74S
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | N05 | sing | 1.47Å | 1.57Å | |
| C10 | C11 | sing | 1.53Å | 1.57Å | |
| C13 | C12 | doub | 1.38Å | 1.41Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.41Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C22 | doub | 1.35Å | 1.31Å | Aromatic |
| C21 | C23 | sing | 1.51Å | 1.55Å | |
| C21 | N20 | sing | 1.34Å | 1.32Å | Aromatic |
| C22 | N18 | sing | 1.35Å | 1.33Å | Aromatic |
| C26 | C32 | doub | 1.39Å | 1.35Å | Aromatic |
| C26 | C25 | sing | 1.40Å | 1.35Å | Aromatic |
| C26 | C27 | sing | 1.47Å | 1.34Å | Aromatic |
| C28 | C27 | doub | 1.40Å | 1.34Å | Aromatic |
| C28 | C36 | sing | 1.39Å | 1.34Å | Aromatic |
| C28 | N24 | sing | 1.38Å | 1.34Å | Aromatic |
| C32 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | C30 | doub | 1.39Å | 1.39Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C25 | doub | 1.39Å | 1.34Å | Aromatic |
| C25 | N24 | sing | 1.38Å | 1.35Å | Aromatic |
| C27 | C33 | sing | 1.39Å | 1.35Å | Aromatic |
| C33 | C34 | doub | 1.38Å | 1.40Å | Aromatic |
| C34 | C35 | sing | 1.39Å | 1.38Å | Aromatic |
| C35 | C36 | doub | 1.38Å | 1.40Å | Aromatic |
| N24 | C23 | sing | 1.47Å | 1.50Å | |
| N20 | N19 | doub | 1.29Å | 1.32Å | Aromatic |
| N19 | N18 | sing | 1.29Å | 1.38Å | Aromatic |
| N18 | C07 | sing | 1.47Å | 1.48Å | |
| C07 | C08 | sing | 1.53Å | 1.55Å | |
| C07 | C06 | sing | 1.53Å | 1.42Å | |
| C08 | C01 | sing | 1.54Å | 1.62Å | |
| C06 | C04 | sing | 1.54Å | 1.55Å | |
| C04 | C03 | sing | 1.55Å | 1.16Å | |
| C04 | N05 | sing | 1.49Å | 1.64Å | |
| C03 | C02 | sing | 1.54Å | 1.46Å | |
| C02 | C01 | sing | 1.55Å | 1.56Å | |
| C01 | N05 | sing | 1.49Å | 1.63Å | |
| N05 | C72 | sing | 1.47Å | 1.59Å | |
| C11 | C12 | sing | 1.51Å | 1.39Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.08Å | 1.08Å | |
| C15 | H4 | sing | 1.08Å | 1.08Å | |
| C17 | H5 | sing | 1.08Å | 1.08Å | |
| C22 | H6 | sing | 1.08Å | 1.08Å | |
| C32 | H7 | sing | 1.08Å | 1.08Å | |
| C31 | H8 | sing | 1.08Å | 1.08Å | |
| C30 | H9 | sing | 1.08Å | 1.08Å | |
| C29 | H10 | sing | 1.08Å | 1.08Å | |
| C33 | H11 | sing | 1.08Å | 1.08Å | |
| C34 | H12 | sing | 1.08Å | 1.08Å | |
| C35 | H13 | sing | 1.08Å | 1.08Å | |
| C36 | H14 | sing | 1.08Å | 1.08Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C07 | H17 | sing | 1.09Å | 1.10Å | |
| C08 | H18 | sing | 1.09Å | 1.10Å | |
| C08 | H19 | sing | 1.09Å | 1.10Å | |
| C06 | H20 | sing | 1.09Å | 1.10Å | |
| C06 | H21 | sing | 1.09Å | 1.10Å | |
| C04 | H22 | sing | 1.09Å | 1.10Å | |
| C03 | H23 | sing | 1.09Å | 1.10Å | |
| C02 | H24 | sing | 1.09Å | 1.10Å | |
| C02 | H25 | sing | 1.09Å | 1.10Å | |
