4YW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O29 | S27 | doub | 1.42Å | 1.42Å | |
| C23 | C22 | sing | 1.53Å | 1.53Å | |
| C23 | C24 | sing | 1.53Å | 1.53Å | |
| C22 | N21 | sing | 1.47Å | 1.49Å | |
| S27 | C30 | sing | 1.81Å | 1.82Å | |
| S27 | C24 | sing | 1.81Å | 1.82Å | |
| S27 | O28 | doub | 1.42Å | 1.42Å | |
| C24 | C25 | sing | 1.53Å | 1.54Å | |
| N18 | C17 | doub | 1.32Å | 1.33Å | Aromatic |
| N18 | C19 | sing | 1.32Å | 1.34Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.38Å | Aromatic |
| N21 | C19 | sing | 1.38Å | 1.40Å | |
| N21 | C26 | sing | 1.47Å | 1.49Å | |
| C19 | N20 | doub | 1.32Å | 1.34Å | Aromatic |
| C16 | C15 | doub | 1.40Å | 1.40Å | Aromatic |
| C25 | C26 | sing | 1.53Å | 1.54Å | |
| N20 | C15 | sing | 1.33Å | 1.34Å | Aromatic |
| C15 | N14 | sing | 1.39Å | 1.39Å | |
| N14 | C7 | sing | 1.39Å | 1.41Å | |
| C7 | C8 | doub | 1.39Å | 1.40Å | Aromatic |
| C7 | N6 | sing | 1.33Å | 1.34Å | Aromatic |
| C8 | C9 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.53Å | 1.53Å | |
| C11 | C13 | sing | 1.53Å | 1.53Å | |
| C11 | N10 | sing | 1.47Å | 1.48Å | |
| N6 | C5 | doub | 1.32Å | 1.33Å | Aromatic |
| C9 | N10 | sing | 1.38Å | 1.38Å | Aromatic |
| C9 | C4 | doub | 1.41Å | 1.42Å | Aromatic |
| N10 | C2 | sing | 1.36Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.40Å | Aromatic |
| C4 | N3 | sing | 1.36Å | 1.36Å | Aromatic |
| C2 | N3 | doub | 1.30Å | 1.30Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.51Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C8 | H3 | sing | 1.08Å | 1.08Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C1 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| N14 | H13 | sing | 0.97Å | 1.00Å | |
| C16 | H14 | sing | 1.08Å | 1.08Å | |
| C17 | H15 | sing | 1.08Å | 1.08Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | 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 | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C26 | H24 | sing | 1.09Å | 1.10Å | |
| C30 | H25 | sing | 1.09Å | 1.10Å | |
| C30 | H26 | sing | 1.09Å | 1.10Å | |
| C30 | H27 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O29 | S27 | C30 | 108.9° | 108.6° |
| O29 | S27 | C24 | 106.3° | 108.6° |
| O29 | S27 | O28 | 118.4° | 119.2° |
| C22 | C23 | C24 | 105.6° | 109.3° |
| C23 | C22 | N21 | 114.0° | 109.5° |
| C23 | C22 | H16 | 108.3° | 109.4° |
| C23 | C22 | H17 | 108.3° | 109.4° |
| C22 | C23 | H18 | 110.4° | 109.5° |
| C22 | C23 | H19 | 110.4° | 109.5° |
| C23 | C24 | S27 | 114.6° | 109.5° |
| C23 | C24 | C25 | 109.7° | 109.2° |
