VYQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C34 | C32 | sing | 1.53Å | 1.53Å | |
| C34 | C35 | sing | 1.53Å | 1.53Å | |
| F33 | C32 | sing | 1.40Å | 1.37Å | |
| C32 | C35 | sing | 1.53Å | 1.53Å | |
| C32 | C31 | sing | 1.51Å | 1.55Å | |
| C29 | C26 | sing | 1.53Å | 1.55Å | |
| C31 | O36 | doub | 1.21Å | 1.18Å | |
| C31 | N30 | sing | 1.35Å | 1.47Å | |
| N30 | C25 | sing | 1.46Å | 1.44Å | |
| C27 | C26 | sing | 1.53Å | 1.55Å | |
| C26 | C25 | sing | 1.53Å | 1.54Å | |
| C26 | C28 | sing | 1.53Å | 1.55Å | |
| C25 | C24 | sing | 1.51Å | 1.53Å | |
| C24 | O37 | doub | 1.21Å | 1.18Å | |
| C24 | N23 | sing | 1.35Å | 1.48Å | |
| C38 | N23 | sing | 1.47Å | 1.50Å | |
| C38 | C02 | sing | 1.55Å | 1.52Å | |
| N23 | C04 | sing | 1.47Å | 1.49Å | |
| C02 | O01 | sing | 1.43Å | 1.41Å | |
| C02 | C03 | sing | 1.55Å | 1.49Å | |
| C04 | C05 | sing | 1.51Å | 1.52Å | |
| C04 | C03 | sing | 1.54Å | 1.50Å | |
| O22 | C05 | doub | 1.21Å | 1.18Å | |
| C05 | N06 | sing | 1.35Å | 1.48Å | |
| N06 | C07 | sing | 1.46Å | 1.45Å | |
| C07 | C08 | sing | 1.53Å | 1.52Å | |
| C07 | C09 | sing | 1.51Å | 1.53Å | |
| C21 | C20 | sing | 1.51Å | 1.54Å | |
| C09 | C20 | doub | 1.38Å | 1.33Å | Aromatic |
| C09 | C10 | sing | 1.38Å | 1.53Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.54Å | Aromatic |
| C10 | C11 | doub | 1.38Å | 1.32Å | Aromatic |
| C19 | C12 | doub | 1.39Å | 1.33Å | Aromatic |
| C11 | C12 | sing | 1.40Å | 1.54Å | Aromatic |
| C12 | C13 | sing | 1.48Å | 1.54Å | |
| C13 | S18 | sing | 1.76Å | 1.62Å | Aromatic |
| C13 | C14 | doub | 1.35Å | 1.45Å | Aromatic |
| S18 | C17 | sing | 1.71Å | 1.66Å | Aromatic |
| C14 | C15 | sing | 1.51Å | 1.54Å | |
| C14 | N16 | sing | 1.31Å | 1.55Å | Aromatic |
| C17 | N16 | doub | 1.29Å | 1.42Å | Aromatic |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C15 | H2 | sing | 1.09Å | 1.10Å | |
| C15 | H3 | sing | 1.09Å | 1.10Å | |
| C15 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.08Å | 1.08Å | |
| C21 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C28 | H9 | sing | 1.09Å | 1.10Å | |
| C28 | H10 | sing | 1.09Å | 1.10Å | |
| C28 | H11 | sing | 1.09Å | 1.10Å | |
| C02 | H12 | sing | 1.09Å | 1.10Å | |
| C03 | H13 | sing | 1.09Å | 1.10Å | |
| C03 | H14 | sing | 1.09Å | 1.10Å | |
| C04 | H15 | sing | 1.09Å | 1.10Å | |
| C07 | H16 | sing | 1.09Å | 1.10Å | |
| C08 | H17 | sing | 1.09Å | 1.10Å | |
| C08 | H18 | sing | 1.09Å | 1.10Å | |
| C08 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.08Å | 1.08Å | |
