VQW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C5 | sing | 1.53Å | 1.56Å | |
| C15 | C13 | sing | 1.53Å | 1.55Å | |
| C23 | C17 | sing | 1.53Å | 1.54Å | |
| C5 | C10 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.53Å | 1.58Å | |
| C5 | C7 | sing | 1.53Å | 1.58Å | |
| C6 | C4 | sing | 1.53Å | 1.55Å | |
| C6 | C8 | sing | 1.53Å | 1.57Å | |
| C9 | C7 | sing | 1.54Å | 1.57Å | |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| C9 | C12 | sing | 1.52Å | 1.53Å | |
| C10 | C1 | sing | 1.53Å | 1.56Å | |
| C4 | C2 | sing | 1.53Å | 1.56Å | |
| C11 | C7 | sing | 1.53Å | 1.59Å | |
| C11 | C14 | sing | 1.54Å | 1.53Å | |
| C13 | C12 | sing | 1.55Å | 1.55Å | |
| C13 | C14 | sing | 1.50Å | 1.48Å | |
| C13 | C16 | sing | 1.50Å | 1.45Å | |
| C17 | C12 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.56Å | 1.57Å | |
| C18 | C16 | sing | 1.53Å | 1.43Å | |
| C16 | O16 | doub | 1.21Å | 1.24Å | |
| C1 | C3 | sing | 1.53Å | 1.50Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C3 | O25 | sing | 1.43Å | 1.45Å | |
| N19 | S22 | sing | 1.66Å | 1.62Å | |
| O25 | S22 | sing | 1.52Å | 1.55Å | |
| O20 | S22 | doub | 1.42Å | 1.50Å | |
| S22 | O21 | doub | 1.42Å | 1.44Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C9 | H12 | sing | 1.09Å | 1.10Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | 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 | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C15 | H20 | sing | 1.09Å | 1.10Å | |
| C15 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C | H29 | sing | 1.09Å | 1.10Å | |
| C | H30 | sing | 1.09Å | 1.10Å | |
| C | H31 | sing | 1.09Å | 1.10Å | |
| N19 | H32 | sing | 0.97Å | 1.00Å | |
| N19 | H33 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C5 | C10 | 103.2° | 109.5° |
| C | C5 | C4 | 110.1° | 109.5° |
| C | C5 | C7 | 111.2° | 109.6° |
| C5 | C | H29 | 109.5° | 109.5° |
| C5 | C | H30 | 109.5° | 109.5° |
| C5 | C | H31 | 109.5° | 109.5° |
| C15 | C13 | C12 | 116.2° | 109.5° |
| C15 | C13 | C14 | 109.7° | 109.3° |
| C15 | C13 | C16 | 107.6° | 109.2° |
| C13 | C15 | H20 | 109.5° | 109.5° |
| C13 | C15 | H21 | 109.5° | 109.4° |
| C13 | C15 | H22 | 109.5° | 109.5° |
| C23 | C17 | C12 | 114.9° | 110.8° |
| C23 | C17 | C18 | 117.4° | 110.5° |
| C23 | C17 | H23 | 108.0° | 110.8° |
| C17 | C23 | H26 | 109.5° | 109.5° |
