ZQH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | C03 | sing | 1.51Å | 1.54Å | |
| O19 | C17 | doub | 1.21Å | 1.23Å | |
| C04 | C03 | sing | 1.53Å | 1.55Å | |
| C04 | C05 | sing | 1.53Å | 1.54Å | |
| C03 | C08 | sing | 1.53Å | 1.55Å | |
| C03 | C02 | sing | 1.53Å | 1.54Å | |
| C27 | C23 | sing | 1.53Å | 1.54Å | |
| C08 | C10 | sing | 1.55Å | 1.54Å | |
| C26 | C23 | sing | 1.53Å | 1.54Å | |
| C17 | C05 | sing | 1.51Å | 1.55Å | |
| C17 | N18 | sing | 1.35Å | 1.37Å | |
| C05 | C09 | sing | 1.53Å | 1.56Å | |
| C05 | C06 | sing | 1.54Å | 1.55Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C23 | C22 | sing | 1.53Å | 1.55Å | |
| C24 | N18 | sing | 1.47Å | 1.46Å | |
| C02 | C01 | sing | 1.53Å | 1.54Å | |
| C09 | C10 | sing | 1.52Å | 1.55Å | |
| N18 | C20 | sing | 1.47Å | 1.49Å | |
| C10 | C07 | sing | 1.52Å | 1.52Å | |
| C06 | C01 | sing | 1.53Å | 1.54Å | |
| C01 | C07 | sing | 1.52Å | 1.52Å | |
| N25 | C22 | sing | 1.47Å | 1.48Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C07 | C28 | doub | 1.31Å | 1.32Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C32 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
| C32 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | C29 | sing | 1.51Å | 1.52Å | |
| C31 | C30 | sing | 1.38Å | 1.39Å | Aromatic |
| C33 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | C29 | sing | 1.51Å | 1.53Å | |
| C30 | C35 | doub | 1.38Å | 1.39Å | Aromatic |
| C34 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C02 | H2 | sing | 1.09Å | 1.10Å | |
| C02 | H3 | sing | 1.09Å | 1.10Å | |
| C04 | H4 | sing | 1.09Å | 1.10Å | |
| C04 | H5 | sing | 1.09Å | 1.10Å | |
| C06 | H6 | sing | 1.09Å | 1.10Å | |
| C06 | H7 | sing | 1.09Å | 1.10Å | |
| C08 | H8 | sing | 1.09Å | 1.10Å | |
| C08 | H9 | sing | 1.09Å | 1.10Å | |
| C09 | H10 | sing | 1.09Å | 1.10Å | |
| C09 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.08Å | 1.08Å | |
| C13 | H14 | sing | 1.08Å | 1.08Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| C15 | H16 | sing | 1.08Å | 1.08Å | |
| C16 | H17 | sing | 1.08Å | 1.08Å | |
| C20 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C24 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H28 | sing | 1.09Å | 1.10Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.08Å | 1.08Å | |
| C29 | H32 | sing | 1.09Å | 1.10Å | |
| C29 | H33 | sing | 1.09Å | 1.10Å | |
| C31 | H34 | sing | 1.08Å | 1.08Å | |
| C32 | H35 | sing | 1.08Å | 1.08Å | |
| C33 | H36 | sing | 1.08Å | 1.08Å | |
| C34 | H37 | sing | 1.08Å | 1.08Å | |
| C35 | H38 | sing | 1.08Å | 1.08Å | |
| N25 | H39 | sing | 1.01Å | 1.00Å | |
| N25 | H40 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | C15 | C16 | 119.8° | 120.0° |
| C15 | C14 | C13 | 118.9° | 120.0° |
| C15 | C14 | H15 | 120.5° | 120.0° |
| C14 | C15 | H16 | 120.1° | 120.0° |
| C15 | C16 | C11 | 122.3° | 120.0° |
| C16 | C15 | H16 | 120.1° | 120.0° |
