23 | C21 | C24 | 109.1° | 109.5° |
| C23 | C21 | H14 | 109.1° | 109.5° |
| C21 | C23 | H15 | 109.5° | 109.5° |
| C21 | C23 | H16 | 109.5° | 109.5° |
| C21 | C23 | H17 | 109.5° | 109.4° |
| C27 | C28 | O29 | 125.1° | 124.9° |
| C28 | C27 | C26 | 132.1° | 132.1° |
| C27 | C26 | C9 | 119.9° | 119.9° |
| C27 | C26 | H26 | 120.0° | 120.0° |
| C8 | C9 | C26 | 119.1° | 120.2° |
| C8 | C9 | C10 | 118.2° | 119.9° |
| C9 | C8 | H5 | 119.3° | 120.0° |
| O20 | C21 | C24 | 108.0° | 109.3° |
| C21 | O20 | C17 | 116.4° | 113.7° |
| O20 | C21 | H14 | 110.5° | 109.6° |
| C21 | C24 | N15 | 106.5° | 109.3° |
| C24 | C21 | H14 | 109.2° | 109.5° |
| C21 | C24 | H18 | 110.2° | 109.5° |
| C21 | C24 | H19 | 110.2° | 109.5° |
| C26 | C9 | C10 | 122.7° | 119.9° |
| C9 | C26 | H26 | 120.0° | 120.0° |
| C9 | C10 | C25 | 120.2° | 120.9° |
| C9 | C10 | C11 | 122.4° | 120.9° |
| O20 | C17 | C16 | 111.6° | 109.2° |
| O20 | C17 | C19 | 109.2° | 109.5° |
| O20 | C17 | H10 | 110.0° | 109.5° |
| C24 | N15 | C14 | 119.4° | 111.0° |
| C24 | N15 | C16 | 118.3° | 110.7° |
| N15 | C24 | H18 | 110.2° | 109.5° |
| N15 | C24 | H19 | 110.2° | 109.5° |
| C10 | C25 | C14 | 119.2° | 118.9° |
| C25 | C10 | C11 | 117.3° | 118.3° |
| C10 | C25 | H25 | 120.4° | 120.5° |
| C25 | C14 | N15 | 119.6° | 119.6° |
| C25 | C14 | N13 | 121.3° | 120.7° |
| C14 | C25 | H25 | 120.4° | 120.6° |
| C10 | C11 | C12 | 119.6° | 119.2° |
| C10 | C11 | H6 | 120.2° | 120.4° |
| C16 | C17 | C19 | 108.7° | 109.5° |
| C17 | C16 | N15 | 109.2° | 109.3° |
| C17 | C16 | H8 | 109.6° | 109.5° |
| C17 | C16 | H9 | 109.5° | 109.5° |
| C16 | C17 | H10 | 108.6° | 109.5° |
| C19 | C17 | H10 | 108.7° | 109.5° |
| C17 | C19 | H11 | 109.5° | 109.5° |
| C17 | C19 | H12 | 109.5° | 109.5° |
| C17 | C19 | H13 | 109.5° | 109.5° |
| C14 | N15 | C16 | 122.3° | 111.1° |
| N15 | C14 | N13 | 119.1° | 119.7° |
| N15 | C16 | H8 | 109.5° | 109.6° |
| N15 | C16 | H9 | 109.6° | 109.5° |
| C14 | N13 | C12 | 121.4° | 121.9° |
| C11 | C12 | N13 | 121.1° | 120.9° |
| C12 | C11 | H6 | 120.2° | 120.4° |
| C11 | C12 | H7 | 119.4° | 119.5° |
| N13 | C12 | H7 | 119.5° | 119.5° |
| H1 | C1 | H2 | 109.4° | 109.4° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H8 | C16 | H9 | 109.5° | 109.5° |
| H11 | C19 | H12 | 109.5° | 109.4° |
| H11 | C19 | H13 | 109.4° | 109.5° |
| H12 | C19 | H13 | 109.5° | 109.5° |
| H15 | C23 | H16 | 109.5° | 109.4° |
| H15 | C23 | H17 | 109.5° | 109.5° |
| H16 | C23 | H17 | 109.5° | 109.5° |
| H18 | C24 | H19 | 109.4° | 109.6° |
