WT1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C29 | O28 | sing | 1.43Å | 1.41Å | |
| O28 | C27 | sing | 1.36Å | 1.37Å | |
| O31 | C32 | sing | 1.43Å | 1.40Å | |
| O31 | C30 | sing | 1.36Å | 1.36Å | |
| C27 | C30 | doub | 1.39Å | 1.40Å | Aromatic |
| C27 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
| C30 | C33 | sing | 1.39Å | 1.40Å | Aromatic |
| C26 | C25 | doub | 1.39Å | 1.40Å | Aromatic |
| C33 | C34 | doub | 1.39Å | 1.39Å | Aromatic |
| C25 | C34 | sing | 1.39Å | 1.40Å | Aromatic |
| C25 | N24 | sing | 1.40Å | 1.42Å | |
| C34 | O35 | sing | 1.36Å | 1.36Å | |
| N24 | N23 | sing | 1.40Å | 1.38Å | Aromatic |
| N24 | C37 | sing | 1.35Å | 1.40Å | Aromatic |
| N23 | N22 | doub | 1.29Å | 1.27Å | Aromatic |
| O35 | C36 | sing | 1.43Å | 1.40Å | |
| C37 | C38 | sing | 1.51Å | 1.47Å | |
| C37 | C21 | doub | 1.37Å | 1.40Å | Aromatic |
| N22 | C21 | sing | 1.34Å | 1.41Å | Aromatic |
| C21 | C19 | sing | 1.47Å | 1.48Å | |
| C02 | C01 | sing | 1.53Å | 1.52Å | |
| C02 | C03 | sing | 1.53Å | 1.54Å | |
| C03 | C04 | sing | 1.53Å | 1.57Å | |
| C19 | O20 | doub | 1.22Å | 1.21Å | |
| C19 | N18 | sing | 1.35Å | 1.40Å | |
| C05 | C04 | sing | 1.53Å | 1.55Å | |
| C05 | C06 | sing | 1.53Å | 1.53Å | |
| C04 | O07 | sing | 1.43Å | 1.44Å | |
| N18 | C17 | sing | 1.40Å | 1.41Å | |
| O07 | C08 | sing | 1.36Å | 1.38Å | |
| C17 | C08 | doub | 1.39Å | 1.41Å | Aromatic |
| C17 | C16 | sing | 1.39Å | 1.42Å | Aromatic |
| C08 | C09 | sing | 1.39Å | 1.40Å | Aromatic |
| C16 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
| C09 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.51Å | 1.56Å | |
| C13 | C12 | sing | 1.53Å | 1.55Å | |
| C12 | C14 | sing | 1.53Å | 1.54Å | |
| C12 | C15 | sing | 1.53Å | 1.54Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C02 | H5 | sing | 1.09Å | 1.10Å | |
| C04 | H6 | sing | 1.09Å | 1.10Å | |
| C05 | H7 | sing | 1.09Å | 1.10Å | |
| C05 | H8 | sing | 1.09Å | 1.10Å | |
| C06 | H9 | sing | 1.09Å | 1.10Å | |
| C06 | H10 | sing | 1.09Å | 1.10Å | |
| C06 | H11 | sing | 1.09Å | 1.10Å | |
| C09 | H12 | sing | 1.08Å | 1.08Å | |
| C10 | H13 | sing | 1.08Å | 1.08Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | 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 | |
| C16 | H23 | sing | 1.08Å | 1.08Å | |
| C03 | H24 | sing | 1.09Å | 1.10Å | |
| C03 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C32 | H30 | sing | 1.09Å | 1.10Å | |