| C15 | C16 | H17 | 118.9° | 120.0° |
| C14 | C13 | C12 | 121.2° | 120.0° |
| C14 | C13 | H14 | 119.4° | 120.0° |
| C13 | C14 | H15 | 120.5° | 120.0° |
| C16 | C11 | C12 | 117.0° | 120.0° |
| C16 | C11 | C03 | 122.3° | 120.0° |
| C11 | C16 | H17 | 118.8° | 120.0° |
| C13 | C12 | C11 | 120.7° | 120.1° |
| C13 | C12 | H13 | 119.6° | 119.9° |
| C12 | C13 | H14 | 119.4° | 120.0° |
| C12 | C11 | C03 | 120.7° | 120.0° |
| C11 | C12 | H13 | 119.6° | 120.0° |
| C11 | C03 | C04 | 108.0° | 108.6° |
| C11 | C03 | C08 | 112.1° | 109.3° |
| C11 | C03 | C02 | 111.0° | 109.3° |
| O19 | C17 | C05 | 110.3° | 120.0° |
| O19 | C17 | N18 | 115.9° | 120.0° |
| C03 | C04 | C05 | 111.6° | 108.8° |
| C04 | C03 | C08 | 110.0° | 109.5° |
| C04 | C03 | C02 | 107.1° | 109.5° |
| C03 | C04 | H4 | 108.9° | 109.6° |
| C03 | C04 | H5 | 108.9° | 109.6° |
| C04 | C05 | C17 | 115.2° | 109.2° |
| C04 | C05 | C09 | 107.5° | 109.5° |
| C04 | C05 | C06 | 108.5° | 109.9° |
| C05 | C04 | H4 | 108.9° | 109.6° |
| C05 | C04 | H5 | 108.9° | 109.6° |
| C08 | C03 | C02 | 108.5° | 110.7° |
| C03 | C08 | C10 | 109.8° | 109.7° |
| C03 | C08 | H8 | 109.4° | 109.4° |
| C03 | C08 | H9 | 109.4° | 109.4° |
| C03 | C02 | C01 | 111.1° | 109.9° |
| C03 | C02 | H2 | 109.1° | 109.4° |
| C03 | C02 | H3 | 109.1° | 109.3° |
| C27 | C23 | C26 | 109.3° | 109.5° |
| C27 | C23 | C24 | 110.2° | 109.5° |
| C27 | C23 | C22 | 109.6° | 109.5° |
| C23 | C27 | H28 | 109.5° | 109.4° |
| C23 | C27 | H29 | 109.4° | 109.5° |
| C23 | C27 | H30 | 109.5° | 109.5° |
| C08 | C10 | C09 | 107.7° | 109.1° |
| C08 | C10 | C07 | 108.7° | 106.6° |
| C10 | C08 | H8 | 109.4° | 109.8° |
| C10 | C08 | H9 | 109.4° | 109.2° |
| C08 | C10 | H12 | 109.6° | 110.7° |
| C26 | C23 | C24 | 107.2° | 109.5° |
| C26 | C23 | C22 | 111.3° | 109.5° |
| C23 | C26 | H25 | 109.5° | 109.5° |
| C23 | C26 | H26 | 109.5° | 109.4° |
| C23 | C26 | H27 | 109.4° | 109.5° |
| C05 | C17 | N18 | 133.8° | 120.1° |
| C17 | C05 | C09 | 109.0° | 109.3° |
| C17 | C05 | C06 | 107.1° | 108.4° |
| C17 | N18 | C24 | 127.0° | 120.7° |
| C17 | N18 | C20 | 121.7° | 120.6° |
| C09 | C05 | C06 | 109.5° | 110.5° |
| C05 | C09 | C10 | 109.9° | 110.1° |
| C05 | C09 | H10 | 109.3° | 109.3° |
| C05 | C09 | H11 | 109.3° | 109.4° |
| C05 | C06 | C01 | 110.5° | 109.2° |
| C05 | C06 | H6 | 109.2° | 109.4° |
| C05 | C06 | H7 | 109.2° | 109.4° |
| C24 | C23 | C22 | 109.2° | 109.3° |
| C23 | C24 | N18 | 110.0° | 108.8° |
| C23 | C24 | H23 | 109.3° | 109.6° |
| C23 | C24 | H24 | 109.4° | 109.6° |
| C23 | C22 | N25 | 108.0° | 109.5° |
| C23 | C22 | C21 | 112.0° | 109.5° |
| C23 | C22 | H22 | 108.3° | 109.4° |
| C24 | N18 | C20 | 111.2° | 118.8° |
| N18 | C24 | H23 | 109.3° | 109.5° |
| N18 | C24 | H24 | 109.3° | 109.6° |
| C02 | C01 | C06 | 109.2° | 109.7° |
| C02 | C01 | C07 | 108.0° | 107.4° |
| C02 | C01 | H1 | 110.0° | 110.8° |
| C01 | C02 | H2 | 109.1° | 109.4° |