| H20 | C31 | H28 | 109.5° | 110.1° |
| H22 | C37 | H23 | 109.4° | 109.5° |
| H22 | C37 | H24 | 109.5° | 109.4° |
| H23 | C37 | H24 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | O2 | C3 | C34 | 151.1° | 179.7° |
| C1 | O2 | C3 | N4 | 29.2° | 0.0° |
| O2 | C1 | H1 | H2 | 120.0° | 120.0° |
| O2 | C1 | H1 | H3 | 120.0° | 120.0° |
| O2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C34 | N35 | S36 | H27 | 121.5° | 180.0° |
| C34 | N35 | S36 | O39 | 149.5° | 178.9° |
| N35 | C34 | C3 | O2 | 0.3° | 0.3° |
| N35 | C34 | C3 | C33 | 179.7° | 180.0° |
| C34 | N35 | S36 | C37 | 94.6° | 65.0° |
| N35 | C34 | C3 | N4 | 180.0° | 180.0° |
| C34 | N35 | S36 | O38 | 20.0° | 51.0° |
| N35 | C34 | C33 | C6 | 179.9° | 180.0° |
| N35 | C34 | C33 | H21 | 0.1° | 0.0° |
| N35 | S36 | O39 | C37 | 111.6° | 111.7° |
| N35 | S36 | O39 | O38 | 119.1° | 116.8° |
| S36 | N35 | C34 | C3 | 116.5° | 145.1° |
| S36 | N35 | C34 | C33 | 63.8° | 35.0° |
| N35 | S36 | C37 | O38 | 111.9° | 111.6° |
| N35 | S36 | C37 | H22 | 180.0° | 59.9° |
| N35 | S36 | C37 | H23 | 60.0° | 180.0° |
| N35 | S36 | C37 | H24 | 60.0° | 60.0° |
| O39 | S36 | C37 | O38 | 135.9° | 136.7° |
| O39 | S36 | C37 | H22 | 67.8° | 51.7° |
| O39 | S36 | C37 | H23 | 52.2° | 68.4° |
| O39 | S36 | C37 | H24 | 172.2° | 171.6° |
| O39 | S36 | N35 | H27 | 28.0° | 1.1° |
| O2 | C3 | C34 | N4 | 179.7° | 179.6° |
| O2 | C3 | C34 | C33 | 180.0° | 179.7° |
| O2 | C3 | N4 | C5 | 179.9° | 179.7° |
| C3 | O2 | C1 | H1 | 180.0° | 180.0° |
| C3 | O2 | C1 | H2 | 60.0° | 60.0° |
| C3 | O2 | C1 | H3 | 60.0° | 60.0° |
| C3 | C34 | C33 | C6 | 0.2° | 0.1° |
| C34 | C3 | N4 | C5 | 0.4° | 0.1° |
| C3 | C34 | C33 | H21 | 179.8° | 180.0° |
| C3 | C34 | N35 | H27 | 5.0° | 34.9° |
| C33 | C34 | C3 | N4 | 0.3° | 0.1° |
| C34 | C33 | C6 | H21 | 180.0° | 180.0° |
| C34 | C33 | C6 | C5 | 0.2° | 0.0° |
| C34 | C33 | C6 | C7 | 179.7° | 179.9° |
| C33 | C34 | N35 | H27 | 174.7° | 145.0° |
| S36 | C37 | H22 | H23 | 120.0° | 120.1° |
| S36 | C37 | H22 | H24 | 120.0° | 119.9° |
| S36 | C37 | H23 | H24 | 120.0° | 120.0° |
| C37 | S36 | N35 | H27 | 143.8° | 115.0° |
| C3 | N4 | C5 | C6 | 0.4° | 0.0° |
| C3 | N4 | C5 | H4 | 179.6° | 180.0° |
| O38 | S36 | C37 | H22 | 68.1° | 171.6° |
| O38 | S36 | C37 | H23 | 171.9° | 68.4° |
| O38 | S36 | C37 | H24 | 51.9° | 51.7° |
| O38 | S36 | N35 | H27 | 101.6° | 129.0° |
| C33 | C6 | C5 | N4 | 0.3° | 0.0° |
| C33 | C6 | C5 | C7 | 179.5° | 179.9° |
| C33 | C6 | C7 | C32 | 131.1° | 129.7° |
| C33 | C6 | C7 | C8 | 47.5° | 50.0° |