| C17 | C23 | H27 | 109.5° | 109.5° |
| C17 | C23 | H28 | 109.4° | 109.5° |
| C10 | C5 | C4 | 109.5° | 109.4° |
| C10 | C5 | C7 | 112.2° | 109.5° |
| C5 | C10 | C1 | 111.0° | 109.4° |
| C5 | C10 | H13 | 109.0° | 109.5° |
| C5 | C10 | H14 | 109.1° | 109.5° |
| C4 | C5 | C7 | 110.5° | 109.4° |
| C5 | C4 | C6 | 110.6° | 109.5° |
| C5 | C4 | C2 | 112.1° | 109.4° |
| C5 | C4 | H6 | 107.0° | 109.5° |
| C5 | C7 | C9 | 107.7° | 109.2° |
| C5 | C7 | C11 | 115.5° | 110.0° |
| C5 | C7 | H9 | 107.2° | 108.8° |
| C4 | C6 | C8 | 111.3° | 109.5° |
| C6 | C4 | C2 | 112.1° | 109.4° |
| C6 | C4 | H6 | 107.3° | 109.5° |
| C4 | C6 | H7 | 109.0° | 109.5° |
| C4 | C6 | H8 | 109.0° | 109.5° |
| C6 | C8 | C9 | 109.5° | 109.4° |
| C8 | C6 | H7 | 109.0° | 109.4° |
| C8 | C6 | H8 | 109.0° | 109.4° |
| C6 | C8 | H10 | 109.5° | 109.5° |
| C6 | C8 | H11 | 109.5° | 109.5° |
| C7 | C9 | C8 | 109.9° | 109.2° |
| C7 | C9 | C12 | 108.5° | 107.3° |
| C9 | C7 | C11 | 111.5° | 111.0° |
| C9 | C7 | H9 | 107.4° | 108.9° |
| C7 | C9 | H12 | 109.5° | 109.7° |
| C8 | C9 | C12 | 108.9° | 110.4° |
| C9 | C8 | H10 | 109.5° | 109.6° |
| C9 | C8 | H11 | 109.5° | 109.4° |
| C8 | C9 | H12 | 110.1° | 109.7° |
| C9 | C12 | C13 | 113.1° | 107.0° |
| C9 | C12 | C17 | 118.0° | 115.7° |
| C12 | C9 | H12 | 110.0° | 110.5° |
| C9 | C12 | H17 | 107.4° | 110.4° |
| C10 | C1 | C3 | 110.9° | 109.5° |
| C10 | C1 | H1 | 109.1° | 109.5° |
| C10 | C1 | H2 | 109.1° | 109.5° |
| C1 | C10 | H13 | 109.1° | 109.5° |
| C1 | C10 | H14 | 109.1° | 109.5° |
| C4 | C2 | C3 | 109.6° | 109.4° |
| C4 | C2 | H3 | 109.4° | 109.5° |
| C4 | C2 | H4 | 109.4° | 109.5° |
| C2 | C4 | H6 | 107.4° | 109.5° |
| C7 | C11 | C14 | 110.6° | 111.4° |
| C11 | C7 | H9 | 107.2° | 108.9° |
| C7 | C11 | H15 | 109.2° | 109.1° |
| C7 | C11 | H16 | 109.2° | 109.1° |
| C11 | C14 | C13 | 111.5° | 107.5° |
| C14 | C11 | H15 | 109.2° | 109.1° |
| C14 | C11 | H16 | 109.2° | 109.1° |
| C11 | C14 | H18 | 109.0° | 109.9° |
| C11 | C14 | H19 | 108.9° | 109.9° |
| C12 | C13 | C14 | 106.6° | 107.8° |
| C12 | C13 | C16 | 99.1° | 103.6° |
| C13 | C12 | C17 | 103.3° | 102.1° |
| C13 | C12 | H17 | 107.1° | 110.6° |
| C14 | C13 | C16 | 117.7° | 117.1° |
| C13 | C14 | H18 | 108.9° | 110.1° |
| C13 | C14 | H19 | 109.0° | 109.4° |
| C13 | C16 | C18 | 110.7° | 105.9° |
| C13 | C16 | O16 | 125.4° | 127.0° |