| C01 | H26 | sing | 1.09Å | 1.10Å | |
| C72 | H27 | sing | 1.09Å | 1.10Å | |
| C72 | H28 | sing | 1.09Å | 1.10Å | |
| C72 | H29 | sing | 1.09Å | 1.10Å | |
| C11 | H30 | sing | 1.09Å | 1.10Å | |
| C11 | H31 | sing | 1.09Å | 1.10Å | |
| C14 | H32 | sing | 1.08Å | 1.08Å | |
| C16 | H33 | sing | 1.08Å | 1.08Å | |
| C03 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N05 | C10 | C11 | 116.7° | 109.5° |
| C10 | N05 | C04 | 115.4° | 110.6° |
| C10 | N05 | C01 | 113.5° | 110.6° |
| C10 | N05 | C72 | 83.0° | 110.6° |
| N05 | C10 | H1 | 107.6° | 109.4° |
| N05 | C10 | H2 | 107.6° | 109.5° |
| C10 | C11 | C12 | 107.8° | 109.5° |
| C11 | C10 | H1 | 107.7° | 109.5° |
| C11 | C10 | H2 | 107.6° | 109.5° |
| C10 | C11 | H30 | 109.9° | 109.5° |
| C10 | C11 | H31 | 109.9° | 109.5° |
| C12 | C13 | C14 | 122.2° | 120.0° |
| C13 | C12 | C17 | 116.8° | 120.0° |
| C13 | C12 | C11 | 121.5° | 120.0° |
| C12 | C13 | H3 | 118.9° | 120.0° |
| C13 | C14 | C15 | 120.0° | 120.0° |
| C14 | C13 | H3 | 118.9° | 120.0° |
| C13 | C14 | H32 | 120.0° | 120.0° |
| C14 | C15 | C16 | 117.1° | 120.0° |
| C14 | C15 | H4 | 121.5° | 120.0° |
| C15 | C14 | H32 | 120.0° | 120.0° |
| C15 | C16 | C17 | 122.4° | 120.0° |
| C16 | C15 | H4 | 121.5° | 120.0° |
| C15 | C16 | H33 | 118.8° | 120.0° |
| C12 | C17 | C16 | 121.5° | 120.0° |
| C17 | C12 | C11 | 121.7° | 120.0° |
| C12 | C17 | H5 | 119.2° | 120.0° |
| C16 | C17 | H5 | 119.3° | 120.0° |
| C17 | C16 | H33 | 118.8° | 120.0° |
| C22 | C21 | C23 | 126.1° | 126.8° |
| C22 | C21 | N20 | 110.6° | 106.5° |
| C21 | C22 | N18 | 107.0° | 106.2° |
| C21 | C22 | H6 | 126.5° | 126.9° |
| C23 | C21 | N20 | 123.3° | 126.7° |
| C21 | C23 | N24 | 106.1° | 109.5° |
| C21 | C23 | H15 | 110.3° | 109.5° |
| C21 | C23 | H16 | 110.3° | 109.5° |
| C21 | N20 | N19 | 108.1° | 108.9° |
| C22 | N18 | N19 | 107.6° | 108.3° |
| C22 | N18 | C07 | 128.5° | 125.9° |
| N18 | C22 | H6 | 126.5° | 126.9° |
| C32 | C26 | C25 | 121.0° | 120.1° |
| C32 | C26 | C27 | 131.0° | 133.5° |
| C26 | C32 | C31 | 121.3° | 119.8° |
| C26 | C32 | H7 | 119.4° | 120.1° |
| C25 | C26 | C27 | 107.9° | 106.4° |
| C26 | C25 | C29 | 119.7° | 119.3° |
| C26 | C25 | N24 | 108.1° | 108.4° |
| C26 | C27 | C28 | 107.7° | 106.5° |
| C26 | C27 | C33 | 132.0° | 133.4° |
| C27 | C28 | C36 | 120.2° | 119.3° |
| C27 | C28 | N24 | 108.7° | 108.4° |
| C28 | C27 | C33 | 120.3° | 120.1° |
| C36 | C28 | N24 | 131.1° | 132.3° |
| C28 | C36 | C35 | 121.9° | 120.0° |
| C28 | C36 | H14 | 119.0° | 120.0° |
| C28 | N24 | C25 | 107.5° | 110.3° |
| C28 | N24 | C23 | 121.6° | 124.9° |
| C32 | C31 | C30 | 117.8° | 120.2° |
| C31 | C32 | H7 | 119.4° | 120.1° |