| C32 | H31 | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C36 | H34 | sing | 1.09Å | 1.10Å | |
| C36 | H35 | sing | 1.09Å | 1.10Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C38 | H37 | sing | 1.09Å | 1.10Å | |
| C38 | H38 | sing | 1.09Å | 1.10Å | |
| C38 | H39 | sing | 1.09Å | 1.10Å | |
| N18 | H40 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C29 | O28 | C27 | 117.2° | 117.0° |
| O28 | C29 | H27 | 109.5° | 109.4° |
| O28 | C29 | H28 | 109.5° | 109.4° |
| O28 | C29 | H29 | 109.5° | 109.5° |
| O28 | C27 | C30 | 122.1° | 120.0° |
| O28 | C27 | C26 | 118.3° | 120.0° |
| C32 | O31 | C30 | 114.4° | 117.0° |
| O31 | C32 | H30 | 109.5° | 109.5° |
| O31 | C32 | H31 | 109.5° | 109.5° |
| O31 | C32 | H32 | 109.5° | 109.5° |
| O31 | C30 | C27 | 119.1° | 120.0° |
| O31 | C30 | C33 | 120.6° | 120.0° |
| C30 | C27 | C26 | 119.5° | 120.0° |
| C27 | C30 | C33 | 120.3° | 120.0° |
| C27 | C26 | C25 | 120.8° | 120.0° |
| C27 | C26 | H26 | 119.6° | 120.0° |
| C30 | C33 | C34 | 119.9° | 120.0° |
| C30 | C33 | H33 | 120.0° | 120.0° |
| C26 | C25 | C34 | 119.3° | 120.0° |
| C26 | C25 | N24 | 119.2° | 120.0° |
| C25 | C26 | H26 | 119.6° | 120.0° |
| C33 | C34 | C25 | 120.2° | 120.0° |
| C33 | C34 | O35 | 122.7° | 120.0° |
| C34 | C33 | H33 | 120.0° | 120.0° |
| C34 | C25 | N24 | 121.5° | 120.0° |
| C25 | C34 | O35 | 117.1° | 120.0° |
| C25 | N24 | N23 | 120.9° | 126.6° |
| C25 | N24 | C37 | 130.6° | 126.6° |
| C34 | O35 | C36 | 117.3° | 117.0° |
| N23 | N24 | C37 | 108.6° | 106.7° |
| N24 | N23 | N22 | 109.1° | 108.4° |
| N24 | C37 | C38 | 122.4° | 126.6° |
| N24 | C37 | C21 | 105.2° | 106.8° |
| N23 | N22 | C21 | 110.8° | 109.6° |
| O35 | C36 | H34 | 109.5° | 109.5° |
| O35 | C36 | H35 | 109.5° | 109.6° |
| O35 | C36 | H36 | 109.5° | 109.5° |
| C38 | C37 | C21 | 132.3° | 126.6° |
| C37 | C38 | H37 | 109.5° | 109.4° |
| C37 | C38 | H38 | 109.5° | 109.5° |
| C37 | C38 | H39 | 109.5° | 109.5° |
| C37 | C21 | N22 | 106.2° | 108.4° |
| C37 | C21 | C19 | 132.1° | 125.8° |
| N22 | C21 | C19 | 121.6° | 125.8° |
| C21 | C19 | O20 | 119.2° | 120.0° |
| C21 | C19 | N18 | 117.9° | 120.0° |
| C01 | C02 | C03 | 115.7° | 109.5° |
| C02 | C01 | H1 | 109.5° | 109.5° |
| C02 | C01 | H2 | 109.5° | 109.4° |
| C02 | C01 | H3 | 109.5° | 109.5° |
| C01 | C02 | H4 | 107.9° | 109.5° |
| C01 | C02 | H5 | 107.9° | 109.5° |