| C01 | C02 | H3 | 109.0° | 109.4° |
| C09 | C10 | C07 | 111.5° | 108.0° |
| C10 | C09 | H10 | 109.4° | 109.6° |
| C10 | C09 | H11 | 109.4° | 109.1° |
| C09 | C10 | H12 | 109.5° | 110.9° |
| N18 | C20 | C21 | 113.4° | 108.8° |
| N18 | C20 | H18 | 108.5° | 109.6° |
| N18 | C20 | H19 | 108.5° | 109.6° |
| C10 | C07 | C01 | 111.7° | 114.9° |
| C10 | C07 | C28 | 122.5° | 122.6° |
| C07 | C10 | H12 | 109.9° | 111.3° |
| C06 | C01 | C07 | 109.3° | 107.3° |
| C06 | C01 | H1 | 110.0° | 110.8° |
| C01 | C06 | H6 | 109.2° | 109.4° |
| C01 | C06 | H7 | 109.2° | 110.3° |
| C01 | C07 | C28 | 125.8° | 122.5° |
| C07 | C01 | H1 | 110.4° | 110.8° |
| N25 | C22 | C21 | 110.9° | 109.5° |
| N25 | C22 | H22 | 109.2° | 109.5° |
| C22 | N25 | H39 | 109.5° | 111.0° |
| C22 | N25 | H40 | 109.5° | 111.0° |
| C22 | C21 | C20 | 112.9° | 109.3° |
| C22 | C21 | H20 | 108.6° | 109.5° |
| C22 | C21 | H21 | 108.6° | 109.5° |
| C21 | C22 | H22 | 108.4° | 109.4° |
| C07 | C28 | C29 | 127.0° | 120.0° |
| C07 | C28 | H31 | 116.5° | 120.0° |
| C21 | C20 | H18 | 108.5° | 109.6° |
| C21 | C20 | H19 | 108.5° | 109.5° |
| C20 | C21 | H20 | 108.6° | 109.5° |
| C20 | C21 | H21 | 108.6° | 109.5° |
| C31 | C32 | C33 | 120.0° | 120.0° |
| C32 | C31 | C30 | 120.8° | 120.0° |
| C32 | C31 | H34 | 119.6° | 120.0° |
| C31 | C32 | H35 | 120.0° | 120.0° |
| C32 | C33 | C34 | 119.7° | 120.0° |
| C33 | C32 | H35 | 120.0° | 120.0° |
| C32 | C33 | H36 | 120.1° | 120.0° |
| C28 | C29 | C30 | 114.1° | 109.5° |
| C29 | C28 | H31 | 116.5° | 120.0° |
| C28 | C29 | H32 | 108.3° | 109.5° |
| C28 | C29 | H33 | 108.3° | 109.5° |
| C31 | C30 | C29 | 120.7° | 120.0° |
| C31 | C30 | C35 | 118.6° | 120.0° |
| C30 | C31 | H34 | 119.6° | 120.0° |
| C33 | C34 | C35 | 119.6° | 120.0° |
| C34 | C33 | H36 | 120.1° | 120.0° |
| C33 | C34 | H37 | 120.2° | 120.0° |
| C29 | C30 | C35 | 120.7° | 120.0° |
| C30 | C29 | H32 | 108.3° | 109.4° |
| C30 | C29 | H33 | 108.3° | 109.5° |
| C30 | C35 | C34 | 121.4° | 120.0° |
| C30 | C35 | H38 | 119.3° | 120.0° |
| C35 | C34 | H37 | 120.2° | 120.0° |
| C34 | C35 | H38 | 119.3° | 120.0° |
| H2 | C02 | H3 | 109.4° | 109.4° |
| H4 | C04 | H5 | 109.5° | 109.7° |
| H6 | C06 | H7 | 109.4° | 109.3° |
| H8 | C08 | H9 | 109.5° | 109.4° |
| H10 | C09 | H11 | 109.5° | 109.3° |
| H18 | C20 | H19 | 109.5° | 109.6° |
| H20 | C21 | H21 | 109.5° | 109.5° |
| H23 | C24 | H24 | 109.5° | 109.7° |
| H25 | C26 | H26 | 109.5° | 109.5° |
| H25 | C26 | H27 | 109.5° | 109.5° |
| H26 | C26 | H27 | 109.5° | 109.5° |
| H28 | C27 | H29 | 109.4° | 109.5° |
| H28 | C27 | H30 | 109.5° | 109.4° |
| H29 | C27 | H30 | 109.5° | 109.5° |
| H32 | C29 | H33 | 109.5° | 109.5° |
| H39 | N25 | H40 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | C15 | C16 | H16 | 180.0° | 179.7° |
| C15 | C14 | C13 | H15 | 180.0° | 179.9° |
| C14 | C15 | C16 | C11 | 0.4° | 0.6° |