| C33 | C6 | C5 | H4 | 179.7° | 180.0° |
| N4 | C5 | C6 | H4 | 180.0° | 180.0° |
| N4 | C5 | C6 | C7 | 179.7° | 180.0° |
| N30 | C31 | C32 | H20 | 119.5° | 119.0° |
| N30 | C31 | C32 | H28 | 119.5° | 119.3° |
| C31 | N30 | C28 | H29 | 180.0° | 179.7° |
| N30 | C31 | C32 | C7 | 179.6° | 180.0° |
| N30 | C31 | C32 | C27 | 0.7° | 0.0° |
| C31 | N30 | C28 | C27 | 0.8° | 0.5° |
| C31 | N30 | C28 | O29 | 179.8° | 179.7° |
| N30 | C31 | H20 | H28 | 121.4° | 121.6° |
| C31 | C32 | C7 | C6 | 1.0° | 0.1° |
| C32 | C31 | N30 | C28 | 0.9° | 0.3° |
| C31 | C32 | C7 | C27 | 179.6° | 179.9° |
| C31 | C32 | C7 | C8 | 179.7° | 179.8° |
| C31 | C32 | C27 | C28 | 0.3° | 0.2° |
| C31 | C32 | C27 | C26 | 179.8° | 180.0° |
| C32 | C31 | H20 | H28 | 121.5° | 121.8° |
| C32 | C31 | N30 | H29 | 179.1° | 180.0° |
| C5 | C6 | C7 | C32 | 48.3° | 50.3° |
| C5 | C6 | C7 | C8 | 133.0° | 130.0° |
| C5 | C6 | C33 | H21 | 179.8° | 180.0° |
| C6 | C7 | C32 | C8 | 178.7° | 179.7° |
| C6 | C7 | C32 | C27 | 179.4° | 180.0° |
| C6 | C7 | C8 | C9 | 179.9° | 180.0° |
| C7 | C6 | C5 | H4 | 0.3° | 0.1° |
| C6 | C7 | C8 | H5 | 0.1° | 0.0° |
| C7 | C6 | C33 | H21 | 0.3° | 0.0° |
| N30 | C28 | C27 | C32 | 0.3° | 0.4° |
| N30 | C28 | C27 | O29 | 179.0° | 179.8° |
| N30 | C28 | C27 | C26 | 179.1° | 179.9° |
| C28 | N30 | C31 | H20 | 118.5° | 119.2° |
| C28 | N30 | C31 | H28 | 120.4° | 119.2° |
| C7 | C32 | C27 | C28 | 180.0° | 179.7° |
| C7 | C32 | C27 | C26 | 0.5° | 0.0° |
| C32 | C7 | C8 | C9 | 1.2° | 0.3° |
| C32 | C7 | C8 | H5 | 178.8° | 179.7° |
| C7 | C32 | C31 | H20 | 60.9° | 61.0° |
| C7 | C32 | C31 | H28 | 60.2° | 60.6° |
| C27 | C32 | C7 | C8 | 0.7° | 0.3° |
| C32 | C27 | C28 | C26 | 179.4° | 179.7° |
| C32 | C27 | C28 | O29 | 179.3° | 179.8° |
| C32 | C27 | C26 | C9 | 0.7° | 0.3° |
| C27 | C32 | C31 | H20 | 118.8° | 119.1° |
| C32 | C27 | C26 | H26 | 179.3° | 180.0° |
| C27 | C32 | C31 | H28 | 120.2° | 119.3° |
| C7 | C8 | C9 | H5 | 180.0° | 179.9° |
| C7 | C8 | C9 | C26 | 1.4° | 0.0° |
| C7 | C8 | C9 | C10 | 179.0° | 180.0° |
| C23 | C21 | O20 | C24 | 119.5° | 119.9° |
| C23 | C21 | O20 | H14 | 121.2° | 120.1° |
| C23 | C21 | C24 | H14 | 119.2° | 120.0° |
| C23 | C21 | O20 | C17 | 178.9° | 178.6° |
| C23 | C21 | C24 | N15 | 178.6° | 176.8° |
| C21 | C23 | H15 | H16 | 120.0° | 120.0° |
| C21 | C23 | H15 | H17 | 120.0° | 120.0° |
| C21 | C23 | H16 | H17 | 120.0° | 120.0° |
| C23 | C21 | C24 | H18 | 61.9° | 63.2° |
| C23 | C21 | C24 | H19 | 59.0° | 56.9° |
| C28 | C27 | C26 | C9 | 179.9° | 179.9° |