| C32 | C31 | H8 | 121.1° | 119.9° |
| C31 | C30 | C29 | 118.6° | 120.6° |
| C30 | C31 | H8 | 121.1° | 119.9° |
| C31 | C30 | H9 | 120.7° | 119.7° |
| C30 | C29 | C25 | 121.6° | 120.0° |
| C29 | C30 | H9 | 120.7° | 119.7° |
| C30 | C29 | H10 | 119.2° | 120.0° |
| C29 | C25 | N24 | 132.1° | 132.3° |
| C25 | C29 | H10 | 119.2° | 120.0° |
| C25 | N24 | C23 | 130.9° | 124.8° |
| C27 | C33 | C34 | 121.4° | 119.8° |
| C27 | C33 | H11 | 119.3° | 120.1° |
| C33 | C34 | C35 | 118.3° | 120.3° |
| C34 | C33 | H11 | 119.3° | 120.2° |
| C33 | C34 | H12 | 120.9° | 119.9° |
| C34 | C35 | C36 | 117.9° | 120.6° |
| C35 | C34 | H12 | 120.9° | 119.9° |
| C34 | C35 | H13 | 121.1° | 119.7° |
| C36 | C35 | H13 | 121.0° | 119.7° |
| C35 | C36 | H14 | 119.0° | 119.9° |
| N24 | C23 | H15 | 110.3° | 109.4° |
| N24 | C23 | H16 | 110.3° | 109.4° |
| N20 | N19 | N18 | 106.7° | 110.2° |
| N19 | N18 | C07 | 123.6° | 125.8° |
| N18 | C07 | C08 | 109.4° | 109.4° |
| N18 | C07 | C06 | 103.2° | 109.4° |
| N18 | C07 | H17 | 110.8° | 109.4° |
| C08 | C07 | C06 | 111.6° | 109.7° |
| C07 | C08 | C01 | 113.5° | 108.9° |
| C08 | C07 | H17 | 109.9° | 109.5° |
| C07 | C08 | H18 | 108.4° | 109.6° |
| C07 | C08 | H19 | 108.4° | 109.6° |
| C07 | C06 | C04 | 115.2° | 108.9° |
| C06 | C07 | H17 | 111.8° | 109.4° |
| C07 | C06 | H20 | 108.0° | 109.6° |
| C07 | C06 | H21 | 108.0° | 109.5° |
| C08 | C01 | C02 | 123.5° | 107.8° |
| C08 | C01 | N05 | 83.5° | 107.3° |
| C01 | C08 | H18 | 108.5° | 109.6° |
| C01 | C08 | H19 | 108.5° | 109.6° |
| C08 | C01 | H26 | 117.7° | 112.1° |
| C06 | C04 | C03 | 145.9° | 107.8° |
| C06 | C04 | N05 | 89.0° | 107.3° |
| C04 | C06 | H20 | 108.0° | 109.6° |
| C04 | C06 | H21 | 108.0° | 109.6° |
| C06 | C04 | H22 | 101.5° | 112.1° |
| C03 | C04 | N05 | 65.9° | 104.2° |
| C04 | C03 | C02 | 117.7° | 104.8° |
| C03 | C04 | H22 | 105.4° | 112.2° |
| C04 | C03 | H23 | 107.4° | 110.3° |
| C04 | C03 | H34 | 107.4° | 110.3° |
| C04 | N05 | C01 | 119.9° | 103.4° |
| C04 | N05 | C72 | 115.9° | 110.7° |
| N05 | C04 | H22 | 100.9° | 112.7° |
| C03 | C02 | C01 | 110.7° | 104.9° |
| C02 | C03 | H23 | 107.4° | 110.4° |
| C03 | C02 | H24 | 109.2° | 110.4° |
| C03 | C02 | H25 | 109.2° | 110.4° |
| C02 | C03 | H34 | 107.4° | 110.4° |
| C02 | C01 | N05 | 71.5° | 104.2° |
| C01 | C02 | H24 | 109.2° | 110.4° |
| C01 | C02 | H25 | 109.2° | 110.3° |
| C02 | C01 | H26 | 118.7° | 112.2° |
| C01 | N05 | C72 | 102.6° | 110.8° |
| N05 | C01 | H26 | 117.5° | 112.8° |
| N05 | C72 | H27 | 109.5° | 109.5° |
| N05 | C72 | H28 | 109.4° | 109.4° |
| N05 | C72 | H29 | 109.5° | 109.5° |
| C12 | C11 | H30 | 109.9° | 109.5° |