| C15 | C14 | C13 | C12 | 1.0° | 0.0° |
| C15 | C14 | C13 | H14 | 179.0° | 179.9° |
| C14 | C15 | C16 | H17 | 179.6° | 180.0° |
| C16 | C15 | C14 | C13 | 0.7° | 0.3° |
| C15 | C16 | C11 | H17 | 180.0° | 179.4° |
| C15 | C16 | C11 | C12 | 0.3° | 0.6° |
| C15 | C16 | C11 | C03 | 179.7° | 179.7° |
| C16 | C15 | C14 | H15 | 179.3° | 179.8° |
| C14 | C13 | C12 | H14 | 180.0° | 179.9° |
| C14 | C13 | C12 | C11 | 0.9° | 0.0° |
| C14 | C13 | C12 | H13 | 179.1° | 180.0° |
| C13 | C14 | C15 | H16 | 179.3° | 180.0° |
| C16 | C11 | C12 | C13 | 0.6° | 0.2° |
| C16 | C11 | C12 | C03 | 179.3° | 179.8° |
| C16 | C11 | C03 | C04 | 48.7° | 0.9° |
| C16 | C11 | C03 | C08 | 72.6° | 120.3° |
| C16 | C11 | C03 | C02 | 165.8° | 118.4° |
| C16 | C11 | C12 | H13 | 179.4° | 179.7° |
| C11 | C16 | C15 | H16 | 179.6° | 179.7° |
| C13 | C12 | C11 | H13 | 180.0° | 179.9° |
| C13 | C12 | C11 | C03 | 179.9° | 180.0° |
| C12 | C13 | C14 | H15 | 179.0° | 179.9° |
| C12 | C11 | C03 | C04 | 130.6° | 179.3° |
| C12 | C11 | C03 | C08 | 108.1° | 60.0° |
| C12 | C11 | C03 | C02 | 13.5° | 61.3° |
| C11 | C12 | C13 | H14 | 179.1° | 180.0° |
| C12 | C11 | C16 | H17 | 179.7° | 180.0° |
| C11 | C03 | C04 | C08 | 122.7° | 119.2° |
| C11 | C03 | C04 | C02 | 119.6° | 119.2° |
| C11 | C03 | C04 | C05 | 179.9° | 180.0° |
| C11 | C03 | C08 | C02 | 123.0° | 120.4° |
| C11 | C03 | C08 | C10 | 178.2° | 178.8° |
| C11 | C03 | C02 | C01 | 177.5° | 179.2° |
| C11 | C03 | C02 | H2 | 57.3° | 60.7° |
| C11 | C03 | C02 | H3 | 62.2° | 59.1° |
| C11 | C03 | C04 | H4 | 59.6° | 60.3° |
| C11 | C03 | C04 | H5 | 59.7° | 60.1° |
| C11 | C03 | C08 | H8 | 61.7° | 60.7° |
| C11 | C03 | C08 | H9 | 58.2° | 59.0° |
| C03 | C11 | C12 | H13 | 0.1° | 0.1° |
| C03 | C11 | C16 | H17 | 0.4° | 0.3° |
| O19 | C17 | C05 | C04 | 3.0° | 7.3° |
| O19 | C17 | C05 | N18 | 179.0° | 180.0° |
| O19 | C17 | C05 | C09 | 123.8° | 112.5° |
| O19 | C17 | C05 | C06 | 117.9° | 127.0° |
| O19 | C17 | N18 | C24 | 7.0° | 5.3° |
| O19 | C17 | N18 | C20 | 176.3° | 174.6° |
| C03 | C04 | C05 | H4 | 120.3° | 119.8° |
| C03 | C04 | C05 | H5 | 120.3° | 119.8° |
| C04 | C03 | C08 | C02 | 116.8° | 120.8° |
| C04 | C03 | C08 | C10 | 58.1° | 60.0° |
| C03 | C04 | C05 | C17 | 179.9° | 179.5° |
| C03 | C04 | C05 | C09 | 58.2° | 60.9° |
| C03 | C04 | C05 | C06 | 60.1° | 60.7° |
| C04 | C03 | C02 | C01 | 59.9° | 60.4° |
| C04 | C03 | C02 | H2 | 60.4° | 179.5° |
| C04 | C03 | C02 | H3 | 179.9° | 59.7° |
| C03 | C04 | H4 | H5 | 119.0° | 120.4° |
| C04 | C03 | C08 | H8 | 178.1° | 179.5° |
| C04 | C03 | C08 | H9 | 62.0° | 59.8° |
| C05 | C04 | C03 | C08 | 57.3° | 60.8° |
| C05 | C04 | C03 | C02 | 60.5° | 60.7° |
| C04 | C05 | C17 | C09 | 120.8° | 119.8° |
| C04 | C05 | C17 | C06 | 120.8° | 119.8° |
| C04 | C05 | C17 | N18 | 178.0° | 172.7° |
| C04 | C05 | C09 | C06 | 117.7° | 121.2° |
| C04 | C05 | C09 | C10 | 61.8° | 60.7° |