| C28 | C27 | C26 | H26 | 0.1° | 0.4° |
| C27 | C28 | N30 | H29 | 179.2° | 179.8° |
| O29 | C28 | C27 | C26 | 0.1° | 0.1° |
| O29 | C28 | N30 | H29 | 0.2° | 0.0° |
| C27 | C26 | C9 | C8 | 1.2° | 0.3° |
| C27 | C26 | C9 | H26 | 180.0° | 179.7° |
| C27 | C26 | C9 | C10 | 178.6° | 179.7° |
| C8 | C9 | C26 | C10 | 177.4° | 180.0° |
| C8 | C9 | C10 | C25 | 135.8° | 180.0° |
| C8 | C9 | C10 | C11 | 40.8° | 0.0° |
| C8 | C9 | C26 | H26 | 178.8° | 179.9° |
| O20 | C21 | C24 | H14 | 120.2° | 120.0° |
| O20 | C21 | C24 | N15 | 57.9° | 56.8° |
| C21 | O20 | C17 | C16 | 54.1° | 58.6° |
| C21 | O20 | C17 | C19 | 174.2° | 178.6° |
| C21 | O20 | C17 | H10 | 66.5° | 61.3° |
| O20 | C21 | C23 | H15 | 180.0° | 60.0° |
| O20 | C21 | C23 | H16 | 60.0° | 180.0° |
| O20 | C21 | C23 | H17 | 60.0° | 60.0° |
| O20 | C21 | C24 | H18 | 177.5° | 176.8° |
| O20 | C21 | C24 | H19 | 61.6° | 63.1° |
| C24 | C21 | O20 | C17 | 61.6° | 58.7° |
| C21 | C24 | N15 | H18 | 119.5° | 120.0° |
| C21 | C24 | N15 | H19 | 119.5° | 119.9° |
| C21 | C24 | N15 | C14 | 122.7° | 177.6° |
| C21 | C24 | N15 | C16 | 56.7° | 58.6° |
| C24 | C21 | C23 | H15 | 61.2° | 59.8° |
| C24 | C21 | C23 | H16 | 178.8° | 60.1° |
| C24 | C21 | C23 | H17 | 58.8° | 179.8° |
| C21 | C24 | H18 | H19 | 121.4° | 120.1° |
| C26 | C9 | C10 | C25 | 41.6° | 0.0° |
| C26 | C9 | C10 | C11 | 141.7° | 179.9° |
| C26 | C9 | C8 | H5 | 178.5° | 180.0° |
| C9 | C10 | C25 | C11 | 176.8° | 179.9° |
| C9 | C10 | C25 | C14 | 178.9° | 179.5° |
| C9 | C10 | C11 | C12 | 178.4° | 180.0° |
| C10 | C9 | C8 | H5 | 1.0° | 0.1° |
| C9 | C10 | C11 | H6 | 1.7° | 0.2° |
| C9 | C10 | C25 | H25 | 1.1° | 0.0° |
| C10 | C9 | C26 | H26 | 1.4° | 0.0° |
| O20 | C17 | C16 | C19 | 120.5° | 120.0° |
| O20 | C17 | C16 | H10 | 121.4° | 119.9° |
| O20 | C17 | C19 | H10 | 120.0° | 120.1° |
| O20 | C17 | C16 | N15 | 43.2° | 56.9° |
| O20 | C17 | C16 | H8 | 76.7° | 63.1° |
| O20 | C17 | C16 | H9 | 163.2° | 176.8° |
| O20 | C17 | C19 | H11 | 180.0° | 59.8° |
| O20 | C17 | C19 | H12 | 60.0° | 60.2° |
| O20 | C17 | C19 | H13 | 60.0° | 179.8° |
| C17 | O20 | C21 | H14 | 57.7° | 61.3° |
| C24 | N15 | C14 | C25 | 95.7° | 179.5° |
| C24 | N15 | C16 | C17 | 49.2° | 58.6° |
| C24 | N15 | C14 | C16 | 179.4° | 123.6° |
| C24 | N15 | C14 | N13 | 82.9° | 0.0° |
| C24 | N15 | C16 | H8 | 70.8° | 61.4° |
| C24 | N15 | C16 | H9 | 169.1° | 178.5° |
| N15 | C24 | C21 | H14 | 62.2° | 63.2° |
| N15 | C24 | H18 | H19 | 121.4° | 120.1° |
| C10 | C25 | C14 | H25 | 180.0° | 179.5° |