| C24 | C23 | H18 | 110.5° | 109.6° |
| C24 | C23 | H19 | 110.4° | 109.5° |
| C23 | C24 | H20 | 105.2° | 109.6° |
| C22 | N21 | C19 | 111.3° | 111.0° |
| C22 | N21 | C26 | 118.8° | 111.2° |
| N21 | C22 | H16 | 108.3° | 109.5° |
| N21 | C22 | H17 | 108.3° | 109.5° |
| C30 | S27 | C24 | 106.7° | 101.9° |
| C30 | S27 | O28 | 107.1° | 108.6° |
| S27 | C30 | H25 | 109.5° | 109.5° |
| S27 | C30 | H26 | 109.5° | 109.5° |
| S27 | C30 | H27 | 109.4° | 109.5° |
| C24 | S27 | O28 | 109.0° | 108.6° |
| S27 | C24 | C25 | 117.8° | 109.5° |
| S27 | C24 | H20 | 102.8° | 109.6° |
| C24 | C25 | C26 | 107.6° | 109.3° |
| C25 | C24 | H20 | 105.2° | 109.5° |
| C24 | C25 | H21 | 109.9° | 109.5° |
| C24 | C25 | H22 | 109.9° | 109.5° |
| C17 | N18 | C19 | 122.0° | 120.9° |
| N18 | C17 | C16 | 119.2° | 119.3° |
| N18 | C17 | H15 | 120.4° | 120.4° |
| N18 | C19 | N21 | 120.0° | 119.2° |
| N18 | C19 | N20 | 119.7° | 121.7° |
| C17 | C16 | C15 | 118.7° | 118.4° |
| C17 | C16 | H14 | 120.7° | 120.8° |
| C16 | C17 | H15 | 120.4° | 120.3° |
| C19 | N21 | C26 | 112.9° | 111.0° |
| N21 | C19 | N20 | 120.3° | 119.2° |
| N21 | C26 | C25 | 115.2° | 109.5° |
| N21 | C26 | H23 | 108.0° | 109.5° |
| N21 | C26 | H24 | 108.0° | 109.5° |
| C19 | N20 | C15 | 122.0° | 120.6° |
| C16 | C15 | N20 | 118.4° | 119.1° |
| C16 | C15 | N14 | 119.3° | 120.4° |
| C15 | C16 | H14 | 120.7° | 120.8° |
| C26 | C25 | H21 | 109.9° | 109.5° |
| C26 | C25 | H22 | 109.9° | 109.5° |
| C25 | C26 | H23 | 108.0° | 109.5° |
| C25 | C26 | H24 | 108.0° | 109.5° |
| N20 | C15 | N14 | 122.3° | 120.5° |
| C15 | N14 | C7 | 127.4° | 120.0° |
| C15 | N14 | H13 | 116.3° | 120.1° |
| N14 | C7 | C8 | 123.0° | 119.5° |
| N14 | C7 | N6 | 117.2° | 119.5° |
| C7 | N14 | H13 | 116.3° | 120.0° |
| C8 | C7 | N6 | 119.8° | 121.1° |
| C7 | C8 | C9 | 119.6° | 118.8° |
| C7 | C8 | H3 | 120.2° | 120.6° |
| C7 | N6 | C5 | 123.0° | 122.3° |
| C8 | C9 | N10 | 135.3° | 135.2° |
| C8 | C9 | C4 | 118.3° | 118.7° |
| C9 | C8 | H3 | 120.2° | 120.6° |
| C12 | C11 | C13 | 113.8° | 109.5° |
| C12 | C11 | N10 | 114.6° | 109.5° |
| C12 | C11 | H2 | 104.1° | 109.5° |
| C11 | C12 | H4 | 109.5° | 109.5° |
| C11 | C12 | H5 | 109.4° | 109.4° |
| C11 | C12 | H6 | 109.5° | 109.4° |
| C13 | C11 | N10 | 113.8° | 109.5° |
| C13 | C11 | H2 | 104.2° | 109.5° |
| C11 | C13 | H7 | 109.5° | 109.5° |
| C11 | C13 | H8 | 109.5° | 109.5° |
| C11 | C13 | H9 | 109.5° | 109.5° |
| C11 | N10 | C9 | 122.4° | 126.3° |
| C11 | N10 | C2 | 131.0° | 126.3° |
| N10 | C11 | H2 | 104.7° | 109.5° |