| C04 | C05 | C06 | C01 | 58.2° | 59.9° |
| C05 | C04 | H4 | H5 | 119.0° | 120.4° |
| C04 | C05 | C06 | H6 | 178.3° | 59.8° |
| C04 | C05 | C06 | H7 | 62.0° | 179.4° |
| C04 | C05 | C09 | H10 | 58.3° | 59.7° |
| C04 | C05 | C09 | H11 | 178.1° | 179.4° |
| C03 | C08 | C10 | H8 | 120.0° | 120.2° |
| C03 | C08 | C10 | H9 | 120.0° | 119.9° |
| C08 | C03 | C02 | C01 | 58.8° | 60.4° |
| C03 | C08 | C10 | C09 | 61.1° | 58.9° |
| C03 | C08 | C10 | C07 | 59.8° | 57.5° |
| C08 | C03 | C02 | H2 | 179.1° | 59.8° |
| C08 | C03 | C02 | H3 | 61.4° | 179.5° |
| C08 | C03 | C04 | H4 | 63.1° | 58.9° |
| C08 | C03 | C04 | H5 | 177.6° | 179.4° |
| C03 | C08 | H8 | H9 | 119.9° | 119.7° |
| C03 | C08 | C10 | H12 | 179.9° | 178.8° |
| C02 | C03 | C08 | C10 | 58.8° | 60.8° |
| C03 | C02 | C01 | H2 | 120.3° | 120.1° |
| C03 | C02 | C01 | H3 | 120.3° | 120.1° |
| C03 | C02 | C01 | C06 | 60.0° | 59.4° |
| C03 | C02 | C01 | C07 | 58.8° | 56.9° |
| C03 | C02 | C01 | H1 | 179.2° | 178.0° |
| C03 | C02 | H2 | H3 | 119.3° | 119.7° |
| C02 | C03 | C04 | H4 | 179.2° | 179.5° |
| C02 | C03 | C04 | H5 | 59.9° | 59.1° |
| C02 | C03 | C08 | H8 | 61.3° | 59.7° |
| C02 | C03 | C08 | H9 | 178.8° | 179.4° |
| C27 | C23 | C26 | C24 | 119.5° | 120.1° |
| C27 | C23 | C26 | C22 | 121.2° | 120.0° |
| C27 | C23 | C24 | C22 | 120.5° | 119.9° |
| C27 | C23 | C24 | N18 | 58.6° | 65.3° |
| C27 | C23 | C22 | N25 | 54.0° | 61.4° |
| C27 | C23 | C22 | C21 | 68.4° | 58.6° |
| C27 | C23 | C22 | H22 | 172.1° | 178.6° |
| C27 | C23 | C24 | H23 | 178.6° | 175.0° |
| C27 | C23 | C24 | H24 | 61.5° | 54.5° |
| C27 | C23 | C26 | H25 | 180.0° | 179.9° |
| C27 | C23 | C26 | H26 | 60.0° | 59.9° |
| C27 | C23 | C26 | H27 | 60.0° | 60.1° |
| C23 | C27 | H28 | H29 | 120.0° | 120.0° |
| C23 | C27 | H28 | H30 | 120.0° | 119.9° |
| C23 | C27 | H29 | H30 | 120.0° | 120.0° |
| C08 | C10 | C09 | C05 | 63.8° | 59.1° |
| C08 | C10 | C09 | C07 | 119.2° | 115.6° |
| C08 | C10 | C09 | H12 | 119.0° | 122.2° |
| C08 | C10 | C07 | H12 | 119.9° | 120.9° |
| C08 | C10 | C07 | C01 | 61.3° | 59.3° |
| C08 | C10 | C07 | C28 | 117.8° | 120.7° |
| C10 | C08 | H8 | H9 | 119.8° | 119.8° |
| C08 | C10 | C09 | H10 | 56.3° | 61.2° |
| C08 | C10 | C09 | H11 | 176.2° | 179.2° |
| C26 | C23 | C24 | C22 | 120.7° | 120.0° |
| C26 | C23 | C24 | N18 | 177.4° | 174.6° |
| C26 | C23 | C22 | N25 | 67.0° | 58.7° |
| C26 | C23 | C22 | C21 | 170.6° | 178.7° |
| C26 | C23 | C22 | H22 | 51.1° | 61.3° |
| C26 | C23 | C24 | H23 | 62.5° | 54.8° |
| C26 | C23 | C24 | H24 | 57.3° | 65.6° |
| C23 | C26 | H25 | H26 | 120.0° | 120.0° |
| C23 | C26 | H25 | H27 | 120.0° | 120.0° |
| C23 | C26 | H26 | H27 | 120.0° | 120.0° |
| C26 | C23 | C27 | H28 | 180.0° | 60.1° |
| C26 | C23 | C27 | H29 | 60.0° | 59.9° |
| C26 | C23 | C27 | H30 | 60.0° | 179.9° |
| C17 | C05 | C09 | C06 | 116.9° | 119.2° |
| C05 | C17 | N18 | C24 | 174.1° | 174.7° |