| C02 | C03 | C04 | 113.3° | 109.5° |
| C03 | C02 | H4 | 107.9° | 109.4° |
| C03 | C02 | H5 | 107.9° | 109.5° |
| C02 | C03 | H24 | 108.5° | 109.4° |
| C02 | C03 | H25 | 108.5° | 109.5° |
| C03 | C04 | C05 | 107.2° | 109.5° |
| C03 | C04 | O07 | 109.0° | 109.5° |
| C03 | C04 | H6 | 109.5° | 109.4° |
| C04 | C03 | H24 | 108.5° | 109.5° |
| C04 | C03 | H25 | 108.5° | 109.5° |
| O20 | C19 | N18 | 122.9° | 120.0° |
| C19 | N18 | C17 | 129.7° | 120.0° |
| C19 | N18 | H40 | 115.2° | 120.0° |
| C04 | C05 | C06 | 111.8° | 109.5° |
| C05 | C04 | O07 | 109.7° | 109.5° |
| C05 | C04 | H6 | 109.8° | 109.5° |
| C04 | C05 | H7 | 108.9° | 109.4° |
| C04 | C05 | H8 | 108.9° | 109.5° |
| C06 | C05 | H7 | 108.9° | 109.5° |
| C06 | C05 | H8 | 108.9° | 109.5° |
| C05 | C06 | H9 | 109.5° | 109.4° |
| C05 | C06 | H10 | 109.4° | 109.4° |
| C05 | C06 | H11 | 109.5° | 109.5° |
| C04 | O07 | C08 | 122.1° | 117.0° |
| O07 | C04 | H6 | 111.4° | 109.5° |
| N18 | C17 | C08 | 121.7° | 120.1° |
| N18 | C17 | C16 | 119.3° | 120.1° |
| C17 | N18 | H40 | 115.1° | 120.0° |
| O07 | C08 | C17 | 120.6° | 120.1° |
| O07 | C08 | C09 | 123.3° | 120.0° |
| C08 | C17 | C16 | 118.9° | 119.8° |
| C17 | C08 | C09 | 116.1° | 119.9° |
| C17 | C16 | C11 | 125.3° | 120.0° |
| C17 | C16 | H23 | 117.4° | 120.0° |
| C08 | C09 | C10 | 123.5° | 120.0° |
| C08 | C09 | H12 | 118.2° | 120.1° |
| C16 | C11 | C10 | 113.7° | 120.1° |
| C16 | C11 | C12 | 125.9° | 119.9° |
| C11 | C16 | H23 | 117.3° | 120.1° |
| C09 | C10 | C11 | 122.5° | 120.2° |
| C10 | C09 | H12 | 118.3° | 120.0° |
| C09 | C10 | H13 | 118.8° | 119.9° |
| C10 | C11 | C12 | 120.4° | 120.0° |
| C11 | C10 | H13 | 118.7° | 119.8° |
| C11 | C12 | C13 | 113.8° | 109.5° |
| C11 | C12 | C14 | 115.6° | 109.5° |
| C11 | C12 | C15 | 111.5° | 109.4° |
| C13 | C12 | C14 | 103.8° | 109.5° |
| C13 | C12 | C15 | 105.2° | 109.5° |
| C12 | C13 | H14 | 109.5° | 109.4° |
| C12 | C13 | H15 | 109.4° | 109.5° |
| C12 | C13 | H16 | 109.4° | 109.5° |
| C14 | C12 | C15 | 106.0° | 109.5° |
| C12 | C14 | H17 | 109.5° | 109.5° |
| C12 | C14 | H18 | 109.5° | 109.5° |
| C12 | C14 | H19 | 109.5° | 109.4° |
| C12 | C15 | H20 | 109.5° | 109.5° |
| C12 | C15 | H21 | 109.4° | 109.5° |
| C12 | C15 | H22 | 109.5° | 109.5° |
| H1 | C01 | H2 | 109.5° | 109.4° |
| H1 | C01 | H3 | 109.4° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.5° |
| H4 | C02 | H5 | 109.4° | 109.5° |