| C12 | C17 | C18 | 100.1° | 102.0° |
| C17 | C12 | H17 | 107.4° | 110.6° |
| C12 | C17 | H23 | 108.2° | 110.8° |
| C17 | C18 | C16 | 106.6° | 107.1° |
| C18 | C17 | H23 | 107.6° | 111.6° |
| C17 | C18 | H24 | 110.2° | 110.0° |
| C17 | C18 | H25 | 110.2° | 110.0° |
| C18 | C16 | O16 | 123.8° | 127.1° |
| C16 | C18 | H24 | 110.2° | 108.7° |
| C16 | C18 | H25 | 110.2° | 111.0° |
| C1 | C3 | C2 | 111.1° | 109.5° |
| C1 | C3 | O25 | 107.6° | 109.5° |
| C3 | C1 | H1 | 109.1° | 109.5° |
| C3 | C1 | H2 | 109.1° | 109.5° |
| C1 | C3 | H5 | 109.7° | 109.5° |
| C2 | C3 | O25 | 108.8° | 109.4° |
| C3 | C2 | H3 | 109.4° | 109.5° |
| C3 | C2 | H4 | 109.4° | 109.4° |
| C2 | C3 | H5 | 109.4° | 109.5° |
| C3 | O25 | S22 | 119.0° | 114.0° |
| O25 | C3 | H5 | 110.3° | 109.4° |
| N19 | S22 | O25 | 107.3° | 107.3° |
| N19 | S22 | O20 | 112.2° | 106.4° |
| N19 | S22 | O21 | 111.9° | 106.4° |
| S22 | N19 | H32 | 109.5° | 119.9° |
| S22 | N19 | H33 | 109.5° | 120.0° |
| O25 | S22 | O20 | 107.9° | 106.4° |
| O25 | S22 | O21 | 100.3° | 106.4° |
| O20 | S22 | O21 | 116.0° | 123.2° |
| H1 | C1 | H2 | 109.4° | 109.5° |
| H3 | C2 | H4 | 109.5° | 109.5° |
| H7 | C6 | H8 | 109.5° | 109.5° |
| H10 | C8 | H11 | 109.5° | 109.5° |
| H13 | C10 | H14 | 109.4° | 109.5° |
| H15 | C11 | H16 | 109.4° | 109.0° |
| H18 | C14 | H19 | 109.5° | 110.0° |
| H20 | C15 | H21 | 109.5° | 109.5° |
| H20 | C15 | H22 | 109.5° | 109.5° |
| H21 | C15 | H22 | 109.5° | 109.5° |
| H24 | C18 | H25 | 109.5° | 110.0° |
| H26 | C23 | H27 | 109.5° | 109.5° |
| H26 | C23 | H28 | 109.5° | 109.4° |
| H27 | C23 | H28 | 109.5° | 109.5° |
| H29 | C | H30 | 109.5° | 109.4° |
| H29 | C | H31 | 109.5° | 109.4° |
| H30 | C | H31 | 109.5° | 109.5° |
| H32 | N19 | H33 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C5 | C10 | C4 | 117.2° | 120.0° |
| C | C5 | C10 | C7 | 119.8° | 120.1° |
| C | C5 | C4 | C7 | 123.2° | 120.1° |
| C | C5 | C4 | C6 | 68.0° | 59.9° |
| C | C5 | C7 | C9 | 64.0° | 59.5° |
| C | C5 | C10 | C1 | 171.1° | 179.8° |
| C | C5 | C4 | C2 | 166.1° | 179.8° |
| C | C5 | C7 | C11 | 61.4° | 62.6° |
| C | C5 | C4 | H6 | 48.6° | 60.2° |
| C | C5 | C7 | H9 | 179.3° | 178.2° |
| C | C5 | C10 | H13 | 50.8° | 59.8° |
| C | C5 | C10 | H14 | 68.7° | 60.2° |
| C5 | C | H29 | H30 | 120.0° | 120.0° |
| C5 | C | H29 | H31 | 120.0° | 120.0° |