| C17 | C05 | C09 | C10 | 172.7° | 179.6° |
| C05 | C17 | N18 | C20 | 2.7° | 5.3° |
| C17 | C05 | C06 | C01 | 176.9° | 179.2° |
| C17 | C05 | C04 | H4 | 59.5° | 60.7° |
| C17 | C05 | C04 | H5 | 59.8° | 59.7° |
| C17 | C05 | C06 | H6 | 56.7° | 59.6° |
| C17 | C05 | C06 | H7 | 62.9° | 60.1° |
| C17 | C05 | C09 | H10 | 67.2° | 59.9° |
| C17 | C05 | C09 | H11 | 52.7° | 59.8° |
| N18 | C17 | C05 | C09 | 57.2° | 67.5° |
| N18 | C17 | C05 | C06 | 61.2° | 53.0° |
| C17 | N18 | C24 | C23 | 113.6° | 126.4° |
| C17 | N18 | C24 | C20 | 177.0° | 180.0° |
| C17 | N18 | C20 | C21 | 121.9° | 126.4° |
| C17 | N18 | C20 | H18 | 117.5° | 6.6° |
| C17 | N18 | C20 | H19 | 1.3° | 113.8° |
| C17 | N18 | C24 | H23 | 126.3° | 113.8° |
| C17 | N18 | C24 | H24 | 6.5° | 6.6° |
| C05 | C09 | C10 | H10 | 120.0° | 120.3° |
| C05 | C09 | C10 | H11 | 120.1° | 120.0° |
| C05 | C09 | C10 | C07 | 55.4° | 56.4° |
| C09 | C05 | C06 | C01 | 58.8° | 61.1° |
| C09 | C05 | C04 | H4 | 62.1° | 58.9° |
| C09 | C05 | C04 | H5 | 178.6° | 179.4° |
| C09 | C05 | C06 | H6 | 61.3° | 179.3° |
| C09 | C05 | C06 | H7 | 179.0° | 59.6° |
| C05 | C09 | H10 | H11 | 119.8° | 119.7° |
| C05 | C09 | C10 | H12 | 177.2° | 178.6° |
| C05 | C06 | C01 | C02 | 58.3° | 58.7° |
| C06 | C05 | C09 | C10 | 55.9° | 60.5° |
| C05 | C06 | C01 | H6 | 120.2° | 119.6° |
| C05 | C06 | C01 | H7 | 120.2° | 120.2° |
| C05 | C06 | C01 | C07 | 59.6° | 57.7° |
| C05 | C06 | C01 | H1 | 179.1° | 178.7° |
| C06 | C05 | C04 | H4 | 179.6° | 179.5° |
| C06 | C05 | C04 | H5 | 60.3° | 59.1° |
| C05 | C06 | H6 | H7 | 119.5° | 119.8° |
| C06 | C05 | C09 | H10 | 176.0° | 179.0° |
| C06 | C05 | C09 | H11 | 64.2° | 59.3° |
| C23 | C24 | N18 | H23 | 120.1° | 119.8° |
| C23 | C24 | N18 | H24 | 120.1° | 119.8° |
| C23 | C24 | N18 | C20 | 63.4° | 53.6° |
| C24 | C23 | C22 | N25 | 174.9° | 178.7° |
| C24 | C23 | C22 | C21 | 52.5° | 61.3° |
| C24 | C23 | C22 | H22 | 67.0° | 58.6° |
| C23 | C24 | H23 | H24 | 119.8° | 120.4° |
| C24 | C23 | C26 | H25 | 60.5° | 60.0° |
| C24 | C23 | C26 | H26 | 179.5° | 180.0° |
| C24 | C23 | C26 | H27 | 59.5° | 60.0° |
| C24 | C23 | C27 | H28 | 62.4° | 60.0° |
| C24 | C23 | C27 | H29 | 57.5° | 180.0° |
| C24 | C23 | C27 | H30 | 177.5° | 60.0° |
| C22 | C23 | C24 | N18 | 61.9° | 54.6° |
| C23 | C22 | N25 | C21 | 123.0° | 120.1° |
| C23 | C22 | N25 | H22 | 117.6° | 120.0° |
| C23 | C22 | C21 | H22 | 119.4° | 120.0° |
| C23 | C22 | C21 | C20 | 45.1° | 61.3° |
| C23 | C22 | C21 | H20 | 75.4° | 178.7° |
| C23 | C22 | C21 | H21 | 165.6° | 58.6° |
| C22 | C23 | C24 | H23 | 58.1° | 65.1° |
| C22 | C23 | C24 | H24 | 178.0° | 174.4° |
| C22 | C23 | C26 | H25 | 58.8° | 59.8° |
| C22 | C23 | C26 | H26 | 61.2° | 60.2° |
| C22 | C23 | C26 | H27 | 178.8° | 179.8° |
| C22 | C23 | C27 | H28 | 57.8° | 179.8° |
| C22 | C23 | C27 | H29 | 177.8° | 60.2° |
| C22 | C23 | C27 | H30 | 62.2° | 59.9° |