| C19 | H21 | sing | 1.08Å | 1.08Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C27 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.09Å | 1.10Å | |
| C34 | H29 | sing | 1.09Å | 1.10Å | |
| C34 | H30 | sing | 1.09Å | 1.10Å | |
| C35 | H31 | sing | 1.09Å | 1.10Å | |
| C35 | H32 | sing | 1.09Å | 1.10Å | |
| C38 | H33 | sing | 1.09Å | 1.10Å | |
| C38 | H34 | sing | 1.09Å | 1.10Å | |
| N06 | H35 | sing | 0.97Å | 1.00Å | |
| N30 | H36 | sing | 0.97Å | 1.00Å | |
| O01 | H37 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C32 | C34 | C35 | 60.0° | 60.0° |
| C34 | C32 | F33 | 115.3° | 117.5° |
| C34 | C32 | C35 | 60.1° | 60.0° |
| C34 | C32 | C31 | 115.9° | 117.5° |
| C32 | C34 | H29 | 120.0° | 117.6° |
| C32 | C34 | H30 | 120.0° | 117.5° |
| C34 | C35 | C32 | 59.9° | 60.0° |
| C35 | C34 | H29 | 120.0° | 117.5° |
| C35 | C34 | H30 | 120.0° | 117.5° |
| C34 | C35 | H31 | 120.0° | 117.5° |
| C34 | C35 | H32 | 120.0° | 117.5° |
| F33 | C32 | C35 | 115.7° | 117.5° |
| F33 | C32 | C31 | 119.8° | 115.5° |
| C35 | C32 | C31 | 116.0° | 117.5° |
| C32 | C35 | H31 | 120.0° | 117.4° |
| C32 | C35 | H32 | 120.0° | 117.5° |
| C32 | C31 | O36 | 120.8° | 120.0° |
| C32 | C31 | N30 | 118.9° | 120.0° |
| C29 | C26 | C27 | 109.3° | 109.5° |
| C29 | C26 | C25 | 109.0° | 109.4° |
| C29 | C26 | C28 | 109.3° | 109.4° |
| C26 | C29 | H26 | 109.5° | 109.4° |
| C26 | C29 | H27 | 109.5° | 109.5° |
| C26 | C29 | H28 | 109.5° | 109.5° |
| O36 | C31 | N30 | 120.2° | 120.0° |
| C31 | N30 | C25 | 120.3° | 120.0° |
| C31 | N30 | H36 | 119.8° | 120.0° |
| N30 | C25 | C26 | 108.5° | 109.5° |
| N30 | C25 | C24 | 108.2° | 109.4° |
| N30 | C25 | H22 | 110.5° | 109.5° |
| C25 | N30 | H36 | 119.8° | 120.0° |
| C27 | C26 | C25 | 109.2° | 109.5° |
| C27 | C26 | C28 | 109.4° | 109.5° |
| C26 | C27 | H23 | 109.5° | 109.5° |
| C26 | C27 | H24 | 109.5° | 109.5° |
| C26 | C27 | H25 | 109.5° | 109.4° |
| C25 | C26 | C28 | 110.7° | 109.5° |
| C26 | C25 | C24 | 111.2° | 109.5° |
| C26 | C25 | H22 | 109.1° | 109.5° |
| C26 | C28 | H9 | 109.5° | 109.5° |
| C26 | C28 | H10 | 109.5° | 109.5° |
| C26 | C28 | H11 | 109.5° | 109.4° |
| C25 | C24 | O37 | 120.6° | 120.0° |
| C25 | C24 | N23 | 119.4° | 120.0° |
| C24 | C25 | H22 | 109.3° | 109.4° |
| O37 | C24 | N23 | 120.0° | 120.0° |
| C24 | N23 | C38 | 125.8° | 125.7° |
| C24 | N23 | C04 | 126.4° | 125.6° |
| N23 | C38 | C02 | 104.8° | 104.9° |
| C38 | N23 | C04 | 107.8° | 108.7° |
| N23 | C38 | H33 | 110.6° | 110.4° |
| N23 | C38 | H34 | 110.6° | 110.4° |
| C38 | C02 | O01 | 108.0° | 111.0° |
| C38 | C02 | C03 | 107.7° | 101.6° |
| C38 | C02 | H12 | 110.1° | 111.1° |