| C5 | C | H30 | H31 | 120.0° | 120.1° |
| C15 | C13 | C12 | C9 | 58.7° | 49.3° |
| C15 | C13 | C14 | C11 | 63.6° | 54.8° |
| C15 | C13 | C12 | C14 | 122.6° | 118.8° |
| C15 | C13 | C12 | C16 | 114.8° | 116.4° |
| C15 | C13 | C14 | C16 | 123.4° | 124.7° |
| C15 | C13 | C12 | C17 | 70.0° | 72.6° |
| C15 | C13 | C16 | C18 | 85.6° | 87.0° |
| C15 | C13 | C16 | O16 | 90.4° | 93.1° |
| C15 | C13 | C12 | H17 | 176.8° | 169.7° |
| C15 | C13 | C14 | H18 | 176.1° | 174.5° |
| C15 | C13 | C14 | H19 | 56.7° | 64.5° |
| C13 | C15 | H20 | H21 | 120.0° | 119.9° |
| C13 | C15 | H20 | H22 | 120.0° | 120.0° |
| C13 | C15 | H21 | H22 | 120.0° | 120.0° |
| C23 | C17 | C12 | C9 | 35.7° | 37.6° |
| C23 | C17 | C12 | C13 | 89.9° | 78.1° |
| C23 | C17 | C12 | C18 | 126.8° | 117.6° |
| C23 | C17 | C12 | H23 | 120.8° | 123.5° |
| C23 | C17 | C18 | H23 | 122.0° | 123.8° |
| C23 | C17 | C18 | C16 | 109.3° | 95.8° |
| C23 | C17 | C12 | H17 | 157.1° | 164.1° |
| C23 | C17 | C18 | H24 | 10.3° | 146.3° |
| C23 | C17 | C18 | H25 | 131.2° | 24.9° |
| C17 | C23 | H26 | H27 | 120.0° | 120.0° |
| C17 | C23 | H26 | H28 | 120.0° | 120.0° |
| C17 | C23 | H27 | H28 | 119.9° | 120.0° |
| C10 | C5 | C4 | C7 | 124.0° | 119.9° |
| C10 | C5 | C4 | C6 | 179.2° | 179.8° |
| C10 | C5 | C7 | C9 | 179.0° | 179.6° |
| C5 | C10 | C1 | H13 | 120.2° | 120.0° |
| C5 | C10 | C1 | H14 | 120.3° | 120.0° |
| C10 | C5 | C4 | C2 | 53.3° | 60.2° |
| C10 | C5 | C7 | C11 | 53.6° | 57.5° |
| C5 | C10 | C1 | C3 | 58.8° | 60.1° |
| C5 | C10 | C1 | H1 | 179.0° | 59.9° |
| C5 | C10 | C1 | H2 | 61.4° | 180.0° |
| C10 | C5 | C4 | H6 | 64.2° | 59.8° |
| C10 | C5 | C7 | H9 | 65.7° | 61.7° |
| C5 | C10 | H13 | H14 | 119.3° | 120.1° |
| C10 | C5 | C | H29 | 180.0° | 60.0° |
| C10 | C5 | C | H30 | 60.0° | 180.0° |
| C10 | C5 | C | H31 | 60.0° | 60.0° |
| C5 | C4 | C6 | C2 | 125.9° | 119.9° |
| C5 | C4 | C6 | H6 | 116.4° | 120.1° |
| C5 | C4 | C6 | C8 | 54.3° | 59.9° |
| C4 | C5 | C7 | C9 | 58.5° | 60.5° |
| C4 | C5 | C10 | C1 | 53.9° | 60.2° |
| C5 | C4 | C2 | H6 | 117.3° | 120.1° |
| C4 | C5 | C7 | C11 | 176.1° | 177.4° |
| C5 | C4 | C2 | C3 | 55.1° | 60.1° |
| C5 | C4 | C2 | H3 | 64.9° | 179.9° |
| C5 | C4 | C2 | H4 | 175.2° | 59.8° |
| C5 | C4 | C6 | H7 | 65.9° | 60.1° |
| C5 | C4 | C6 | H8 | 174.6° | 179.8° |
| C4 | C5 | C7 | H9 | 56.8° | 58.2° |