| C10 | C25 | C14 | N15 | 179.7° | 179.7° |
| C10 | C25 | C14 | N13 | 1.8° | 0.8° |
| C25 | C10 | C11 | C12 | 1.6° | 0.1° |
| C25 | C10 | C11 | H6 | 178.4° | 179.7° |
| C14 | C25 | C10 | C11 | 2.1° | 0.6° |
| C25 | C14 | N15 | N13 | 178.5° | 179.5° |
| C25 | C14 | N15 | C16 | 83.7° | 56.9° |
| C25 | C14 | N13 | C12 | 0.8° | 0.6° |
| C10 | C11 | C12 | H6 | 180.0° | 179.8° |
| C10 | C11 | C12 | N13 | 0.7° | 0.2° |
| C10 | C11 | C12 | H7 | 179.3° | 179.7° |
| C11 | C10 | C25 | H25 | 177.9° | 180.0° |
| C16 | C17 | C19 | H10 | 118.1° | 120.1° |
| C17 | C16 | N15 | C14 | 130.2° | 177.6° |
| C17 | C16 | N15 | H8 | 120.0° | 120.0° |
| C17 | C16 | N15 | H9 | 120.0° | 119.9° |
| C17 | C16 | H8 | H9 | 120.1° | 120.0° |
| C16 | C17 | C19 | H11 | 58.1° | 60.0° |
| C16 | C17 | C19 | H12 | 61.9° | 180.0° |
| C16 | C17 | C19 | H13 | 178.1° | 60.0° |
| C19 | C17 | C16 | N15 | 163.7° | 176.8° |
| C19 | C17 | C16 | H8 | 43.7° | 56.8° |
| C19 | C17 | C16 | H9 | 76.4° | 63.2° |
| C17 | C19 | H11 | H12 | 120.0° | 120.0° |
| C17 | C19 | H11 | H13 | 120.0° | 120.0° |
| C17 | C19 | H12 | H13 | 120.0° | 120.0° |
| N15 | C14 | N13 | C12 | 179.3° | 180.0° |
| C14 | N15 | C16 | H8 | 109.8° | 62.4° |
| C14 | N15 | C16 | H9 | 10.2° | 57.7° |
| C14 | N15 | C24 | H18 | 3.1° | 57.6° |
| C14 | N15 | C24 | H19 | 117.8° | 62.5° |
| N15 | C14 | C25 | H25 | 0.3° | 0.2° |
| C16 | N15 | C14 | N13 | 97.8° | 123.6° |
| N15 | C16 | H8 | H9 | 120.1° | 120.1° |
| N15 | C16 | C17 | H10 | 78.2° | 63.0° |
| C16 | N15 | C24 | H18 | 176.3° | 178.5° |
| C16 | N15 | C24 | H19 | 62.8° | 61.3° |
| C14 | N13 | C12 | C11 | 0.3° | 0.1° |
| C14 | N13 | C12 | H7 | 179.7° | 180.0° |
| N13 | C14 | C25 | H25 | 178.2° | 179.7° |
| C11 | C12 | N13 | H7 | 180.0° | 179.9° |
| N13 | C12 | C11 | H6 | 179.3° | 180.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H6 | C11 | C12 | H7 | 0.7° | 0.1° |
| H8 | C16 | C17 | H10 | 161.9° | 176.9° |
| H9 | C16 | C17 | H10 | 41.8° | 56.9° |
| H10 | C17 | C19 | H11 | 60.0° | 179.9° |
| H10 | C17 | C19 | H12 | 180.0° | 59.9° |
| H10 | C17 | C19 | H13 | 60.0° | 60.1° |
| H11 | C19 | H12 | H13 | 120.0° | 120.0° |
| H14 | C21 | C23 | H15 | 58.0° | 179.8° |
| H14 | C21 | C23 | H16 | 62.0° | 59.9° |
| H14 | C21 | C23 | H17 | 178.0° | 60.2° |
| H14 | C21 | C24 | H18 | 57.3° | 56.8° |
| H14 | C21 | C24 | H19 | 178.2° | 177.0° |
| H15 | C23 | H16 | H17 | 120.0° | 120.0° |
| H20 | C31 | N30 | H29 | 61.4° | 61.1° |
| H22 | C37 | H23 | H24 | 120.0° | 120.0° |
| H28 | C31 | N30 | H29 | 59.6° | 60.5° |