| C02 | C38 | H33 | 110.6° | 110.3° |
| C02 | C38 | H34 | 110.6° | 110.3° |
| N23 | C04 | C05 | 110.8° | 109.9° |
| N23 | C04 | C03 | 108.9° | 107.3° |
| N23 | C04 | H15 | 109.3° | 110.0° |
| O01 | C02 | C03 | 108.5° | 111.0° |
| O01 | C02 | H12 | 111.8° | 110.8° |
| C02 | O01 | H37 | 109.5° | 114.0° |
| C02 | C03 | C04 | 104.0° | 102.9° |
| C03 | C02 | H12 | 110.6° | 111.0° |
| C02 | C03 | H13 | 110.8° | 110.8° |
| C02 | C03 | H14 | 110.8° | 110.7° |
| C05 | C04 | C03 | 109.8° | 109.9° |
| C04 | C05 | O22 | 120.7° | 120.0° |
| C04 | C05 | N06 | 119.0° | 120.0° |
| C05 | C04 | H15 | 108.9° | 109.9° |
| C04 | C03 | H13 | 110.8° | 110.7° |
| C04 | C03 | H14 | 110.8° | 110.8° |
| C03 | C04 | H15 | 109.2° | 109.9° |
| O22 | C05 | N06 | 120.3° | 120.0° |
| C05 | N06 | C07 | 120.5° | 120.0° |
| C05 | N06 | H35 | 119.7° | 120.0° |
| N06 | C07 | C08 | 108.1° | 109.4° |
| N06 | C07 | C09 | 106.3° | 109.5° |
| N06 | C07 | H16 | 112.0° | 109.5° |
| C07 | N06 | H35 | 119.8° | 120.0° |
| C08 | C07 | C09 | 108.5° | 109.4° |
| C08 | C07 | H16 | 111.0° | 109.5° |
| C07 | C08 | H17 | 109.5° | 109.5° |
| C07 | C08 | H18 | 109.5° | 109.5° |
| C07 | C08 | H19 | 109.5° | 109.5° |
| C07 | C09 | C20 | 120.9° | 119.9° |
| C07 | C09 | C10 | 118.8° | 119.8° |
| C09 | C07 | H16 | 110.8° | 109.5° |
| C21 | C20 | C09 | 120.0° | 119.9° |
| C21 | C20 | C19 | 120.1° | 119.9° |
| C20 | C21 | H6 | 109.5° | 109.5° |
| C20 | C21 | H7 | 109.5° | 109.5° |
| C20 | C21 | H8 | 109.5° | 109.4° |
| C20 | C09 | C10 | 120.3° | 120.3° |
| C09 | C20 | C19 | 119.9° | 120.1° |
| C09 | C10 | C11 | 119.7° | 120.1° |
| C09 | C10 | H1 | 120.1° | 120.0° |
| C20 | C19 | C12 | 119.6° | 119.9° |
| C20 | C19 | H21 | 120.2° | 120.1° |
| C10 | C11 | C12 | 120.0° | 119.8° |
| C11 | C10 | H1 | 120.1° | 119.9° |
| C10 | C11 | H20 | 120.0° | 120.0° |
| C19 | C12 | C11 | 120.4° | 119.7° |
| C19 | C12 | C13 | 120.5° | 120.2° |
| C12 | C19 | H21 | 120.2° | 120.0° |
| C11 | C12 | C13 | 119.1° | 120.1° |
| C12 | C11 | H20 | 120.0° | 120.1° |
| C12 | C13 | S18 | 124.4° | 126.1° |
| C12 | C13 | C14 | 126.5° | 126.1° |
| S18 | C13 | C14 | 109.2° | 107.8° |
| C13 | S18 | C17 | 101.5° | 90.3° |
| C13 | C14 | C15 | 125.4° | 122.8° |
| C13 | C14 | N16 | 109.6° | 114.3° |
| S18 | C17 | N16 | 108.8° | 110.4° |
| S18 | C17 | H5 | 125.6° | 124.9° |
| C15 | C14 | N16 | 125.0° | 122.9° |
| C14 | C15 | H2 | 109.5° | 109.5° |
| C14 | C15 | H3 | 109.5° | 109.5° |
| C14 | C15 | H4 | 109.5° | 109.5° |
| C14 | N16 | C17 | 111.0° | 117.2° |
| N16 | C17 | H5 | 125.6° | 124.8° |