| C12 | C11 | H31 | 109.9° | 109.4° |
| H1 | C10 | H2 | 109.5° | 109.5° |
| H15 | C23 | H16 | 109.5° | 109.5° |
| H18 | C08 | H19 | 109.5° | 109.7° |
| H20 | C06 | H21 | 109.5° | 109.7° |
| H23 | C03 | H34 | 109.5° | 110.5° |
| H24 | C02 | H25 | 109.5° | 110.4° |
| H27 | C72 | H28 | 109.4° | 109.5° |
| H27 | C72 | H29 | 109.5° | 109.5° |
| H28 | C72 | H29 | 109.5° | 109.5° |
| H30 | C11 | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N05 | C10 | C11 | H1 | 121.0° | 120.0° |
| N05 | C10 | C11 | H2 | 121.0° | 120.0° |
| C10 | N05 | C01 | C08 | 58.8° | 45.9° |
| C10 | N05 | C04 | C06 | 58.8° | 45.9° |
| C10 | N05 | C04 | C03 | 144.9° | 160.1° |
| C10 | N05 | C04 | C01 | 141.4° | 118.4° |
| C10 | N05 | C04 | C72 | 94.6° | 122.9° |
| C10 | N05 | C01 | C02 | 172.5° | 160.1° |
| C10 | N05 | C01 | C72 | 87.7° | 122.9° |
| N05 | C10 | C11 | C12 | 169.4° | 180.0° |
| N05 | C10 | H1 | H2 | 116.7° | 120.0° |
| C10 | N05 | C04 | H22 | 42.7° | 78.0° |
| C10 | N05 | C01 | H26 | 59.1° | 78.0° |
| C10 | N05 | C72 | H27 | 180.0° | 59.2° |
| C10 | N05 | C72 | H28 | 60.0° | 179.1° |
| C10 | N05 | C72 | H29 | 60.0° | 60.8° |
| N05 | C10 | C11 | H30 | 49.7° | 60.0° |
| N05 | C10 | C11 | H31 | 70.9° | 60.0° |
| C10 | C11 | C12 | C13 | 34.9° | 90.0° |
| C10 | C11 | C12 | C17 | 147.3° | 90.0° |
| C11 | C10 | N05 | C04 | 159.0° | 177.0° |
| C11 | C10 | N05 | C01 | 57.2° | 63.0° |
| C11 | C10 | N05 | C72 | 43.6° | 60.0° |
| C10 | C11 | C12 | H30 | 119.7° | 120.0° |
| C10 | C11 | C12 | H31 | 119.8° | 120.0° |
| C11 | C10 | H1 | H2 | 116.7° | 120.0° |
| C10 | C11 | H30 | H31 | 120.8° | 120.0° |
| C12 | C13 | C14 | H3 | 180.0° | 179.7° |
| C12 | C13 | C14 | C15 | 0.0° | 0.0° |
| C13 | C12 | C17 | C11 | 177.9° | 180.0° |
| C13 | C12 | C17 | C16 | 1.0° | 0.0° |
| C13 | C12 | C17 | H5 | 179.0° | 180.0° |
| C13 | C12 | C11 | H30 | 84.8° | 30.0° |
| C13 | C12 | C11 | H31 | 154.7° | 150.0° |
| C12 | C13 | C14 | H32 | 180.0° | 180.0° |
| C13 | C14 | C15 | H32 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.6° | 0.0° |
| C14 | C13 | C12 | C17 | 0.9° | 0.0° |
| C14 | C13 | C12 | C11 | 178.7° | 180.0° |
| C13 | C14 | C15 | H4 | 179.3° | 180.0° |
| C14 | C15 | C16 | H4 | 180.0° | 179.9° |
| C14 | C15 | C16 | C17 | 0.5° | 0.0° |
| C15 | C14 | C13 | H3 | 180.0° | 179.7° |
| C14 | C15 | C16 | H33 | 179.5° | 180.0° |
| C15 | C16 | C17 | C12 | 0.4° | 0.0° |
| C15 | C16 | C17 | H33 | 180.0° | 180.0° |
| C15 | C16 | C17 | H5 | 179.6° | 180.0° |
| C16 | C15 | C14 | H32 | 179.3° | 180.0° |
| C12 | C17 | C16 | H5 | 180.0° | 180.0° |
| C17 | C12 | C13 | H3 | 179.1° | 179.7° |
| C17 | C12 | C11 | H30 | 93.0° | 150.0° |