| C4 | C5 | C10 | H13 | 66.4° | 179.8° |
| C4 | C5 | C10 | H14 | 174.1° | 59.8° |
| C4 | C5 | C | H29 | 63.2° | 59.9° |
| C4 | C5 | C | H30 | 176.8° | 60.0° |
| C4 | C5 | C | H31 | 56.8° | 179.9° |
| C7 | C5 | C4 | C6 | 55.1° | 60.2° |
| C5 | C7 | C9 | C11 | 127.7° | 121.4° |
| C5 | C7 | C9 | H9 | 115.2° | 118.7° |
| C5 | C7 | C9 | C8 | 63.0° | 60.6° |
| C5 | C7 | C9 | C12 | 178.0° | 179.8° |
| C7 | C5 | C10 | C1 | 69.1° | 59.7° |
| C7 | C5 | C4 | C2 | 70.8° | 59.7° |
| C5 | C7 | C11 | H9 | 119.3° | 119.2° |
| C5 | C7 | C11 | C14 | 174.8° | 176.2° |
| C7 | C5 | C4 | H6 | 171.8° | 179.7° |
| C5 | C7 | C9 | H12 | 57.9° | 59.6° |
| C7 | C5 | C10 | H13 | 170.6° | 60.3° |
| C7 | C5 | C10 | H14 | 51.1° | 179.7° |
| C5 | C7 | C11 | H15 | 65.0° | 63.3° |
| C5 | C7 | C11 | H16 | 54.6° | 55.7° |
| C7 | C5 | C | H29 | 59.6° | 179.9° |
| C7 | C5 | C | H30 | 60.5° | 60.0° |
| C7 | C5 | C | H31 | 179.6° | 60.1° |
| C4 | C6 | C8 | H7 | 120.3° | 120.0° |
| C4 | C6 | C8 | H8 | 120.3° | 120.0° |
| C4 | C6 | C8 | C9 | 58.4° | 60.0° |
| C6 | C4 | C2 | H6 | 117.7° | 120.0° |
| C6 | C4 | C2 | C3 | 179.8° | 179.9° |
| C6 | C4 | C2 | H3 | 60.2° | 60.0° |
| C6 | C4 | C2 | H4 | 59.8° | 60.1° |
| C4 | C6 | H7 | H8 | 119.1° | 120.0° |
| C4 | C6 | C8 | H10 | 178.5° | 179.9° |
| C4 | C6 | C8 | H11 | 61.6° | 59.9° |
| C6 | C8 | C9 | C7 | 62.9° | 60.3° |
| C6 | C8 | C9 | H10 | 120.0° | 120.0° |
| C6 | C8 | C9 | H11 | 120.0° | 119.9° |
| C6 | C8 | C9 | C12 | 178.4° | 178.0° |
| C8 | C6 | C4 | C2 | 71.6° | 60.0° |
| C8 | C6 | C4 | H6 | 170.8° | 180.0° |
| C8 | C6 | H7 | H8 | 119.2° | 119.9° |
| C6 | C8 | H10 | H11 | 120.0° | 120.0° |
| C6 | C8 | C9 | H12 | 57.7° | 59.9° |
| C7 | C9 | C8 | C12 | 118.8° | 117.7° |
| C7 | C9 | C8 | H12 | 120.6° | 120.3° |
| C7 | C9 | C12 | H12 | 119.7° | 119.6° |
| C9 | C7 | C11 | H9 | 117.3° | 119.8° |
| C9 | C7 | C11 | C14 | 51.4° | 55.2° |
| C7 | C9 | C12 | C13 | 57.6° | 64.4° |
| C7 | C9 | C12 | C17 | 178.3° | 177.4° |
| C7 | C9 | C8 | H10 | 177.1° | 179.7° |
| C7 | C9 | C8 | H11 | 57.2° | 59.6° |
| C9 | C7 | C11 | H15 | 171.6° | 175.7° |
| C9 | C7 | C11 | H16 | 68.7° | 65.3° |
| C7 | C9 | C12 | H17 | 60.3° | 56.1° |
| C8 | C9 | C12 | H12 | 120.7° | 121.5° |
| C8 | C9 | C7 | C11 | 169.3° | 178.0° |
| C8 | C9 | C12 | C13 | 177.2° | 176.7° |
| C8 | C9 | C12 | C17 | 62.1° | 63.8° |