| H2 | C15 | H3 | 109.4° | 109.4° |
| H2 | C15 | H4 | 109.4° | 109.5° |
| H3 | C15 | H4 | 109.5° | 109.5° |
| H6 | C21 | H7 | 109.5° | 109.5° |
| H6 | C21 | H8 | 109.5° | 109.4° |
| H7 | C21 | H8 | 109.5° | 109.5° |
| H9 | C28 | H10 | 109.5° | 109.5° |
| H9 | C28 | H11 | 109.5° | 109.5° |
| H10 | C28 | H11 | 109.5° | 109.4° |
| H13 | C03 | H14 | 109.5° | 110.7° |
| H17 | C08 | H18 | 109.4° | 109.5° |
| H17 | C08 | H19 | 109.5° | 109.4° |
| H18 | C08 | H19 | 109.4° | 109.4° |
| H23 | C27 | H24 | 109.5° | 109.5° |
| H23 | C27 | H25 | 109.5° | 109.5° |
| H24 | C27 | H25 | 109.5° | 109.5° |
| H26 | C29 | H27 | 109.5° | 109.5° |
| H26 | C29 | H28 | 109.5° | 109.5° |
| H27 | C29 | H28 | 109.4° | 109.5° |
| H29 | C34 | H30 | 109.4° | 115.6° |
| H31 | C35 | H32 | 109.4° | 115.6° |
| H33 | C38 | H34 | 109.5° | 110.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C32 | C34 | C35 | H29 | 109.5° | 107.6° |
| C32 | C34 | C35 | H30 | 109.5° | 107.5° |
| C34 | C32 | F33 | C35 | 67.3° | 68.7° |
| C34 | C32 | F33 | C31 | 145.9° | 145.6° |
| C34 | C32 | C35 | C31 | 106.3° | 107.5° |
| C34 | C32 | C31 | O36 | 41.8° | 58.7° |
| C34 | C32 | C31 | N30 | 138.5° | 121.4° |
| C32 | C34 | H29 | H30 | 144.7° | 145.8° |
| C32 | C34 | C35 | H31 | 109.5° | 107.4° |
| C32 | C34 | C35 | H32 | 109.5° | 107.5° |
| C35 | C34 | H29 | H30 | 144.7° | 145.6° |
| C34 | C35 | H31 | H32 | 144.8° | 145.8° |
| F33 | C32 | C35 | C31 | 148.1° | 145.0° |
| F33 | C32 | C31 | O36 | 172.5° | 155.7° |
| F33 | C32 | C31 | N30 | 7.2° | 24.3° |
| F33 | C32 | C34 | H29 | 3.2° | 0.1° |
| F33 | C32 | C34 | H30 | 144.2° | 145.1° |
| F33 | C32 | C35 | H31 | 3.8° | 145.0° |
| F33 | C32 | C35 | H32 | 144.9° | 0.0° |
| C35 | C32 | C31 | O36 | 25.8° | 10.0° |
| C35 | C32 | C31 | N30 | 153.9° | 170.0° |
| C32 | C35 | H31 | H32 | 144.8° | 145.7° |
| C32 | C31 | O36 | N30 | 179.7° | 180.0° |
| C32 | C31 | N30 | C25 | 179.9° | 180.0° |
| C31 | C32 | C34 | H29 | 144.1° | 145.0° |
| C31 | C32 | C34 | H30 | 3.0° | 0.1° |
| C31 | C32 | C35 | H31 | 144.2° | 0.0° |
| C31 | C32 | C35 | H32 | 3.2° | 145.0° |
| C32 | C31 | N30 | H36 | 0.1° | 0.1° |
| C29 | C26 | C25 | N30 | 76.0° | 65.8° |
| C29 | C26 | C27 | C25 | 119.1° | 120.0° |
| C29 | C26 | C27 | C28 | 119.6° | 120.0° |
| C29 | C26 | C25 | C28 | 120.2° | 119.9° |
| C29 | C26 | C25 | C24 | 165.1° | 174.2° |
| C29 | C26 | C28 | H9 | 180.0° | 56.0° |
| C29 | C26 | C28 | H10 | 60.0° | 64.1° |
| C29 | C26 | C28 | H11 | 60.0° | 176.0° |
| C29 | C26 | C25 | H22 | 44.5° | 54.2° |
| C29 | C26 | C27 | H23 | 180.0° | 180.0° |