| C17 | C12 | C11 | H31 | 27.5° | 30.0° |
| C12 | C17 | C16 | H33 | 179.6° | 180.0° |
| C16 | C17 | C12 | C11 | 178.9° | 180.0° |
| C17 | C16 | C15 | H4 | 179.5° | 180.0° |
| C22 | C21 | C23 | N20 | 179.4° | 179.7° |
| C21 | C22 | N18 | H6 | 180.0° | 180.0° |
| C22 | C21 | C23 | N24 | 149.6° | 125.0° |
| C22 | C21 | N20 | N19 | 0.8° | 0.1° |
| C21 | C22 | N18 | N19 | 1.2° | 0.4° |
| C21 | C22 | N18 | C07 | 174.6° | 180.0° |
| C22 | C21 | C23 | H15 | 90.9° | 115.0° |
| C22 | C21 | C23 | H16 | 30.1° | 5.0° |
| C23 | C21 | C22 | N18 | 178.2° | 180.0° |
| C21 | C23 | N24 | C28 | 92.1° | 90.0° |
| C21 | C23 | N24 | C25 | 86.8° | 89.9° |
| C21 | C23 | N24 | H15 | 119.5° | 120.0° |
| C21 | C23 | N24 | H16 | 119.5° | 120.0° |
| C23 | C21 | N20 | N19 | 178.7° | 179.7° |
| C23 | C21 | C22 | H6 | 1.8° | 0.0° |
| C21 | C23 | H15 | H16 | 121.5° | 120.0° |
| N20 | C21 | C22 | N18 | 1.3° | 0.2° |
| N20 | C21 | C23 | N24 | 29.8° | 54.7° |
| C21 | N20 | N19 | N18 | 0.0° | 0.3° |
| N20 | C21 | C22 | H6 | 178.7° | 179.8° |
| N20 | C21 | C23 | H15 | 89.7° | 65.3° |
| N20 | C21 | C23 | H16 | 149.3° | 174.7° |
| C22 | N18 | N19 | N20 | 0.7° | 0.5° |
| C22 | N18 | N19 | C07 | 173.7° | 179.6° |
| C22 | N18 | C07 | C08 | 148.7° | 85.0° |
| C22 | N18 | C07 | C06 | 92.4° | 35.2° |
| C22 | N18 | C07 | H17 | 27.4° | 155.1° |
| C32 | C26 | C25 | C27 | 179.7° | 179.8° |
| C32 | C26 | C27 | C28 | 179.6° | 180.0° |
| C26 | C32 | C31 | H7 | 180.0° | 180.0° |
| C26 | C32 | C31 | C30 | 0.2° | 0.1° |
| C32 | C26 | C25 | C29 | 0.1° | 0.1° |
| C32 | C26 | C25 | N24 | 179.5° | 180.0° |
| C32 | C26 | C27 | C33 | 0.5° | 0.1° |
| C26 | C32 | C31 | H8 | 179.8° | 180.0° |
| C25 | C26 | C27 | C28 | 0.0° | 0.2° |
| C26 | C25 | N24 | C28 | 0.2° | 0.1° |
| C25 | C26 | C32 | C31 | 0.2° | 0.0° |
| C26 | C25 | C29 | C30 | 0.1° | 0.1° |
| C26 | C25 | C29 | N24 | 179.4° | 179.9° |
| C25 | C26 | C27 | C33 | 179.8° | 179.7° |
| C26 | C25 | N24 | C23 | 179.2° | 179.8° |
| C25 | C26 | C32 | H7 | 179.8° | 180.0° |
| C26 | C25 | C29 | H10 | 179.9° | 180.0° |
| C26 | C27 | C28 | C33 | 179.9° | 179.9° |
| C26 | C27 | C28 | C36 | 180.0° | 180.0° |
| C26 | C27 | C28 | N24 | 0.1° | 0.2° |
| C27 | C26 | C32 | C31 | 179.8° | 179.7° |
| C27 | C26 | C25 | C29 | 179.7° | 179.8° |
| C27 | C26 | C25 | N24 | 0.2° | 0.2° |
| C26 | C27 | C33 | C34 | 179.5° | 180.0° |
| C27 | C26 | C32 | H7 | 0.2° | 0.3° |
| C26 | C27 | C33 | H11 | 0.5° | 0.1° |
| C27 | C28 | C36 | N24 | 179.9° | 179.8° |
| C27 | C28 | N24 | C25 | 0.2° | 0.0° |
| C28 | C27 | C33 | C34 | 0.7° | 0.1° |
| C27 | C28 | C36 | C35 | 0.4° | 0.0° |
| C27 | C28 | N24 | C23 | 179.3° | 180.0° |
| C28 | C27 | C33 | H11 | 179.3° | 180.0° |