| N6 | C5 | C4 | 120.5° | 120.4° |
| N6 | C5 | H1 | 119.8° | 119.8° |
| N10 | C9 | C4 | 106.4° | 106.1° |
| C9 | N10 | C2 | 106.6° | 107.3° |
| C9 | C4 | C5 | 118.8° | 118.8° |
| C9 | C4 | N3 | 106.8° | 106.8° |
| N10 | C2 | N3 | 109.8° | 110.2° |
| N10 | C2 | C1 | 129.0° | 124.9° |
| C5 | C4 | N3 | 134.4° | 134.4° |
| C4 | C5 | H1 | 119.8° | 119.8° |
| C4 | N3 | C2 | 110.3° | 109.6° |
| N3 | C2 | C1 | 121.1° | 124.9° |
| C2 | C1 | H10 | 109.5° | 109.5° |
| C2 | C1 | H11 | 109.4° | 109.5° |
| C2 | C1 | H12 | 109.5° | 109.5° |
| H4 | C12 | H5 | 109.5° | 109.5° |
| H4 | C12 | H6 | 109.5° | 109.5° |
| H5 | C12 | H6 | 109.5° | 109.4° |
| H7 | C13 | H8 | 109.5° | 109.4° |
| H7 | C13 | H9 | 109.5° | 109.5° |
| H8 | C13 | H9 | 109.5° | 109.5° |
| H10 | C1 | H11 | 109.5° | 109.5° |
| H10 | C1 | H12 | 109.5° | 109.5° |
| H11 | C1 | H12 | 109.5° | 109.4° |
| H16 | C22 | H17 | 109.5° | 109.5° |
| H18 | C23 | H19 | 109.4° | 109.5° |
| H21 | C25 | H22 | 109.5° | 109.5° |
| H23 | C26 | H24 | 109.5° | 109.4° |
| H25 | C30 | H26 | 109.4° | 109.4° |
| H25 | C30 | H27 | 109.5° | 109.4° |
| H26 | C30 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O29 | S27 | C24 | C23 | 23.9° | 70.5° |
| O29 | S27 | C30 | C24 | 114.3° | 114.5° |
| O29 | S27 | C30 | O28 | 129.0° | 131.0° |
| O29 | S27 | C24 | O28 | 128.6° | 131.0° |
| O29 | S27 | C24 | C25 | 155.3° | 169.8° |
| O29 | S27 | C24 | H20 | 89.7° | 49.7° |
| O29 | S27 | C30 | H25 | 180.0° | 174.5° |
| O29 | S27 | C30 | H26 | 60.0° | 65.5° |
| O29 | S27 | C30 | H27 | 60.0° | 54.6° |
| C22 | C23 | C24 | H18 | 119.4° | 119.9° |
| C22 | C23 | C24 | H19 | 119.4° | 119.9° |
| C23 | C22 | N21 | H16 | 120.7° | 120.0° |
| C23 | C22 | N21 | H17 | 120.7° | 119.9° |
| C22 | C23 | C24 | S27 | 155.9° | 177.5° |
| C22 | C23 | C24 | C25 | 68.9° | 57.6° |
| C23 | C22 | N21 | C19 | 170.9° | 174.2° |
| C23 | C22 | N21 | C26 | 37.2° | 61.7° |
| C23 | C22 | H16 | H17 | 117.9° | 119.9° |
| C22 | C23 | H18 | H19 | 121.8° | 120.0° |
| C22 | C23 | C24 | H20 | 43.7° | 62.2° |
| C24 | C23 | C22 | N21 | 53.0° | 59.2° |
| C23 | C24 | S27 | C30 | 139.9° | 175.0° |
| C23 | C24 | S27 | C25 | 131.4° | 119.7° |
| C23 | C24 | S27 | H20 | 113.6° | 120.2° |
| C23 | C24 | S27 | O28 | 104.8° | 60.5° |
| C23 | C24 | C25 | H20 | 112.7° | 119.9° |
| C23 | C24 | C25 | C26 | 65.1° | 57.7° |
| C24 | C23 | C22 | H16 | 67.7° | 179.2° |
| C24 | C23 | C22 | H17 | 173.6° | 60.8° |
| C24 | C23 | H18 | H19 | 121.8° | 120.1° |
| C23 | C24 | C25 | H21 | 54.6° | 62.3° |