| C29 | C26 | C27 | H24 | 60.0° | 60.0° |
| C29 | C26 | C27 | H25 | 60.0° | 60.0° |
| C26 | C29 | H26 | H27 | 120.0° | 119.9° |
| C26 | C29 | H26 | H28 | 120.0° | 120.0° |
| C26 | C29 | H27 | H28 | 120.0° | 120.0° |
| O36 | C31 | N30 | C25 | 0.2° | 0.1° |
| O36 | C31 | N30 | H36 | 179.8° | 180.0° |
| C31 | N30 | C25 | H36 | 180.0° | 179.9° |
| C31 | N30 | C25 | C26 | 137.9° | 85.0° |
| C31 | N30 | C25 | C24 | 101.3° | 155.0° |
| C31 | N30 | C25 | H22 | 18.3° | 35.1° |
| N30 | C25 | C26 | C27 | 43.4° | 54.2° |
| N30 | C25 | C26 | C24 | 118.9° | 120.0° |
| N30 | C25 | C26 | H22 | 120.5° | 120.0° |
| N30 | C25 | C26 | C28 | 163.8° | 174.2° |
| N30 | C25 | C24 | H22 | 120.4° | 120.0° |
| N30 | C25 | C24 | O37 | 36.9° | 33.0° |
| N30 | C25 | C24 | N23 | 142.5° | 147.0° |
| C27 | C26 | C25 | C28 | 120.5° | 120.0° |
| C27 | C26 | C25 | C24 | 75.6° | 65.8° |
| C27 | C26 | C28 | H9 | 60.3° | 176.0° |
| C27 | C26 | C28 | H10 | 179.6° | 56.0° |
| C27 | C26 | C28 | H11 | 59.7° | 64.0° |
| C27 | C26 | C25 | H22 | 163.8° | 174.2° |
| C26 | C27 | H23 | H24 | 120.0° | 120.0° |
| C26 | C27 | H23 | H25 | 120.0° | 120.0° |
| C26 | C27 | H24 | H25 | 120.0° | 120.0° |
| C27 | C26 | C29 | H26 | 180.0° | 60.0° |
| C27 | C26 | C29 | H27 | 60.0° | 60.0° |
| C27 | C26 | C29 | H28 | 60.0° | 180.0° |
| C26 | C25 | C24 | H22 | 120.5° | 120.0° |
| C26 | C25 | C24 | O37 | 82.1° | 87.0° |
| C26 | C25 | C24 | N23 | 98.5° | 93.0° |
| C25 | C26 | C28 | H9 | 60.0° | 64.0° |
| C25 | C26 | C28 | H10 | 60.0° | 176.0° |
| C25 | C26 | C28 | H11 | 180.0° | 56.1° |
| C25 | C26 | C27 | H23 | 60.8° | 60.0° |
| C25 | C26 | C27 | H24 | 179.1° | 180.0° |
| C25 | C26 | C27 | H25 | 59.2° | 60.0° |
| C25 | C26 | C29 | H26 | 60.8° | 60.0° |
| C25 | C26 | C29 | H27 | 59.3° | 180.0° |
| C25 | C26 | C29 | H28 | 179.2° | 60.0° |
| C26 | C25 | N30 | H36 | 42.0° | 94.9° |
| C28 | C26 | C25 | C24 | 44.9° | 54.2° |
| C26 | C28 | H9 | H10 | 120.0° | 120.0° |
| C26 | C28 | H9 | H11 | 120.0° | 120.0° |
| C26 | C28 | H10 | H11 | 120.0° | 119.9° |
| C28 | C26 | C25 | H22 | 75.7° | 65.7° |
| C28 | C26 | C27 | H23 | 60.4° | 60.0° |
| C28 | C26 | C27 | H24 | 59.6° | 60.0° |
| C28 | C26 | C27 | H25 | 179.6° | 180.0° |
| C28 | C26 | C29 | H26 | 60.3° | 180.0° |
| C28 | C26 | C29 | H27 | 179.6° | 60.0° |
| C28 | C26 | C29 | H28 | 59.7° | 60.0° |
| C25 | C24 | O37 | N23 | 179.4° | 180.0° |
| C25 | C24 | N23 | C38 | 0.2° | 4.9° |
| C25 | C24 | N23 | C04 | 179.4° | 175.2° |
| C24 | C25 | N30 | H36 | 78.7° | 25.1° |
| O37 | C24 | N23 | C38 | 179.6° | 175.2° |
| O37 | C24 | N23 | C04 | 0.1° | 4.8° |