| H7 | C05 | H8 | 109.5° | 109.5° |
| H9 | C06 | H10 | 109.5° | 109.4° |
| H9 | C06 | H11 | 109.5° | 109.5° |
| H10 | C06 | H11 | 109.5° | 109.5° |
| H14 | C13 | H15 | 109.5° | 109.4° |
| H14 | C13 | H16 | 109.5° | 109.5° |
| H15 | C13 | H16 | 109.5° | 109.5° |
| H17 | C14 | H18 | 109.5° | 109.5° |
| H17 | C14 | H19 | 109.5° | 109.5° |
| H18 | C14 | H19 | 109.5° | 109.5° |
| H20 | C15 | H21 | 109.5° | 109.4° |
| H20 | C15 | H22 | 109.5° | 109.5° |
| H21 | C15 | H22 | 109.5° | 109.4° |
| H24 | C03 | H25 | 109.5° | 109.5° |
| H27 | C29 | H28 | 109.5° | 109.4° |
| H27 | C29 | H29 | 109.4° | 109.5° |
| H28 | C29 | H29 | 109.5° | 109.5° |
| H30 | C32 | H31 | 109.5° | 109.4° |
| H30 | C32 | H32 | 109.5° | 109.5° |
| H31 | C32 | H32 | 109.4° | 109.4° |
| H34 | C36 | H35 | 109.5° | 109.4° |
| H34 | C36 | H36 | 109.5° | 109.4° |
| H35 | C36 | H36 | 109.4° | 109.4° |
| H37 | C38 | H38 | 109.5° | 109.4° |
| H37 | C38 | H39 | 109.5° | 109.5° |
| H38 | C38 | H39 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C29 | O28 | C27 | C30 | 103.2° | 180.0° |
| C29 | O28 | C27 | C26 | 76.9° | 0.0° |
| O28 | C29 | H27 | H28 | 120.0° | 119.9° |
| O28 | C29 | H27 | H29 | 120.0° | 120.1° |
| O28 | C29 | H28 | H29 | 120.0° | 120.1° |
| O28 | C27 | C30 | O31 | 0.3° | 0.0° |
| O28 | C27 | C30 | C26 | 179.9° | 180.0° |
| O28 | C27 | C30 | C33 | 179.8° | 180.0° |
| O28 | C27 | C26 | C25 | 179.8° | 180.0° |
| O28 | C27 | C26 | H26 | 0.2° | 0.0° |
| C27 | O28 | C29 | H27 | 180.0° | 60.1° |
| C27 | O28 | C29 | H28 | 60.0° | 180.0° |
| C27 | O28 | C29 | H29 | 60.0° | 60.0° |
| C32 | O31 | C30 | C27 | 139.9° | 180.0° |
| C32 | O31 | C30 | C33 | 39.6° | 0.1° |
| O31 | C32 | H30 | H31 | 120.0° | 120.0° |
| O31 | C32 | H30 | H32 | 120.0° | 120.0° |
| O31 | C32 | H31 | H32 | 120.0° | 120.0° |
| O31 | C30 | C27 | C33 | 179.5° | 179.9° |
| O31 | C30 | C27 | C26 | 179.8° | 180.0° |
| O31 | C30 | C33 | C34 | 179.8° | 180.0° |
| C30 | O31 | C32 | H30 | 180.0° | 60.0° |
| C30 | O31 | C32 | H31 | 60.0° | 60.1° |
| C30 | O31 | C32 | H32 | 60.0° | 180.0° |
| O31 | C30 | C33 | H33 | 0.2° | 0.0° |
| C30 | C27 | C26 | C25 | 0.1° | 0.0° |
| C27 | C30 | C33 | C34 | 0.3° | 0.0° |
| C30 | C27 | C26 | H26 | 179.9° | 180.0° |
| C27 | C30 | C33 | H33 | 179.8° | 179.9° |
| C26 | C27 | C30 | C33 | 0.3° | 0.0° |
| C27 | C26 | C25 | H26 | 180.0° | 180.0° |
| C27 | C26 | C25 | C34 | 0.5° | 0.0° |