| C23 | C24 | C25 | H22 | 175.2° | 177.6° |
| C22 | N21 | C19 | N18 | 43.9° | 124.2° |
| C22 | N21 | C19 | C26 | 136.5° | 124.2° |
| C22 | N21 | C19 | N20 | 138.0° | 56.1° |
| C22 | N21 | C26 | C25 | 33.0° | 61.8° |
| N21 | C22 | H16 | H17 | 117.9° | 120.1° |
| N21 | C22 | C23 | H18 | 66.4° | 60.8° |
| N21 | C22 | C23 | H19 | 172.4° | 179.1° |
| C22 | N21 | C26 | H23 | 87.9° | 58.3° |
| C22 | N21 | C26 | H24 | 153.8° | 178.2° |
| C30 | S27 | C24 | O28 | 115.3° | 114.5° |
| C30 | S27 | C24 | C25 | 88.7° | 55.3° |
| C30 | S27 | C24 | H20 | 26.3° | 64.8° |
| S27 | C30 | H25 | H26 | 120.0° | 120.0° |
| S27 | C30 | H25 | H27 | 120.0° | 120.0° |
| S27 | C30 | H26 | H27 | 120.0° | 120.1° |
| S27 | C24 | C25 | H20 | 113.7° | 120.2° |
| S27 | C24 | C25 | C26 | 161.3° | 177.6° |
| S27 | C24 | C23 | H18 | 84.7° | 57.6° |
| S27 | C24 | C23 | H19 | 36.5° | 62.5° |
| S27 | C24 | C25 | H21 | 79.0° | 57.6° |
| S27 | C24 | C25 | H22 | 41.6° | 62.5° |
| C24 | S27 | C30 | H25 | 65.7° | 60.0° |
| C24 | S27 | C30 | H26 | 174.4° | 180.0° |
| C24 | S27 | C30 | H27 | 54.3° | 60.0° |
| O28 | S27 | C24 | C25 | 26.6° | 59.2° |
| O28 | S27 | C24 | H20 | 141.6° | 179.3° |
| O28 | S27 | C30 | H25 | 50.9° | 54.5° |
| O28 | S27 | C30 | H26 | 69.0° | 65.5° |
| O28 | S27 | C30 | H27 | 171.0° | 174.5° |
| C24 | C25 | C26 | N21 | 45.0° | 59.2° |
| C24 | C25 | C26 | H21 | 119.7° | 119.9° |
| C24 | C25 | C26 | H22 | 119.7° | 119.9° |
| C25 | C24 | C23 | H18 | 50.5° | 62.3° |
| C25 | C24 | C23 | H19 | 171.7° | 177.6° |
| C24 | C25 | H21 | H22 | 120.9° | 120.1° |
| C24 | C25 | C26 | H23 | 75.8° | 60.9° |
| C24 | C25 | C26 | H24 | 165.9° | 179.2° |
| N18 | C17 | C16 | H15 | 180.0° | 180.0° |
| C17 | N18 | C19 | N21 | 178.4° | 180.0° |
| C17 | N18 | C19 | N20 | 0.3° | 0.3° |
| N18 | C17 | C16 | C15 | 1.0° | 0.0° |
| N18 | C17 | C16 | H14 | 179.0° | 179.9° |
| C19 | N18 | C17 | C16 | 1.3° | 0.0° |
| N18 | C19 | N21 | N20 | 178.1° | 179.7° |
| N18 | C19 | N21 | C26 | 179.5° | 0.0° |
| N18 | C19 | N20 | C15 | 1.1° | 0.6° |
| C19 | N18 | C17 | H15 | 178.7° | 180.0° |
| C17 | C16 | C15 | H14 | 180.0° | 179.9° |
| C17 | C16 | C15 | N20 | 0.3° | 0.2° |
| C17 | C16 | C15 | N14 | 179.5° | 180.0° |
| C19 | N21 | C26 | C25 | 166.0° | 174.1° |
| N21 | C19 | N20 | C15 | 177.0° | 179.7° |
| C19 | N21 | C22 | H16 | 50.2° | 54.2° |
| C19 | N21 | C22 | H17 | 68.5° | 65.9° |
| C19 | N21 | C26 | H23 | 45.2° | 65.8° |
| C19 | N21 | C26 | H24 | 73.2° | 54.1° |
| C26 | N21 | C19 | N20 | 1.5° | 179.7° |
| N21 | C26 | C25 | H23 | 120.8° | 120.0° |