| C27 | C28 | C36 | H14 | 179.6° | 180.0° |
| C36 | C28 | N24 | C25 | 179.9° | 179.8° |
| C36 | C28 | C27 | C33 | 0.1° | 0.1° |
| C28 | C36 | C35 | C34 | 0.3° | 0.0° |
| C28 | C36 | C35 | H14 | 180.0° | 179.9° |
| C36 | C28 | N24 | C23 | 0.8° | 0.2° |
| C28 | C36 | C35 | H13 | 179.7° | 180.0° |
| C28 | N24 | C25 | C29 | 179.7° | 179.9° |
| C28 | N24 | C25 | C23 | 179.0° | 180.0° |
| N24 | C28 | C27 | C33 | 180.0° | 179.8° |
| N24 | C28 | C36 | C35 | 179.5° | 179.8° |
| N24 | C28 | C36 | H14 | 0.5° | 0.3° |
| C28 | N24 | C23 | H15 | 27.4° | 30.0° |
| C28 | N24 | C23 | H16 | 148.5° | 150.0° |
| C32 | C31 | C30 | H8 | 180.0° | 179.9° |
| C32 | C31 | C30 | C29 | 0.1° | 0.0° |
| C32 | C31 | C30 | H9 | 179.9° | 179.9° |
| C31 | C30 | C29 | H9 | 180.0° | 180.0° |
| C31 | C30 | C29 | C25 | 0.0° | 0.1° |
| C30 | C31 | C32 | H7 | 179.8° | 180.0° |
| C31 | C30 | C29 | H10 | 180.0° | 179.9° |
| C30 | C29 | C25 | H10 | 180.0° | 179.9° |
| C30 | C29 | C25 | N24 | 179.5° | 180.0° |
| C29 | C30 | C31 | H8 | 179.9° | 179.9° |
| C29 | C25 | N24 | C23 | 1.3° | 0.1° |
| C25 | C29 | C30 | H9 | 180.0° | 180.0° |
| N24 | C25 | C29 | H10 | 0.5° | 0.1° |
| C25 | N24 | C23 | H15 | 153.8° | 150.0° |
| C25 | N24 | C23 | H16 | 32.7° | 30.1° |
| C27 | C33 | C34 | H11 | 180.0° | 179.9° |
| C27 | C33 | C34 | C35 | 0.7° | 0.1° |
| C27 | C33 | C34 | H12 | 179.3° | 180.0° |
| C33 | C34 | C35 | H12 | 180.0° | 179.9° |
| C33 | C34 | C35 | C36 | 0.2° | 0.0° |
| C33 | C34 | C35 | H13 | 179.8° | 180.0° |
| C34 | C35 | C36 | H13 | 180.0° | 179.9° |
| C35 | C34 | C33 | H11 | 179.3° | 180.0° |
| C34 | C35 | C36 | H14 | 179.7° | 180.0° |
| C36 | C35 | C34 | H12 | 179.8° | 179.9° |
| N24 | C23 | H15 | H16 | 121.6° | 119.9° |
| N20 | N19 | N18 | C07 | 174.5° | 180.0° |
| N19 | N18 | C07 | C08 | 38.9° | 95.5° |
| N19 | N18 | C07 | C06 | 79.9° | 144.2° |
| N19 | N18 | C22 | H6 | 178.7° | 179.6° |
| N19 | N18 | C07 | H17 | 160.2° | 24.4° |
| N18 | C07 | C08 | C06 | 113.5° | 120.1° |
| N18 | C07 | C08 | H17 | 121.9° | 119.9° |
| N18 | C07 | C06 | H17 | 119.1° | 119.9° |
| N18 | C07 | C08 | C01 | 179.4° | 174.1° |
| N18 | C07 | C06 | C04 | 179.8° | 174.1° |
| C07 | N18 | C22 | H6 | 5.4° | 0.0° |
| N18 | C07 | C08 | H18 | 58.8° | 54.3° |
| N18 | C07 | C08 | H19 | 60.0° | 66.1° |
| N18 | C07 | C06 | H20 | 59.3° | 66.1° |
| N18 | C07 | C06 | H21 | 59.0° | 54.3° |
| C08 | C07 | C06 | H17 | 123.5° | 120.1° |
| C07 | C08 | C01 | H18 | 120.6° | 119.8° |
| C07 | C08 | C01 | H19 | 120.6° | 119.8° |
| C08 | C07 | C06 | C04 | 62.5° | 54.0° |
| C07 | C08 | C01 | C02 | 0.5° | 47.6° |
| C07 | C08 | C01 | N05 | 62.2° | 64.1° |