| C27 | C26 | C25 | N24 | 179.6° | 179.7° |
| C30 | C33 | C34 | H33 | 180.0° | 180.0° |
| C30 | C33 | C34 | C25 | 0.1° | 0.0° |
| C30 | C33 | C34 | O35 | 179.8° | 179.7° |
| C26 | C25 | C34 | C33 | 0.5° | 0.0° |
| C26 | C25 | C34 | N24 | 179.1° | 179.7° |
| C26 | C25 | C34 | O35 | 179.8° | 179.7° |
| C26 | C25 | N24 | N23 | 82.7° | 131.7° |
| C26 | C25 | N24 | C37 | 97.4° | 48.3° |
| C33 | C34 | C25 | O35 | 179.7° | 179.7° |
| C33 | C34 | C25 | N24 | 179.6° | 179.7° |
| C33 | C34 | O35 | C36 | 16.4° | 0.2° |
| C34 | C25 | N24 | N23 | 96.4° | 48.1° |
| C34 | C25 | N24 | C37 | 83.4° | 132.0° |
| C25 | C34 | O35 | C36 | 163.9° | 180.0° |
| C34 | C25 | C26 | H26 | 179.5° | 180.0° |
| C25 | C34 | C33 | H33 | 179.8° | 180.0° |
| N24 | C25 | C34 | O35 | 0.7° | 0.0° |
| C25 | N24 | N23 | C37 | 179.9° | 180.0° |
| C25 | N24 | N23 | N22 | 180.0° | 180.0° |
| C25 | N24 | C37 | C38 | 0.3° | 0.1° |
| C25 | N24 | C37 | C21 | 179.9° | 179.9° |
| N24 | C25 | C26 | H26 | 0.4° | 0.3° |
| O35 | C34 | C33 | H33 | 0.2° | 0.3° |
| C34 | O35 | C36 | H34 | 180.0° | 60.0° |
| C34 | O35 | C36 | H35 | 60.0° | 60.0° |
| C34 | O35 | C36 | H36 | 60.0° | 180.0° |
| N23 | N24 | C37 | C38 | 179.8° | 179.8° |
| N23 | N24 | C37 | C21 | 0.2° | 0.2° |
| N24 | N23 | N22 | C21 | 0.1° | 0.2° |
| C37 | N24 | N23 | N22 | 0.1° | 0.0° |
| N24 | C37 | C38 | C21 | 179.4° | 180.0° |
| N24 | C37 | C21 | N22 | 0.3° | 0.3° |
| N24 | C37 | C21 | C19 | 179.9° | 180.0° |
| N24 | C37 | C38 | H37 | 90.2° | 86.0° |
| N24 | C37 | C38 | H38 | 149.8° | 33.9° |
| N24 | C37 | C38 | H39 | 29.7° | 154.0° |
| N23 | N22 | C21 | C37 | 0.3° | 0.3° |
| N23 | N22 | C21 | C19 | 179.9° | 180.0° |
| O35 | C36 | H34 | H35 | 120.0° | 120.1° |
| O35 | C36 | H34 | H36 | 120.0° | 120.0° |
| O35 | C36 | H35 | H36 | 120.0° | 120.1° |
| C38 | C37 | C21 | N22 | 179.8° | 179.7° |
| C38 | C37 | C21 | C19 | 0.4° | 0.0° |
| C37 | C38 | H37 | H38 | 120.0° | 120.0° |
| C37 | C38 | H37 | H39 | 120.0° | 120.0° |
| C37 | C38 | H38 | H39 | 120.0° | 120.1° |
| C37 | C21 | N22 | C19 | 179.8° | 179.7° |
| C37 | C21 | C19 | O20 | 21.7° | 0.0° |
| C37 | C21 | C19 | N18 | 159.2° | 180.0° |
| C21 | C37 | C38 | H37 | 90.3° | 94.0° |
| C21 | C37 | C38 | H38 | 29.7° | 146.1° |
| C21 | C37 | C38 | H39 | 149.7° | 26.0° |
| N22 | C21 | C19 | O20 | 158.5° | 179.7° |
| N22 | C21 | C19 | N18 | 20.6° | 0.3° |