| C9 | C8 | C6 | H7 | 61.8° | 60.0° |
| C9 | C8 | C6 | H8 | 178.7° | 180.0° |
| C8 | C9 | C7 | H9 | 52.2° | 58.1° |
| C9 | C8 | H10 | H11 | 120.0° | 120.0° |
| C8 | C9 | C12 | H17 | 59.3° | 62.8° |
| C12 | C9 | C7 | C11 | 50.3° | 58.3° |
| C9 | C12 | C13 | C17 | 128.7° | 122.0° |
| C9 | C12 | C13 | H17 | 118.1° | 120.3° |
| C9 | C12 | C13 | C14 | 63.9° | 69.5° |
| C9 | C12 | C13 | C16 | 173.5° | 165.7° |
| C9 | C12 | C17 | H17 | 121.4° | 126.5° |
| C9 | C12 | C17 | C18 | 162.4° | 155.2° |
| C12 | C9 | C7 | H9 | 66.8° | 61.5° |
| C12 | C9 | C8 | H10 | 58.4° | 61.9° |
| C12 | C9 | C8 | H11 | 61.6° | 58.1° |
| C9 | C12 | C17 | H23 | 85.1° | 85.8° |
| C10 | C1 | C3 | H1 | 120.2° | 120.0° |
| C10 | C1 | C3 | H2 | 120.2° | 120.0° |
| C10 | C1 | C3 | C2 | 60.8° | 60.0° |
| C10 | C1 | C3 | O25 | 179.8° | 180.0° |
| C10 | C1 | H1 | H2 | 119.4° | 120.0° |
| C10 | C1 | C3 | H5 | 60.3° | 60.1° |
| C1 | C10 | H13 | H14 | 119.3° | 120.0° |
| C4 | C2 | C3 | C1 | 58.8° | 60.0° |
| C4 | C2 | C3 | H3 | 120.0° | 120.0° |
| C4 | C2 | C3 | H4 | 120.0° | 119.9° |
| C4 | C2 | C3 | O25 | 177.0° | 180.0° |
| C4 | C2 | H3 | H4 | 119.9° | 120.1° |
| C4 | C2 | C3 | H5 | 62.4° | 60.1° |
| C2 | C4 | C6 | H7 | 168.2° | 180.0° |
| C2 | C4 | C6 | H8 | 48.7° | 59.9° |
| C7 | C11 | C14 | H15 | 120.2° | 120.5° |
| C7 | C11 | C14 | H16 | 120.2° | 120.5° |
| C7 | C11 | C14 | C13 | 59.0° | 57.7° |
| C11 | C7 | C9 | H12 | 69.8° | 61.8° |
| C7 | C11 | H15 | H16 | 119.5° | 119.1° |
| C7 | C11 | C14 | H18 | 61.3° | 62.1° |
| C7 | C11 | C14 | H19 | 179.3° | 176.7° |
| C11 | C14 | C13 | C12 | 63.0° | 64.1° |
| C11 | C14 | C13 | H18 | 120.3° | 119.7° |
| C11 | C14 | C13 | H19 | 120.3° | 119.3° |
| C11 | C14 | C13 | C16 | 173.1° | 179.6° |
| C14 | C11 | C7 | H9 | 65.9° | 64.6° |
| C14 | C11 | H15 | H16 | 119.5° | 119.1° |
| C11 | C14 | H18 | H19 | 119.1° | 121.1° |
| C12 | C13 | C14 | C16 | 110.0° | 116.3° |
| C13 | C12 | C17 | H17 | 113.0° | 117.7° |
| C13 | C12 | C17 | C18 | 36.8° | 39.5° |
| C12 | C13 | C16 | C18 | 35.7° | 29.6° |
| C12 | C13 | C16 | O16 | 148.3° | 150.3° |
| C13 | C12 | C9 | H12 | 62.1° | 55.2° |
| C12 | C13 | C14 | H18 | 57.3° | 55.6° |
| C12 | C13 | C14 | H19 | 176.7° | 176.5° |
| C12 | C13 | C15 | H20 | 180.0° | 83.6° |
| C12 | C13 | C15 | H21 | 60.0° | 156.5° |
| C12 | C13 | C15 | H22 | 60.0° | 36.5° |