| O37 | C24 | C25 | H22 | 157.4° | 153.0° |
| C24 | N23 | C38 | C04 | 179.6° | 180.0° |
| C24 | N23 | C38 | C02 | 169.7° | 155.9° |
| C24 | N23 | C04 | C05 | 53.1° | 61.7° |
| C24 | N23 | C04 | C03 | 173.9° | 178.9° |
| C24 | N23 | C04 | H15 | 66.9° | 59.4° |
| N23 | C24 | C25 | H22 | 22.1° | 27.0° |
| C24 | N23 | C38 | H33 | 50.4° | 85.3° |
| C24 | N23 | C38 | H34 | 71.1° | 37.0° |
| N23 | C38 | C02 | H33 | 119.2° | 118.9° |
| N23 | C38 | C02 | H34 | 119.3° | 118.9° |
| N23 | C38 | C02 | O01 | 93.9° | 81.0° |
| N23 | C38 | C02 | C03 | 23.0° | 37.0° |
| C38 | N23 | C04 | C05 | 127.3° | 118.3° |
| C38 | N23 | C04 | C03 | 6.4° | 1.1° |
| N23 | C38 | C02 | H12 | 143.7° | 155.2° |
| C38 | N23 | C04 | H15 | 112.7° | 120.6° |
| N23 | C38 | H33 | H34 | 122.1° | 122.3° |
| C02 | C38 | N23 | C04 | 10.0° | 24.1° |
| C38 | C02 | O01 | C03 | 116.4° | 112.2° |
| C38 | C02 | O01 | H12 | 121.3° | 123.9° |
| C38 | C02 | C03 | H12 | 120.4° | 118.2° |
| C38 | C02 | C03 | C04 | 26.6° | 35.5° |
| C38 | C02 | C03 | H13 | 145.8° | 153.8° |
| C38 | C02 | C03 | H14 | 92.5° | 83.0° |
| C02 | C38 | H33 | H34 | 122.2° | 122.2° |
| C38 | C02 | O01 | H37 | 180.0° | 67.8° |
| N23 | C04 | C03 | C02 | 20.4° | 22.1° |
| N23 | C04 | C05 | C03 | 120.3° | 117.8° |
| N23 | C04 | C05 | H15 | 120.3° | 121.2° |
| N23 | C04 | C03 | H15 | 119.3° | 119.6° |
| N23 | C04 | C05 | O22 | 46.1° | 0.8° |
| N23 | C04 | C05 | N06 | 134.1° | 179.3° |
| N23 | C04 | C03 | H13 | 139.5° | 140.5° |
| N23 | C04 | C03 | H14 | 98.8° | 96.2° |
| C04 | N23 | C38 | H33 | 129.2° | 94.7° |
| C04 | N23 | C38 | H34 | 109.3° | 143.0° |
| O01 | C02 | C03 | H12 | 123.0° | 123.8° |
| O01 | C02 | C03 | C04 | 89.9° | 82.6° |
| O01 | C02 | C03 | H13 | 29.2° | 35.8° |
| O01 | C02 | C03 | H14 | 150.9° | 158.9° |
| O01 | C02 | C38 | H33 | 25.3° | 160.0° |
| O01 | C02 | C38 | H34 | 146.8° | 37.8° |
| C02 | C03 | C04 | C05 | 141.8° | 141.6° |
| C02 | C03 | C04 | H13 | 119.1° | 118.4° |
| C02 | C03 | C04 | H14 | 119.1° | 118.4° |
| C02 | C03 | H13 | H14 | 122.5° | 123.2° |
| C02 | C03 | C04 | H15 | 98.9° | 97.4° |
| C03 | C02 | C38 | H33 | 142.2° | 81.9° |
| C03 | C02 | C38 | H34 | 96.3° | 155.9° |
| C03 | C02 | O01 | H37 | 63.6° | 180.0° |
| C05 | C04 | C03 | H15 | 119.3° | 121.0° |
| C04 | C05 | O22 | N06 | 179.8° | 180.0° |
| C04 | C05 | N06 | C07 | 179.5° | 180.0° |
| C05 | C04 | C03 | H13 | 99.1° | 100.0° |
| C05 | C04 | C03 | H14 | 22.7° | 23.2° |
| C04 | C05 | N06 | H35 | 0.5° | 0.0° |
| C03 | C04 | C05 | O22 | 74.2° | 118.6° |
| C03 | C04 | C05 | N06 | 105.6° | 61.4° |