| C21 | C19 | O20 | N18 | 179.0° | 180.0° |
| C21 | C19 | N18 | C17 | 178.8° | 175.2° |
| C21 | C19 | N18 | H40 | 1.2° | 4.8° |
| C01 | C02 | C03 | H4 | 120.9° | 120.0° |
| C01 | C02 | C03 | H5 | 120.9° | 120.0° |
| C01 | C02 | C03 | C04 | 51.2° | NaN° |
| C02 | C01 | H1 | H2 | 120.0° | 119.9° |
| C02 | C01 | H1 | H3 | 120.0° | 120.0° |
| C02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C01 | C02 | H4 | H5 | 117.2° | 120.0° |
| C01 | C02 | C03 | H24 | 171.7° | 60.0° |
| C01 | C02 | C03 | H25 | 69.4° | 59.9° |
| C02 | C03 | C04 | H24 | 120.6° | 119.9° |
| C02 | C03 | C04 | H25 | 120.6° | 120.1° |
| C02 | C03 | C04 | C05 | 96.8° | 175.0° |
| C02 | C03 | C04 | O07 | 144.5° | 65.0° |
| C03 | C02 | C01 | H1 | 180.0° | 59.9° |
| C03 | C02 | C01 | H2 | 60.0° | 60.0° |
| C03 | C02 | C01 | H3 | 60.0° | 180.0° |
| C03 | C02 | H4 | H5 | 117.1° | 120.0° |
| C02 | C03 | C04 | H6 | 22.4° | 55.0° |
| C02 | C03 | H24 | H25 | 118.3° | 120.0° |
| C03 | C04 | C05 | O07 | 118.3° | 120.0° |
| C03 | C04 | C05 | H6 | 118.9° | 119.9° |
| C03 | C04 | C05 | C06 | 118.9° | 175.0° |
| C03 | C04 | O07 | H6 | 121.0° | 120.0° |
| C03 | C04 | O07 | C08 | 93.8° | 144.2° |
| C04 | C03 | C02 | H4 | 69.8° | 60.0° |
| C04 | C03 | C02 | H5 | 172.1° | 60.0° |
| C03 | C04 | C05 | H7 | 1.5° | 65.0° |
| C03 | C04 | C05 | H8 | 120.8° | 54.9° |
| C04 | C03 | H24 | H25 | 118.3° | 120.0° |
| O20 | C19 | N18 | C17 | 0.2° | 4.8° |
| O20 | C19 | N18 | H40 | 179.8° | 175.2° |
| C19 | N18 | C17 | H40 | 180.0° | 180.0° |
| C19 | N18 | C17 | C08 | 144.2° | 147.0° |
| C19 | N18 | C17 | C16 | 35.7° | 33.0° |
| C04 | C05 | C06 | H7 | 120.4° | 120.0° |
| C04 | C05 | C06 | H8 | 120.4° | 120.0° |
| C05 | C04 | O07 | H6 | 121.8° | 120.0° |
| C05 | C04 | O07 | C08 | 149.0° | 95.8° |
| C04 | C05 | H7 | H8 | 118.9° | 120.0° |
| C04 | C05 | C06 | H9 | 180.0° | 60.0° |
| C04 | C05 | C06 | H10 | 60.0° | 60.0° |
| C04 | C05 | C06 | H11 | 60.0° | 180.0° |
| C05 | C04 | C03 | H24 | 142.7° | 65.0° |
| C05 | C04 | C03 | H25 | 23.8° | 54.9° |
| C06 | C05 | C04 | O07 | 0.6° | 65.0° |
| C06 | C05 | C04 | H6 | 122.2° | 55.0° |
| C06 | C05 | H7 | H8 | 118.9° | 120.0° |
| C05 | C06 | H9 | H10 | 120.0° | 119.9° |
| C05 | C06 | H9 | H11 | 120.0° | 120.0° |
| C05 | C06 | H10 | H11 | 120.0° | 120.0° |
| C04 | O07 | C08 | C17 | 130.5° | 177.9° |
| C04 | O07 | C08 | C09 | 50.1° | 2.3° |
| O07 | C04 | C05 | H7 | 119.8° | 55.0° |