| C13 | C12 | C17 | H23 | 149.3° | 158.4° |
| C14 | C13 | C12 | C17 | 167.4° | 168.5° |
| C14 | C13 | C16 | C18 | 149.9° | 148.2° |
| C14 | C13 | C16 | O16 | 34.0° | 31.8° |
| C13 | C14 | C11 | H15 | 179.2° | 178.2° |
| C13 | C14 | C11 | H16 | 61.2° | 62.8° |
| C14 | C13 | C12 | H17 | 54.2° | 50.9° |
| C13 | C14 | H18 | H19 | 119.1° | 120.6° |
| C14 | C13 | C15 | H20 | 59.0° | 158.5° |
| C14 | C13 | C15 | H21 | 61.0° | 38.6° |
| C14 | C13 | C15 | H22 | 179.0° | 81.4° |
| C16 | C13 | C12 | C17 | 44.8° | 43.7° |
| C13 | C16 | C18 | C17 | 13.1° | 4.8° |
| C13 | C16 | C18 | O16 | 176.1° | 179.9° |
| C16 | C13 | C12 | H17 | 68.4° | 74.0° |
| C16 | C13 | C14 | H18 | 52.7° | 60.7° |
| C16 | C13 | C14 | H19 | 66.6° | 60.2° |
| C16 | C13 | C15 | H20 | 70.1° | 29.3° |
| C16 | C13 | C15 | H21 | 169.9° | 90.7° |
| C16 | C13 | C15 | H22 | 49.9° | 149.3° |
| C13 | C16 | C18 | H24 | 106.4° | 123.6° |
| C13 | C16 | C18 | H25 | 132.7° | 115.3° |
| C12 | C17 | C18 | H23 | 112.9° | 118.4° |
| C12 | C17 | C18 | C16 | 15.8° | 22.0° |
| C17 | C12 | C9 | H12 | 58.6° | 57.8° |
| C12 | C17 | C18 | H24 | 135.4° | 95.9° |
| C12 | C17 | C18 | H25 | 103.7° | 142.8° |
| C12 | C17 | C23 | H26 | 180.0° | 35.2° |
| C12 | C17 | C23 | H27 | 60.0° | 155.3° |
| C12 | C17 | C23 | H28 | 60.0° | 84.7° |
| C17 | C18 | C16 | H24 | 119.5° | 118.8° |
| C17 | C18 | C16 | H25 | 119.6° | 120.1° |
| C17 | C18 | C16 | O16 | 170.7° | 175.1° |
| C18 | C17 | C12 | H17 | 76.1° | 78.3° |
| C17 | C18 | H24 | H25 | 121.3° | 121.4° |
| C18 | C17 | C23 | H26 | 62.7° | 147.5° |
| C18 | C17 | C23 | H27 | 57.3° | 92.5° |
| C18 | C17 | C23 | H28 | 177.3° | 27.6° |
| C16 | C18 | C17 | H23 | 128.7° | 140.4° |
| C16 | C18 | H24 | H25 | 121.3° | 121.7° |
| O16 | C16 | C18 | H24 | 69.7° | 56.3° |
| O16 | C16 | C18 | H25 | 51.2° | 64.7° |
| C1 | C3 | C2 | O25 | 118.2° | 120.0° |
| C1 | C3 | C2 | H5 | 121.2° | 120.1° |
| C1 | C3 | O25 | H5 | 119.6° | 120.0° |
| C1 | C3 | O25 | S22 | 137.1° | 95.0° |
| C3 | C1 | H1 | H2 | 119.4° | 120.0° |
| C1 | C3 | C2 | H3 | 61.2° | 180.0° |
| C1 | C3 | C2 | H4 | 178.8° | 59.9° |
| C3 | C1 | C10 | H13 | 61.4° | 179.9° |
| C3 | C1 | C10 | H14 | 179.1° | 59.9° |
| C2 | C3 | O25 | H5 | 120.0° | 119.9° |
| C2 | C3 | O25 | S22 | 102.5° | 145.0° |
| C2 | C3 | C1 | H1 | 178.9° | 60.0° |
| C2 | C3 | C1 | H2 | 59.4° | 180.0° |