| C04 | C03 | C02 | H12 | 147.1° | 153.6° |
| C04 | C03 | H13 | H14 | 122.5° | 123.3° |
| O22 | C05 | N06 | C07 | 0.4° | 0.0° |
| O22 | C05 | C04 | H15 | 166.3° | 120.4° |
| O22 | C05 | N06 | H35 | 179.6° | 179.9° |
| C05 | N06 | C07 | H35 | 180.0° | 180.0° |
| C05 | N06 | C07 | C08 | 155.7° | 88.5° |
| C05 | N06 | C07 | C09 | 88.0° | 151.5° |
| N06 | C05 | C04 | H15 | 13.8° | 59.5° |
| C05 | N06 | C07 | H16 | 33.2° | 31.4° |
| N06 | C07 | C08 | C09 | 114.8° | 120.0° |
| N06 | C07 | C08 | H16 | 123.2° | 120.0° |
| N06 | C07 | C09 | H16 | 121.9° | 120.0° |
| N06 | C07 | C09 | C20 | 143.0° | 145.7° |
| N06 | C07 | C09 | C10 | 36.8° | 34.2° |
| N06 | C07 | C08 | H17 | 180.0° | 60.0° |
| N06 | C07 | C08 | H18 | 60.0° | 179.9° |
| N06 | C07 | C08 | H19 | 60.0° | 60.0° |
| C08 | C07 | C09 | H16 | 122.0° | 120.0° |
| C08 | C07 | C09 | C20 | 100.9° | 94.3° |
| C08 | C07 | C09 | C10 | 79.3° | 85.8° |
| C07 | C08 | H17 | H18 | 120.0° | 120.1° |
| C07 | C08 | H17 | H19 | 120.0° | 120.0° |
| C07 | C08 | H18 | H19 | 120.0° | 120.0° |
| C08 | C07 | N06 | H35 | 24.3° | 91.4° |
| C07 | C09 | C20 | C21 | 0.0° | 0.2° |
| C07 | C09 | C20 | C10 | 179.8° | 179.9° |
| C07 | C09 | C20 | C19 | 179.8° | 179.4° |
| C07 | C09 | C10 | C11 | 180.0° | 179.9° |
| C07 | C09 | C10 | H1 | 0.0° | 0.4° |
| C09 | C07 | C08 | H17 | 65.2° | 60.0° |
| C09 | C07 | C08 | H18 | 174.8° | 60.1° |
| C09 | C07 | C08 | H19 | 54.9° | 180.0° |
| C09 | C07 | N06 | H35 | 92.0° | 28.6° |
| C21 | C20 | C09 | C19 | 179.9° | 179.3° |
| C21 | C20 | C09 | C10 | 179.8° | 179.7° |
| C21 | C20 | C19 | C12 | 179.7° | 180.0° |
| C20 | C21 | H6 | H7 | 120.0° | 120.0° |
| C20 | C21 | H6 | H8 | 120.0° | 120.0° |
| C20 | C21 | H7 | H8 | 120.0° | 120.0° |
| C21 | C20 | C19 | H21 | 0.3° | 0.7° |
| C20 | C09 | C10 | C11 | 0.2° | 0.0° |
| C09 | C20 | C19 | C12 | 0.4° | 0.8° |
| C20 | C09 | C10 | H1 | 179.8° | 179.7° |
| C09 | C20 | C21 | H6 | 90.1° | 89.3° |
| C09 | C20 | C21 | H7 | 149.9° | 30.7° |
| C09 | C20 | C21 | H8 | 29.9° | 150.8° |
| C20 | C09 | C07 | H16 | 21.2° | 25.7° |
| C09 | C20 | C19 | H21 | 179.6° | 180.0° |
| C10 | C09 | C20 | C19 | 0.0° | 0.5° |
| C09 | C10 | C11 | H1 | 180.0° | 179.7° |
| C09 | C10 | C11 | C12 | 0.0° | 0.2° |
| C10 | C09 | C07 | H16 | 158.7° | 154.2° |
| C09 | C10 | C11 | H20 | 180.0° | 179.7° |
| C20 | C19 | C12 | H21 | 180.0° | 179.3° |
| C20 | C19 | C12 | C11 | 0.6° | 0.5° |
| C20 | C19 | C12 | C13 | 179.9° | 179.5° |
| C19 | C20 | C21 | H6 | 90.1° | 90.0° |
| C19 | C20 | C21 | H7 | 30.0° | 150.0° |
| C19 | C20 | C21 | H8 | 149.9° | 30.0° |
