A1EQ2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | N12 | sing | 1.47Å | 1.44Å | |
| C14 | N12 | sing | 1.47Å | 1.44Å | |
| N12 | C11 | sing | 1.47Å | 1.42Å | |
| N20 | C19 | trip | 1.14Å | 1.13Å | |
| C15 | N09 | sing | 1.47Å | 1.44Å | |
| C11 | C10 | sing | 1.53Å | 1.48Å | |
| C19 | C18 | sing | 1.43Å | 1.52Å | |
| C10 | N09 | sing | 1.46Å | 1.44Å | |
| N09 | C08 | sing | 1.35Å | 1.40Å | |
| C17 | C18 | doub | 1.36Å | 1.38Å | Aromatic |
| C17 | N06 | sing | 1.36Å | 1.31Å | Aromatic |
| C18 | C04 | sing | 1.48Å | 1.42Å | Aromatic |
| C08 | C07 | sing | 1.51Å | 1.54Å | |
| C08 | O16 | doub | 1.21Å | 1.16Å | |
| N06 | C07 | sing | 1.46Å | 1.45Å | |
| N06 | C05 | sing | 1.37Å | 1.35Å | Aromatic |
| C04 | C05 | doub | 1.41Å | 1.36Å | Aromatic |
| C04 | C03 | sing | 1.39Å | 1.43Å | Aromatic |
| C02 | C01 | sing | 1.53Å | 1.53Å | |
| C02 | C03 | sing | 1.51Å | 1.51Å | |
| C05 | N21 | sing | 1.33Å | 1.36Å | Aromatic |
| C03 | C36 | doub | 1.40Å | 1.39Å | Aromatic |
| N21 | C22 | doub | 1.32Å | 1.28Å | Aromatic |
| O35 | C33 | doub | 1.21Å | 1.17Å | |
| C36 | C22 | sing | 1.41Å | 1.39Å | Aromatic |
| C36 | C37 | sing | 1.43Å | 1.52Å | |
| N34 | C33 | sing | 1.35Å | 1.44Å | |
| C22 | S23 | sing | 1.76Å | 1.79Å | |
| C33 | C24 | sing | 1.51Å | 1.50Å | |
| C37 | N38 | trip | 1.14Å | 1.13Å | |
| S23 | C24 | sing | 1.81Å | 1.78Å | |
| C24 | C25 | sing | 1.51Å | 1.51Å | |
| C32 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
| C32 | C31 | sing | 1.38Å | 1.37Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.38Å | Aromatic |
| C31 | C28 | doub | 1.39Å | 1.37Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C28 | C27 | sing | 1.39Å | 1.37Å | Aromatic |
| C28 | O29 | sing | 1.36Å | 1.38Å | |
| C30 | O29 | sing | 1.43Å | 1.39Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.08Å | 1.08Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.08Å | 1.08Å | |
| C01 | H13 | sing | 1.09Å | 1.10Å | |
| C01 | H14 | sing | 1.09Å | 1.10Å | |
| C01 | H15 | sing | 1.09Å | 1.10Å | |
| C02 | H16 | sing | 1.09Å | 1.10Å | |
| C02 | H17 | sing | 1.09Å | 1.10Å | |
| C07 | H18 | sing | 1.09Å | 1.10Å | |
| C07 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| C14 | H23 | sing | 1.09Å | 1.10Å | |
| C14 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.08Å | 1.08Å | |
| C30 | H26 | sing | 1.09Å | 1.10Å | |
| C30 | H27 | sing | 1.09Å | 1.10Å | |
| C30 | H28 | sing | 1.09Å | 1.10Å | |
| C31 | H29 | sing | 1.08Å | 1.08Å | |
| C32 | H30 | sing | 1.08Å | 1.08Å | |
| N34 | H31 | sing | 0.97Å | 1.00Å | |
| N34 | H32 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | N12 | C14 | 106.1° | 111.0° |
| C13 | N12 | C11 | 108.2° | 110.9° |
| N12 | C13 | H4 | 109.5° | 109.5° |
| N12 | C13 | H5 | 109.5° | 109.4° |
| N12 | C13 | H6 | 109.4° | 109.5° |
| C14 | N12 | C11 | 107.0° | 111.0° |
| N12 | C14 | H22 | 109.5° | 109.5° |
| N12 | C14 | H23 | 109.4° | 109.4° |
| N12 | C14 | H24 | 109.4° | 109.5° |
| N12 | C11 | C10 | 102.9° | 109.5° |
| N12 | C11 | H20 | 111.1° | 109.5° |
| N12 | C11 | H21 | 111.1° | 109.5° |
| N20 | C19 | C18 | 179.3° | 180.0° |
| C15 | N09 | C10 | 123.1° | 120.0° |
| C15 | N09 | C08 | 117.6° | 120.0° |
| N09 | C15 | H7 | 109.5° | 109.4° |
| N09 | C15 | H8 | 109.5° | 109.5° |