| C07 | C08 | H18 | H19 | 118.1° | 120.3° |
| C08 | C07 | C06 | H20 | 176.7° | 173.8° |
| C08 | C07 | C06 | H21 | 58.4° | 65.8° |
| C07 | C08 | C01 | H26 | 180.0° | 171.6° |
| C06 | C07 | C08 | C01 | 65.9° | 54.0° |
| C07 | C06 | C04 | H20 | 120.8° | 119.8° |
| C07 | C06 | C04 | H21 | 120.9° | 119.8° |
| C07 | C06 | C04 | C03 | 18.1° | 47.6° |
| C07 | C06 | C04 | N05 | 59.1° | 64.1° |
| C06 | C07 | C08 | H18 | 54.7° | 65.8° |
| C06 | C07 | C08 | H19 | 173.5° | 173.8° |
| C07 | C06 | H20 | H21 | 117.4° | 120.3° |
| C07 | C06 | C04 | H22 | 159.9° | 171.7° |
| C08 | C01 | N05 | C04 | 83.2° | 72.5° |
| C08 | C01 | C02 | C03 | 63.9° | 88.6° |
| C08 | C01 | C02 | N05 | 68.6° | 113.8° |
| C08 | C01 | C02 | H26 | 179.5° | 123.9° |
| C08 | C01 | N05 | H26 | 117.9° | 123.9° |
| C08 | C01 | N05 | C72 | 146.6° | 168.9° |
| C01 | C08 | C07 | H17 | 58.7° | 66.0° |
| C01 | C08 | H18 | H19 | 118.2° | 120.3° |
| C08 | C01 | C02 | H24 | 56.3° | 30.3° |
| C08 | C01 | C02 | H25 | 175.9° | 152.5° |
| C06 | C04 | C03 | N05 | 45.9° | 113.7° |
| C06 | C04 | C03 | H22 | 141.1° | 124.0° |
| C06 | C04 | N05 | H22 | 101.6° | 123.9° |
| C06 | C04 | C03 | C02 | 16.3° | 88.5° |
| C06 | C04 | N05 | C01 | 82.5° | 72.5° |
| C06 | C04 | N05 | C72 | 153.4° | 168.8° |
| C04 | C06 | C07 | H17 | 61.0° | 66.1° |
| C04 | C06 | H20 | H21 | 117.4° | 120.3° |
| C06 | C04 | C03 | H23 | 137.5° | 30.3° |
| C06 | C04 | C03 | H34 | 104.9° | 152.6° |
| C03 | C04 | N05 | H22 | 102.2° | 122.0° |
| C04 | C03 | C02 | H23 | 121.2° | 118.8° |
| C04 | C03 | C02 | H34 | 121.2° | 118.8° |
| C04 | C03 | C02 | C01 | 55.4° | 0.0° |
| C03 | C04 | N05 | C01 | 73.7° | 41.6° |
| C03 | C04 | N05 | C72 | 50.3° | 77.0° |
| C03 | C04 | C06 | H20 | 139.0° | 72.2° |
| C03 | C04 | C06 | H21 | 102.7° | 167.4° |
| C04 | C03 | H23 | H34 | 116.2° | 122.2° |
| C04 | C03 | C02 | H24 | 64.8° | 118.8° |
| C04 | C03 | C02 | H25 | 175.6° | 118.9° |
| N05 | C04 | C03 | C02 | 62.2° | 25.2° |
| C04 | N05 | C01 | C02 | 45.4° | 41.6° |
| C04 | N05 | C01 | C72 | 130.2° | 118.6° |
| C04 | N05 | C10 | H1 | 37.9° | 63.0° |
| C04 | N05 | C10 | H2 | 80.0° | 57.0° |
| N05 | C04 | C06 | H20 | 179.9° | 176.1° |
| N05 | C04 | C06 | H21 | 61.8° | 55.7° |
| N05 | C04 | C03 | H23 | 176.6° | 144.0° |
| C04 | N05 | C01 | H26 | 158.8° | 163.6° |
| C04 | N05 | C72 | H27 | 65.1° | 177.9° |
| C04 | N05 | C72 | H28 | 54.8° | 57.9° |
| C04 | N05 | C72 | H29 | 174.8° | 62.1° |
| N05 | C04 | C03 | H34 | 59.0° | 93.7° |
| C03 | C02 | C01 | H24 | 120.2° | 118.8° |
| C03 | C02 | C01 | H25 | 120.2° | 118.9° |
| C03 | C02 | C01 | N05 | 4.7° | 25.2° |
| C02 | C03 | C04 | H22 | 157.4° | 147.5° |