| C23 | C22 | N25 | H39 | 180.0° | 179.9° |
| C23 | C22 | N25 | H40 | 60.0° | 56.1° |
| C24 | N18 | C20 | C21 | 55.3° | 53.5° |
| C24 | N18 | C20 | H18 | 65.3° | 173.4° |
| C24 | N18 | C20 | H19 | 175.9° | 66.2° |
| N18 | C24 | H23 | H24 | 119.7° | 120.3° |
| C02 | C01 | C07 | C10 | 60.1° | 59.2° |
| C02 | C01 | C06 | C07 | 117.9° | 116.4° |
| C02 | C01 | C06 | H1 | 120.8° | 122.6° |
| C02 | C01 | C07 | H1 | 120.2° | 121.1° |
| C02 | C01 | C07 | C28 | 119.0° | 120.7° |
| C01 | C02 | H2 | H3 | 119.2° | 119.8° |
| C02 | C01 | C06 | H6 | 178.5° | 61.0° |
| C02 | C01 | C06 | H7 | 61.9° | 178.9° |
| C09 | C10 | C07 | H12 | 121.5° | 121.9° |
| C09 | C10 | C07 | C01 | 57.3° | 57.9° |
| C09 | C10 | C07 | C28 | 123.6° | 122.1° |
| C09 | C10 | C08 | H8 | 178.8° | 179.1° |
| C09 | C10 | C08 | H9 | 58.9° | 60.9° |
| C10 | C09 | H10 | H11 | 119.8° | 119.5° |
| N18 | C20 | C21 | C22 | 45.9° | 54.6° |
| N18 | C20 | C21 | H18 | 120.6° | 119.9° |
| N18 | C20 | C21 | H19 | 120.6° | 119.8° |
| N18 | C20 | H18 | H19 | 118.2° | 120.4° |
| N18 | C20 | C21 | H20 | 74.6° | 174.6° |
| N18 | C20 | C21 | H21 | 166.4° | 65.3° |
| C20 | N18 | C24 | H23 | 56.7° | 66.2° |
| C20 | N18 | C24 | H24 | 176.5° | 173.4° |
| C10 | C07 | C01 | C06 | 58.6° | 58.6° |
| C10 | C07 | C01 | C28 | 179.1° | 180.0° |
| C10 | C07 | C28 | C29 | 179.4° | 5.7° |
| C10 | C07 | C01 | H1 | 179.7° | 179.6° |
| C07 | C10 | C08 | H8 | 60.2° | 62.7° |
| C07 | C10 | C08 | H9 | 179.8° | 177.4° |
| C07 | C10 | C09 | H10 | 175.5° | 176.7° |
| C07 | C10 | C09 | H11 | 64.7° | 63.6° |
| C10 | C07 | C28 | H31 | 0.6° | 174.2° |
| C06 | C01 | C07 | H1 | 121.1° | 121.0° |
| C06 | C01 | C07 | C28 | 122.3° | 121.4° |
| C06 | C01 | C02 | H2 | 60.3° | 179.5° |
| C06 | C01 | C02 | H3 | 179.7° | 60.7° |
| C01 | C06 | H6 | H7 | 119.5° | 120.8° |
| C01 | C07 | C28 | C29 | 1.7° | 174.3° |
| C07 | C01 | C02 | H2 | 179.0° | 63.2° |
| C07 | C01 | C02 | H3 | 61.5° | 177.0° |
| C07 | C01 | C06 | H6 | 60.5° | 177.3° |
| C07 | C01 | C06 | H7 | 179.8° | 62.5° |
| C01 | C07 | C10 | H12 | 178.8° | 179.8° |
| C01 | C07 | C28 | H31 | 178.3° | 5.7° |
| N25 | C22 | C21 | H22 | 119.9° | 120.0° |
| N25 | C22 | C21 | C20 | 165.8° | 178.7° |
| N25 | C22 | C21 | H20 | 45.3° | 58.7° |
| N25 | C22 | C21 | H21 | 73.7° | 61.4° |
| C22 | N25 | H39 | H40 | 120.0° | 124.0° |
| C22 | C21 | C20 | H20 | 120.5° | 120.0° |
| C22 | C21 | C20 | H21 | 120.5° | 119.9° |
| C22 | C21 | C20 | H18 | 74.7° | 174.4° |
| C22 | C21 | C20 | H19 | 166.5° | 65.3° |
| C22 | C21 | H20 | H21 | 118.4° | 120.0° |
| C21 | C22 | N25 | H39 | 56.9° | 60.0° |
| C21 | C22 | N25 | H40 | 63.1° | 63.9° |
| C07 | C28 | C29 | H31 | 180.0° | 180.0° |
| C07 | C28 | C29 | C30 | 72.9° | 120.7° |
| C28 | C07 | C01 | H1 | 1.3° | 0.4° |
| C28 | C07 | C10 | H12 | 2.1° | 0.2° |
| C07 | C28 | C29 | H32 | 166.4° | 119.3° |
| C07 | C28 | C29 | H33 | 47.8° | 0.7° |