| O07 | C04 | C05 | H8 | 120.9° | 175.0° |
| O07 | C04 | C03 | H24 | 23.9° | 55.0° |
| O07 | C04 | C03 | H25 | 94.9° | 175.0° |
| N18 | C17 | C08 | O07 | 0.5° | 0.2° |
| N18 | C17 | C08 | C16 | 179.9° | 180.0° |
| N18 | C17 | C08 | C09 | 179.9° | 180.0° |
| N18 | C17 | C16 | C11 | 180.0° | 180.0° |
| N18 | C17 | C16 | H23 | 0.0° | 0.0° |
| O07 | C08 | C17 | C09 | 179.4° | 179.8° |
| O07 | C08 | C17 | C16 | 179.7° | 179.8° |
| O07 | C08 | C09 | C10 | 179.7° | 179.8° |
| C08 | O07 | C04 | H6 | 27.2° | 24.2° |
| O07 | C08 | C09 | H12 | 0.3° | 0.2° |
| C08 | C17 | C16 | C11 | 0.1° | 0.0° |
| C17 | C08 | C09 | C10 | 0.3° | 0.0° |
| C17 | C08 | C09 | H12 | 179.7° | 180.0° |
| C08 | C17 | C16 | H23 | 179.9° | 180.0° |
| C08 | C17 | N18 | H40 | 35.8° | 33.1° |
| C16 | C17 | C08 | C09 | 0.3° | 0.0° |
| C17 | C16 | C11 | H23 | 180.0° | 180.0° |
| C17 | C16 | C11 | C10 | 0.0° | 0.0° |
| C17 | C16 | C11 | C12 | 179.9° | 180.0° |
| C16 | C17 | N18 | H40 | 144.3° | 147.0° |
| C08 | C09 | C10 | H12 | 180.0° | 180.0° |
| C08 | C09 | C10 | C11 | 0.2° | 0.0° |
| C08 | C09 | C10 | H13 | 179.7° | 179.9° |
| C16 | C11 | C10 | C09 | 0.0° | 0.0° |
| C16 | C11 | C10 | C12 | 179.9° | 180.0° |
| C16 | C11 | C12 | C13 | 32.4° | 59.9° |
| C16 | C11 | C12 | C14 | 152.4° | 180.0° |
| C16 | C11 | C12 | C15 | 86.4° | 60.0° |
| C16 | C11 | C10 | H13 | 179.9° | 179.9° |
| C09 | C10 | C11 | H13 | 180.0° | 179.9° |
| C09 | C10 | C11 | C12 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 147.6° | 120.0° |
| C10 | C11 | C12 | C14 | 27.6° | 0.0° |
| C10 | C11 | C12 | C15 | 93.7° | 120.0° |
| C11 | C10 | C09 | H12 | 179.8° | 180.0° |
| C10 | C11 | C16 | H23 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 126.5° | 120.0° |
| C11 | C12 | C13 | C15 | 122.3° | 120.0° |
| C11 | C12 | C14 | C15 | 124.1° | 120.0° |
| C12 | C11 | C10 | H13 | 0.0° | 0.0° |
| C11 | C12 | C13 | H14 | 180.0° | 60.0° |
| C11 | C12 | C13 | H15 | 60.0° | 180.0° |
| C11 | C12 | C13 | H16 | 60.0° | 60.0° |
| C11 | C12 | C14 | H17 | 180.0° | 60.0° |
| C11 | C12 | C14 | H18 | 60.0° | 180.0° |
| C11 | C12 | C14 | H19 | 60.0° | 60.0° |
| C11 | C12 | C15 | H20 | 180.0° | 60.0° |
| C11 | C12 | C15 | H21 | 60.0° | 180.0° |
| C11 | C12 | C15 | H22 | 60.0° | 60.0° |
| C12 | C11 | C16 | H23 | 0.0° | 0.1° |
| C13 | C12 | C14 | C15 | 110.5° | 120.0° |
| C12 | C13 | H14 | H15 | 120.0° | 120.0° |