| C02 | C03 | H23 | H34 | 116.2° | 122.4° |
| C03 | C02 | H24 | H25 | 119.5° | 122.3° |
| C03 | C02 | C01 | H26 | 116.6° | 147.5° |
| C02 | C01 | N05 | H26 | 113.4° | 122.0° |
| C02 | C01 | N05 | C72 | 84.8° | 77.0° |
| C02 | C01 | C08 | H18 | 121.1° | 167.4° |
| C02 | C01 | C08 | H19 | 120.1° | 72.2° |
| C01 | C02 | C03 | H23 | 176.6° | 118.8° |
| C01 | C02 | H24 | H25 | 119.4° | 122.3° |
| C01 | C02 | C03 | H34 | 65.8° | 118.8° |
| C01 | N05 | C10 | H1 | 178.2° | 177.0° |
| C01 | N05 | C10 | H2 | 63.8° | 57.0° |
| N05 | C01 | C08 | H18 | 58.4° | 55.7° |
| N05 | C01 | C08 | H19 | 177.2° | 176.1° |
| C01 | N05 | C04 | H22 | 175.9° | 163.6° |
| N05 | C01 | C02 | H24 | 124.9° | 144.0° |
| N05 | C01 | C02 | H25 | 115.5° | 93.7° |
| C01 | N05 | C72 | H27 | 67.5° | 63.8° |
| C01 | N05 | C72 | H28 | 172.6° | 56.2° |
| C01 | N05 | C72 | H29 | 52.6° | 176.2° |
| C72 | N05 | C10 | H1 | 77.5° | 59.9° |
| C72 | N05 | C10 | H2 | 164.6° | 179.9° |
| C72 | N05 | C04 | H22 | 51.8° | 44.9° |
| C72 | N05 | C01 | H26 | 28.6° | 45.0° |
| N05 | C72 | H27 | H28 | 120.0° | 119.9° |
| N05 | C72 | H27 | H29 | 120.0° | 120.0° |
| N05 | C72 | H28 | H29 | 120.0° | 120.0° |
| C12 | C11 | C10 | H1 | 69.5° | 60.0° |
| C12 | C11 | C10 | H2 | 48.4° | 60.0° |
| C11 | C12 | C13 | H3 | 1.3° | 0.3° |
| C11 | C12 | C17 | H5 | 1.1° | 0.0° |
| C12 | C11 | H30 | H31 | 120.8° | 120.0° |
| H1 | C10 | C11 | H30 | 170.7° | 180.0° |
| H1 | C10 | C11 | H31 | 50.2° | 60.0° |
| H2 | C10 | C11 | H30 | 71.3° | 60.0° |
| H2 | C10 | C11 | H31 | 168.1° | 180.0° |
| H3 | C13 | C14 | H32 | 0.0° | 0.3° |
| H4 | C15 | C14 | H32 | 0.7° | 0.0° |
| H4 | C15 | C16 | H33 | 0.5° | 0.0° |
| H5 | C17 | C16 | H33 | 0.4° | 0.0° |
| H7 | C32 | C31 | H8 | 0.2° | 0.1° |
| H8 | C31 | C30 | H9 | 0.1° | 0.0° |
| H9 | C30 | C29 | H10 | 0.0° | 0.1° |
| H11 | C33 | C34 | H12 | 0.7° | 0.1° |
| H12 | C34 | C35 | H13 | 0.2° | 0.1° |
| H13 | C35 | C36 | H14 | 0.3° | 0.1° |
| H17 | C07 | C08 | H18 | 179.3° | 174.2° |
| H17 | C07 | C08 | H19 | 61.9° | 53.8° |
| H17 | C07 | C06 | H20 | 59.8° | 53.8° |
| H17 | C07 | C06 | H21 | 178.1° | 174.2° |
| H18 | C08 | C01 | H26 | 59.4° | 68.6° |
| H19 | C08 | C01 | H26 | 59.4° | 51.8° |
| H20 | C06 | C04 | H22 | 79.2° | 51.9° |
| H21 | C06 | C04 | H22 | 39.1° | 68.6° |
| H22 | C04 | C03 | H23 | 81.4° | 93.7° |
| H22 | C04 | C03 | H34 | 36.2° | 28.6° |
| H23 | C03 | C02 | H24 | 56.4° | 0.1° |
| H23 | C03 | C02 | H25 | 63.2° | 122.4° |
| H24 | C02 | C01 | H26 | 123.3° | 93.7° |
| H24 | C02 | C03 | H34 | 174.1° | 122.4° |
| H25 | C02 | C01 | H26 | 3.6° | 28.6° |
| H25 | C02 | C03 | H34 | 54.4° | 0.1° |
| H27 | C72 | H28 | H29 | 120.0° | 120.0° |