| N21 | C26 | C25 | H24 | 120.8° | 120.1° |
| C26 | N21 | C22 | H16 | 83.5° | 178.3° |
| C26 | N21 | C22 | H17 | 157.9° | 58.2° |
| N21 | C26 | C25 | H21 | 74.7° | 60.8° |
| N21 | C26 | C25 | H22 | 164.7° | 179.1° |
| N21 | C26 | H23 | H24 | 117.4° | 120.0° |
| C19 | N20 | C15 | C16 | 1.4° | 0.5° |
| C19 | N20 | C15 | N14 | 179.5° | 179.7° |
| C16 | C15 | N20 | N14 | 179.2° | 179.8° |
| C16 | C15 | N14 | C7 | 156.6° | 174.4° |
| C16 | C15 | N14 | H13 | 23.3° | 5.6° |
| C15 | C16 | C17 | H15 | 179.0° | 180.0° |
| C26 | C25 | C24 | H20 | 47.6° | 62.3° |
| C26 | C25 | H21 | H22 | 120.9° | 120.1° |
| C25 | C26 | H23 | H24 | 117.4° | 119.9° |
| N20 | C15 | N14 | C7 | 24.2° | 5.4° |
| N20 | C15 | N14 | H13 | 155.8° | 174.6° |
| N20 | C15 | C16 | H14 | 179.7° | 179.7° |
| C15 | N14 | C7 | H13 | 180.0° | 180.0° |
| C15 | N14 | C7 | C8 | 19.4° | 174.4° |
| C15 | N14 | C7 | N6 | 163.2° | 5.1° |
| N14 | C15 | C16 | H14 | 0.5° | 0.1° |
| N14 | C7 | C8 | N6 | 177.2° | 179.5° |
| N14 | C7 | C8 | C9 | 178.9° | 180.0° |
| N14 | C7 | N6 | C5 | 178.9° | 179.9° |
| N14 | C7 | C8 | H3 | 1.1° | 0.5° |
| C7 | C8 | C9 | H3 | 180.0° | 179.5° |
| C8 | C7 | N6 | C5 | 1.5° | 0.5° |
| C7 | C8 | C9 | N10 | 179.5° | 179.8° |
| C7 | C8 | C9 | C4 | 0.7° | 0.1° |
| C8 | C7 | N14 | H13 | 160.6° | 5.7° |
| N6 | C7 | C8 | C9 | 1.7° | 0.5° |
| C7 | N6 | C5 | C4 | 0.2° | 0.0° |
| C7 | N6 | C5 | H1 | 179.8° | 180.0° |
| N6 | C7 | C8 | H3 | 178.3° | 180.0° |
| N6 | C7 | N14 | H13 | 16.7° | 174.9° |
| C8 | C9 | N10 | C11 | 0.1° | 0.1° |
| C8 | C9 | N10 | C4 | 179.8° | 179.9° |
| C8 | C9 | N10 | C2 | 179.6° | 179.7° |
| C8 | C9 | C4 | C5 | 0.6° | 0.3° |
| C8 | C9 | C4 | N3 | 179.9° | 179.9° |
| C12 | C11 | C13 | N10 | 133.9° | 120.0° |
| C12 | C11 | C13 | H2 | 112.7° | 120.0° |
| C12 | C11 | N10 | H2 | 113.4° | 120.0° |
| C12 | C11 | N10 | C9 | 115.2° | 63.9° |
| C12 | C11 | N10 | C2 | 64.2° | 115.8° |
| C11 | C12 | H4 | H5 | 120.0° | 120.0° |
| C11 | C12 | H4 | H6 | 120.0° | 120.0° |
| C11 | C12 | H5 | H6 | 120.0° | 119.9° |
| C12 | C11 | C13 | H7 | 180.0° | 60.0° |
| C12 | C11 | C13 | H8 | 60.0° | 180.0° |
| C12 | C11 | C13 | H9 | 60.0° | 60.0° |
| C13 | C11 | N10 | H2 | 113.1° | 120.0° |
| C13 | C11 | N10 | C9 | 111.3° | 56.1° |
| C13 | C11 | N10 | C2 | 69.3° | 124.1° |
| C13 | C11 | C12 | H4 | 180.0° | 65.0° |
| C13 | C11 | C12 | H5 | 60.0° | 174.9° |
| C13 | C11 | C12 | H6 | 60.0° | 55.0° |
| C11 | C13 | H7 | H8 | 120.0° | 120.0° |
| C11 | C13 | H7 | H9 | 120.0° | 120.0° |
| C11 | C13 | H8 | H9 | 120.0° | 120.0° |