| C10 | C11 | C12 | C19 | 0.4° | 0.0° |
| C10 | C11 | C12 | H20 | 180.0° | 179.9° |
| C10 | C11 | C12 | C13 | 179.7° | 180.0° |
| C19 | C12 | C11 | C13 | 179.3° | 180.0° |
| C19 | C12 | C13 | S18 | 112.9° | 132.3° |
| C19 | C12 | C13 | C14 | 67.6° | 47.4° |
| C19 | C12 | C11 | H20 | 179.6° | 180.0° |
| C11 | C12 | C13 | S18 | 66.4° | 47.7° |
| C11 | C12 | C13 | C14 | 113.1° | 132.6° |
| C12 | C11 | C10 | H1 | 180.0° | 180.0° |
| C11 | C12 | C19 | H21 | 179.4° | 179.8° |
| C12 | C13 | S18 | C14 | 179.6° | 179.7° |
| C12 | C13 | S18 | C17 | 179.8° | 179.7° |
| C12 | C13 | C14 | C15 | 0.6° | 0.3° |
| C12 | C13 | C14 | N16 | 179.8° | 179.7° |
| C13 | C12 | C11 | H20 | 0.3° | 0.0° |
| C13 | C12 | C19 | H21 | 0.1° | 0.2° |
| S18 | C13 | C14 | C15 | 179.8° | 180.0° |
| S18 | C13 | C14 | N16 | 0.2° | 0.0° |
| C13 | S18 | C17 | N16 | 0.0° | 0.0° |
| C13 | S18 | C17 | H5 | 180.0° | 180.0° |
| C14 | C13 | S18 | C17 | 0.2° | 0.0° |
| C13 | C14 | C15 | N16 | 179.6° | 180.0° |
| C13 | C14 | N16 | C17 | 0.2° | 0.0° |
| C13 | C14 | C15 | H2 | 179.6° | 94.0° |
| C13 | C14 | C15 | H3 | 59.6° | 146.0° |
| C13 | C14 | C15 | H4 | 60.5° | 25.9° |
| S18 | C17 | N16 | C14 | 0.1° | 0.0° |
| S18 | C17 | N16 | H5 | 180.0° | 180.0° |
| C15 | C14 | N16 | C17 | 179.8° | 180.0° |
| C14 | C15 | H2 | H3 | 120.0° | 120.0° |
| C14 | C15 | H2 | H4 | 120.0° | 120.0° |
| C14 | C15 | H3 | H4 | 120.0° | 120.0° |
| N16 | C14 | C15 | H2 | 0.0° | 85.9° |
| N16 | C14 | C15 | H3 | 120.0° | 34.0° |
| N16 | C14 | C15 | H4 | 120.0° | 154.1° |
| C14 | N16 | C17 | H5 | 179.9° | 180.0° |
| H1 | C10 | C11 | H20 | 0.0° | 0.0° |
| H2 | C15 | H3 | H4 | 119.9° | 120.0° |
| H6 | C21 | H7 | H8 | 120.0° | 120.0° |
| H9 | C28 | H10 | H11 | 120.0° | 120.0° |
| H12 | C02 | C03 | H13 | 93.8° | 88.0° |
| H12 | C02 | C03 | H14 | 27.9° | 35.2° |
| H12 | C02 | C38 | H33 | 97.1° | 36.2° |
| H12 | C02 | C38 | H34 | 24.4° | 86.0° |
| H12 | C02 | O01 | H37 | 58.7° | 56.1° |
| H13 | C03 | C04 | H15 | 20.2° | 21.0° |
| H14 | C03 | C04 | H15 | 142.0° | 144.2° |
| H16 | C07 | C08 | H17 | 56.8° | 180.0° |
| H16 | C07 | C08 | H18 | 63.2° | 60.0° |
| H16 | C07 | C08 | H19 | 176.8° | 60.0° |
| H16 | C07 | N06 | H35 | 146.8° | 148.6° |
| H17 | C08 | H18 | H19 | 120.0° | 119.9° |
| H22 | C25 | N30 | H36 | 161.6° | 145.0° |
| H23 | C27 | H24 | H25 | 120.0° | 120.0° |
| H26 | C29 | H27 | H28 | 120.0° | 120.1° |
| H29 | C34 | C35 | H31 | 0.0° | 145.0° |
| H29 | C34 | C35 | H32 | 141.1° | 0.1° |
| H30 | C34 | C35 | H31 | 141.0° | 0.1° |
| H30 | C34 | C35 | H32 | 0.0° | 145.0° |