| C21 | C20 | H18 | H19 | 118.2° | 120.2° |
| C20 | C21 | H20 | H21 | 118.4° | 120.1° |
| C20 | C21 | C22 | H22 | 74.3° | 58.7° |
| C31 | C32 | C33 | H35 | 180.0° | 179.9° |
| C32 | C31 | C30 | H34 | 180.0° | 180.0° |
| C31 | C32 | C33 | C34 | 0.3° | 0.1° |
| C32 | C31 | C30 | C29 | 179.3° | 180.0° |
| C32 | C31 | C30 | C35 | 0.8° | 0.2° |
| C31 | C32 | C33 | H36 | 179.7° | 180.0° |
| C33 | C32 | C31 | C30 | 0.4° | 0.0° |
| C32 | C33 | C34 | H36 | 180.0° | 180.0° |
| C32 | C33 | C34 | C35 | 0.5° | 0.2° |
| C33 | C32 | C31 | H34 | 179.6° | 180.0° |
| C32 | C33 | C34 | H37 | 179.5° | 179.9° |
| C28 | C29 | C30 | C31 | 24.3° | 89.7° |
| C28 | C29 | C30 | H32 | 120.7° | 120.0° |
| C28 | C29 | C30 | H33 | 120.7° | 120.0° |
| C28 | C29 | C30 | C35 | 157.2° | 90.0° |
| C28 | C29 | H32 | H33 | 117.9° | 120.1° |
| C31 | C30 | C29 | C35 | 178.5° | 179.8° |
| C31 | C30 | C35 | C34 | 0.5° | 0.5° |
| C31 | C30 | C29 | H32 | 96.4° | 150.3° |
| C31 | C30 | C29 | H33 | 145.0° | 30.3° |
| C30 | C31 | C32 | H35 | 179.6° | 180.0° |
| C31 | C30 | C35 | H38 | 179.5° | 179.7° |
| C33 | C34 | C35 | C30 | 0.1° | 0.5° |
| C33 | C34 | C35 | H37 | 180.0° | 179.8° |
| C34 | C33 | C32 | H35 | 179.8° | 180.0° |
| C33 | C34 | C35 | H38 | 179.9° | 179.8° |
| C29 | C30 | C35 | C34 | 179.1° | 179.7° |
| C30 | C29 | C28 | H31 | 107.1° | 59.3° |
| C30 | C29 | H32 | H33 | 117.9° | 120.0° |
| C29 | C30 | C31 | H34 | 0.6° | 0.0° |
| C29 | C30 | C35 | H38 | 0.9° | 0.0° |
| C30 | C35 | C34 | H38 | 180.0° | 179.8° |
| C35 | C30 | C29 | H32 | 82.1° | 30.0° |
| C35 | C30 | C29 | H33 | 36.5° | 150.0° |
| C35 | C30 | C31 | H34 | 179.2° | 179.8° |
| C30 | C35 | C34 | H37 | 179.9° | 179.8° |
| C35 | C34 | C33 | H36 | 179.5° | 179.8° |
| H1 | C01 | C02 | H2 | 60.5° | 57.9° |
| H1 | C01 | C02 | H3 | 59.0° | 61.9° |
| H1 | C01 | C06 | H6 | 60.8° | 61.7° |
| H1 | C01 | C06 | H7 | 58.9° | 58.5° |
| H8 | C08 | C10 | H12 | 59.9° | 58.6° |
| H9 | C08 | C10 | H12 | 60.1° | 61.3° |
| H10 | C09 | C10 | H12 | 62.8° | 61.0° |
| H11 | C09 | C10 | H12 | 57.1° | 58.6° |
| H13 | C12 | C13 | H14 | 0.9° | 0.1° |
| H14 | C13 | C14 | H15 | 1.0° | 0.0° |
| H15 | C14 | C15 | H16 | 0.7° | 0.1° |
| H16 | C15 | C16 | H17 | 0.4° | 0.3° |
| H18 | C20 | C21 | H20 | 164.8° | 65.6° |
| H18 | C20 | C21 | H21 | 45.8° | 54.5° |
| H19 | C20 | C21 | H20 | 45.9° | 54.7° |
| H19 | C20 | C21 | H21 | 73.0° | 174.8° |
| H20 | C21 | C22 | H22 | 165.2° | 61.4° |
| H21 | C21 | C22 | H22 | 46.2° | 178.6° |
| H22 | C22 | N25 | H39 | 62.5° | 59.9° |
| H22 | C22 | N25 | H40 | 177.6° | 176.1° |
| H25 | C26 | H26 | H27 | 120.0° | 120.0° |
| H28 | C27 | H29 | H30 | 120.0° | 120.0° |
| H31 | C28 | C29 | H32 | 13.6° | 60.7° |
| H31 | C28 | C29 | H33 | 132.2° | 179.3° |
| H34 | C31 | C32 | H35 | 0.5° | 0.0° |
| H35 | C32 | C33 | H36 | 0.3° | 0.0° |
| H36 | C33 | C34 | H37 | 0.6° | 0.0° |
| H37 | C34 | C35 | H38 | 0.2° | 0.0° |