| C11 | N10 | C9 | C2 | 179.5° | 179.8° |
| C11 | N10 | C9 | C4 | 179.7° | 180.0° |
| C11 | N10 | C2 | N3 | 179.9° | 179.8° |
| C11 | N10 | C2 | C1 | 0.2° | 0.2° |
| N10 | C11 | C12 | H4 | 46.5° | 175.0° |
| N10 | C11 | C12 | H5 | 73.5° | 54.9° |
| N10 | C11 | C12 | H6 | 166.5° | 65.0° |
| N10 | C11 | C13 | H7 | 46.2° | 60.0° |
| N10 | C11 | C13 | H8 | 166.2° | 60.0° |
| N10 | C11 | C13 | H9 | 73.8° | 180.0° |
| N6 | C5 | C4 | C9 | 0.8° | 0.4° |
| N6 | C5 | C4 | H1 | 180.0° | 180.0° |
| N6 | C5 | C4 | N3 | 180.0° | 180.0° |
| N10 | C9 | C4 | C5 | 179.3° | 179.8° |
| N10 | C9 | C4 | N3 | 0.1° | 0.0° |
| C9 | N10 | C2 | N3 | 0.4° | 0.4° |
| C9 | N10 | C2 | C1 | 179.3° | 180.0° |
| C9 | N10 | C11 | H2 | 1.8° | 176.1° |
| N10 | C9 | C8 | H3 | 0.4° | 0.2° |
| C4 | C9 | N10 | C2 | 0.2° | 0.2° |
| C9 | C4 | C5 | N3 | 179.2° | 179.7° |
| C9 | C4 | N3 | C2 | 0.3° | 0.3° |
| C9 | C4 | C5 | H1 | 179.2° | 179.6° |
| C4 | C9 | C8 | H3 | 179.3° | 179.6° |
| N10 | C2 | N3 | C4 | 0.4° | 0.4° |
| N10 | C2 | N3 | C1 | 179.7° | 179.6° |
| C2 | N10 | C11 | H2 | 177.6° | 4.2° |
| N10 | C2 | C1 | H10 | 179.7° | 95.3° |
| N10 | C2 | C1 | H11 | 60.4° | 24.8° |
| N10 | C2 | C1 | H12 | 59.6° | 144.7° |
| C5 | C4 | N3 | C2 | 178.9° | 180.0° |
| C4 | N3 | C2 | C1 | 179.3° | 180.0° |
| N3 | C4 | C5 | H1 | 0.0° | 0.0° |
| N3 | C2 | C1 | H10 | 0.0° | 85.2° |
| N3 | C2 | C1 | H11 | 120.0° | 154.8° |
| N3 | C2 | C1 | H12 | 120.0° | 34.9° |
| C2 | C1 | H10 | H11 | 120.0° | 120.0° |
| C2 | C1 | H10 | H12 | 120.0° | 120.0° |
| C2 | C1 | H11 | H12 | 120.0° | 119.9° |
| H2 | C11 | C12 | H4 | 67.3° | 55.0° |
| H2 | C11 | C12 | H5 | 172.8° | 65.1° |
| H2 | C11 | C12 | H6 | 52.8° | 175.0° |
| H2 | C11 | C13 | H7 | 67.2° | 180.0° |
| H2 | C11 | C13 | H8 | 52.8° | 60.0° |
| H2 | C11 | C13 | H9 | 172.8° | 60.0° |
| H4 | C12 | H5 | H6 | 120.0° | 120.1° |
| H7 | C13 | H8 | H9 | 120.0° | 120.0° |
| H10 | C1 | H11 | H12 | 120.0° | 120.0° |
| H14 | C16 | C17 | H15 | 1.0° | 0.1° |
| H16 | C22 | C23 | H18 | 172.9° | 59.2° |
| H16 | C22 | C23 | H19 | 51.7° | 60.8° |
| H17 | C22 | C23 | H18 | 54.2° | 179.2° |
| H17 | C22 | C23 | H19 | 66.9° | 59.1° |
| H18 | C23 | C24 | H20 | 163.1° | 177.8° |
| H19 | C23 | C24 | H20 | 75.7° | 57.7° |
| H20 | C24 | C25 | H21 | 167.3° | 177.8° |
| H20 | C24 | C25 | H22 | 72.1° | 57.7° |
| H21 | C25 | C26 | H23 | 164.5° | 179.2° |
| H21 | C25 | C26 | H24 | 46.2° | 59.3° |
| H22 | C25 | C26 | H23 | 43.9° | 59.1° |
| H22 | C25 | C26 | H24 | 74.4° | 60.8° |
| H25 | C30 | H26 | H27 | 120.0° | 119.9° |