| C12 | C13 | H14 | H16 | 120.0° | 120.0° |
| C12 | C13 | H15 | H16 | 120.0° | 120.1° |
| C13 | C12 | C14 | H17 | 54.7° | 180.0° |
| C13 | C12 | C14 | H18 | 174.7° | 59.9° |
| C13 | C12 | C14 | H19 | 65.3° | 60.0° |
| C13 | C12 | C15 | H20 | 56.2° | 59.9° |
| C13 | C12 | C15 | H21 | 63.8° | 60.0° |
| C13 | C12 | C15 | H22 | 176.2° | 180.0° |
| C14 | C12 | C13 | H14 | 53.5° | 60.0° |
| C14 | C12 | C13 | H15 | 66.5° | 59.9° |
| C14 | C12 | C13 | H16 | 173.5° | 180.0° |
| C12 | C14 | H17 | H18 | 120.0° | 120.0° |
| C12 | C14 | H17 | H19 | 120.0° | 120.0° |
| C12 | C14 | H18 | H19 | 120.0° | 119.9° |
| C14 | C12 | C15 | H20 | 53.4° | 180.0° |
| C14 | C12 | C15 | H21 | 173.4° | 60.0° |
| C14 | C12 | C15 | H22 | 66.7° | 60.0° |
| C15 | C12 | C13 | H14 | 57.7° | 180.0° |
| C15 | C12 | C13 | H15 | 177.7° | 60.1° |
| C15 | C12 | C13 | H16 | 62.4° | 60.0° |
| C15 | C12 | C14 | H17 | 55.9° | 60.0° |
| C15 | C12 | C14 | H18 | 64.1° | 60.0° |
| C15 | C12 | C14 | H19 | 175.9° | 180.0° |
| C12 | C15 | H20 | H21 | 120.0° | 120.0° |
| C12 | C15 | H20 | H22 | 120.0° | 120.0° |
| C12 | C15 | H21 | H22 | 120.0° | 120.0° |
| H1 | C01 | H2 | H3 | 119.9° | 120.0° |
| H1 | C01 | C02 | H4 | 59.1° | 60.0° |
| H1 | C01 | C02 | H5 | 59.1° | 180.0° |
| H2 | C01 | C02 | H4 | 60.9° | 180.0° |
| H2 | C01 | C02 | H5 | 179.1° | 60.0° |
| H3 | C01 | C02 | H4 | 179.1° | 60.0° |
| H3 | C01 | C02 | H5 | 60.9° | 60.0° |
| H4 | C02 | C03 | H24 | 50.8° | 180.0° |
| H4 | C02 | C03 | H25 | 169.7° | 60.0° |
| H5 | C02 | C03 | H24 | 67.4° | 60.0° |
| H5 | C02 | C03 | H25 | 51.5° | 180.0° |
| H6 | C04 | C05 | H7 | 117.5° | 175.0° |
| H6 | C04 | C05 | H8 | 1.8° | 65.0° |
| H6 | C04 | C03 | H24 | 98.2° | 175.0° |
| H6 | C04 | C03 | H25 | 142.9° | 65.0° |
| H7 | C05 | C06 | H9 | 59.6° | 179.9° |
| H7 | C05 | C06 | H10 | 179.6° | 60.0° |
| H7 | C05 | C06 | H11 | 60.4° | 60.0° |
| H8 | C05 | C06 | H9 | 59.7° | 60.0° |
| H8 | C05 | C06 | H10 | 60.3° | 180.0° |
| H8 | C05 | C06 | H11 | 179.7° | 60.0° |
| H9 | C06 | H10 | H11 | 120.0° | 120.1° |
| H12 | C09 | C10 | H13 | 0.2° | 0.1° |
| H14 | C13 | H15 | H16 | 120.1° | 120.0° |
| H17 | C14 | H18 | H19 | 120.0° | 120.0° |
| H20 | C15 | H21 | H22 | 120.0° | 120.0° |
| H27 | C29 | H28 | H29 | 120.0° | 120.0° |
| H30 | C32 | H31 | H32 | 120.0° | 120.0° |
| H34 | C36 | H35 | H36 | 120.0° | 119.9° |
| H37 | C38 | H38 | H39 | 120.0° | 120.0° |