| C3 | C2 | H3 | H4 | 119.9° | 120.0° |
| C3 | C2 | C4 | H6 | 62.2° | 60.0° |
| C3 | O25 | S22 | N19 | 59.6° | 75.0° |
| C3 | O25 | S22 | O20 | 61.5° | 171.5° |
| C3 | O25 | S22 | O21 | 176.7° | 38.6° |
| O25 | C3 | C1 | H1 | 60.0° | 60.0° |
| O25 | C3 | C1 | H2 | 59.5° | 60.1° |
| O25 | C3 | C2 | H3 | 57.0° | 60.0° |
| O25 | C3 | C2 | H4 | 62.9° | 60.1° |
| N19 | S22 | O25 | O20 | 121.1° | 113.5° |
| N19 | S22 | O25 | O21 | 117.0° | 113.6° |
| N19 | S22 | O20 | O21 | 130.4° | 122.9° |
| S22 | N19 | H32 | H33 | 120.0° | 180.0° |
| O25 | S22 | O20 | O21 | 111.5° | 122.9° |
| S22 | O25 | C3 | H5 | 17.5° | 25.0° |
| O25 | S22 | N19 | H32 | 180.0° | 0.0° |
| O25 | S22 | N19 | H33 | 60.0° | 180.0° |
| O20 | S22 | N19 | H32 | 61.7° | 113.6° |
| O20 | S22 | N19 | H33 | 58.3° | 66.5° |
| O21 | S22 | N19 | H32 | 70.8° | 113.6° |
| O21 | S22 | N19 | H33 | 169.2° | 66.4° |
| H1 | C1 | C3 | H5 | 60.0° | 180.0° |
| H1 | C1 | C10 | H13 | 58.8° | 60.1° |
| H1 | C1 | C10 | H14 | 60.7° | 179.9° |
| H2 | C1 | C3 | H5 | 179.5° | 59.9° |
| H2 | C1 | C10 | H13 | 178.4° | 60.0° |
| H2 | C1 | C10 | H14 | 58.9° | 60.1° |
| H3 | C2 | C3 | H5 | 177.6° | 59.9° |
| H3 | C2 | C4 | H6 | 177.8° | 60.0° |
| H4 | C2 | C3 | H5 | 57.6° | 180.0° |
| H4 | C2 | C4 | H6 | 57.9° | 179.9° |
| H6 | C4 | C6 | H7 | 50.5° | 60.0° |
| H6 | C4 | C6 | H8 | 68.9° | 60.1° |
| H7 | C6 | C8 | H10 | 58.2° | 60.0° |
| H7 | C6 | C8 | H11 | 178.2° | 180.0° |
| H8 | C6 | C8 | H10 | 61.2° | 59.9° |
| H8 | C6 | C8 | H11 | 58.7° | 60.1° |
| H9 | C7 | C9 | H12 | 173.1° | 178.4° |
| H9 | C7 | C11 | H15 | 54.3° | 55.9° |
| H9 | C7 | C11 | H16 | 174.0° | 174.9° |
| H10 | C8 | C9 | H12 | 62.3° | 60.1° |
| H11 | C8 | C9 | H12 | 177.7° | 179.9° |
| H12 | C9 | C12 | H17 | 180.0° | 175.7° |
| H15 | C11 | C14 | H18 | 58.9° | 58.4° |
| H15 | C11 | C14 | H19 | 60.5° | 62.8° |
| H16 | C11 | C14 | H18 | 178.5° | 177.4° |
| H16 | C11 | C14 | H19 | 59.1° | 56.2° |
| H17 | C12 | C17 | H23 | 36.3° | 40.7° |
| H20 | C15 | H21 | H22 | 120.0° | 120.0° |
| H23 | C17 | C18 | H24 | 111.7° | 22.5° |
| H23 | C17 | C18 | H25 | 9.2° | 98.8° |
| H23 | C17 | C23 | H26 | 59.1° | 88.2° |
| H23 | C17 | C23 | H27 | 179.2° | 31.8° |
| H23 | C17 | C23 | H28 | 60.9° | 151.8° |
| H26 | C23 | H27 | H28 | 120.1° | 120.0° |
| H29 | C | H30 | H31 | 120.0° | 119.9° |