| N09 | C15 | H9 | 109.5° | 109.5° |
| C11 | C10 | N09 | 106.8° | 109.5° |
| C11 | C10 | H1 | 110.1° | 109.4° |
| C11 | C10 | H2 | 110.2° | 109.5° |
| C10 | C11 | H20 | 111.1° | 109.4° |
| C10 | C11 | H21 | 111.1° | 109.4° |
| C19 | C18 | C17 | 126.0° | 126.8° |
| C19 | C18 | C04 | 126.5° | 126.9° |
| C10 | N09 | C08 | 119.2° | 120.0° |
| N09 | C10 | H1 | 110.1° | 109.4° |
| N09 | C10 | H2 | 110.1° | 109.5° |
| N09 | C08 | C07 | 122.7° | 120.0° |
| N09 | C08 | O16 | 115.3° | 120.0° |
| C18 | C17 | N06 | 109.0° | 109.7° |
| C17 | C18 | C04 | 107.3° | 106.3° |
| C18 | C17 | H10 | 125.5° | 125.1° |
| C17 | N06 | C07 | 126.8° | 124.7° |
| C17 | N06 | C05 | 108.6° | 110.5° |
| N06 | C17 | H10 | 125.5° | 125.1° |
| C18 | C04 | C05 | 104.0° | 106.1° |
| C18 | C04 | C03 | 136.3° | 134.0° |
| C07 | C08 | O16 | 121.9° | 120.0° |
| C08 | C07 | N06 | 120.0° | 109.5° |
| C08 | C07 | H18 | 106.8° | 109.4° |
| C08 | C07 | H19 | 106.8° | 109.4° |
| C07 | N06 | C05 | 124.4° | 124.7° |
| N06 | C07 | H18 | 106.8° | 109.5° |
| N06 | C07 | H19 | 106.7° | 109.5° |
| N06 | C05 | C04 | 110.8° | 107.3° |
| N06 | C05 | N21 | 128.0° | 132.5° |
| C05 | C04 | C03 | 119.5° | 120.0° |
| C04 | C05 | N21 | 120.9° | 120.2° |
| C04 | C03 | C02 | 119.2° | 121.0° |
| C04 | C03 | C36 | 116.8° | 118.1° |
| C01 | C02 | C03 | 111.1° | 109.4° |
| C02 | C01 | H13 | 109.5° | 109.4° |
| C02 | C01 | H14 | 109.5° | 109.5° |
| C02 | C01 | H15 | 109.5° | 109.5° |
| C01 | C02 | H16 | 109.1° | 109.5° |
| C01 | C02 | H17 | 109.0° | 109.5° |
| C02 | C03 | C36 | 124.0° | 121.0° |
| C03 | C02 | H16 | 109.0° | 109.4° |
| C03 | C02 | H17 | 109.1° | 109.5° |
| C05 | N21 | C22 | 120.7° | 121.8° |
| C03 | C36 | C22 | 118.9° | 118.9° |
| C03 | C36 | C37 | 120.1° | 120.5° |
| N21 | C22 | C36 | 123.0° | 121.1° |
| N21 | C22 | S23 | 112.3° | 119.4° |
| O35 | C33 | N34 | 120.7° | 120.0° |
| O35 | C33 | C24 | 119.5° | 120.0° |
| C22 | C36 | C37 | 121.0° | 120.6° |
| C36 | C22 | S23 | 124.6° | 119.4° |
| C36 | C37 | N38 | 178.9° | 180.0° |
| N34 | C33 | C24 | 119.8° | 120.0° |
| C33 | N34 | H31 | 120.0° | 120.0° |
| C33 | N34 | H32 | 120.0° | 120.0° |
| C22 | S23 | C24 | 110.8° | 100.0° |
| C33 | C24 | S23 | 105.0° | 109.5° |
| C33 | C24 | C25 | 105.0° | 109.5° |
| C33 | C24 | H11 | 114.7° | 109.4° |
| S23 | C24 | C25 | 106.4° | 109.5° |
| S23 | C24 | H11 | 110.6° | 109.5° |
| C24 | C25 | C32 | 117.3° | 119.9° |
| C24 | C25 | C26 | 122.6° | 120.0° |
| C25 | C24 | H11 | 114.4° | 109.5° |
| C25 | C32 | C31 | 120.5° | 120.0° |
| C32 | C25 | C26 | 120.1° | 120.1° |
| C25 | C32 | H30 | 119.7° | 119.9° |
| C32 | C31 | C28 | 119.2° | 120.0° |
| C32 | C31 | H29 | 120.4° | 120.0° |
| C31 | C32 | H30 | 119.8° | 120.0° |
| C25 | C26 | C27 | 119.2° | 120.1° |
| C25 | C26 | H12 | 120.4° | 119.9° |
| C31 | C28 | C27 | 120.8° | 119.9° |
| C31 | C28 | O29 | 118.2° | 120.1° |
| C28 | C31 | H29 | 120.4° | 120.0° |
| C26 | C27 | C28 | 120.2° | 120.0° |
| C27 | C26 | H12 | 120.4° | 120.0° |
| C26 | C27 | H25 | 119.9° | 120.0° |
| C27 | C28 | O29 | 121.0° | 120.1° |
| C28 | C27 | H25 | 119.9° | 120.0° |
| C28 | O29 | C30 | 112.5° | 117.0° |
| O29 | C30 | H26 | 109.5° | 109.5° |
| O29 | C30 | H27 | 109.5° | 109.5° |
| O29 | C30 | H28 | 109.4° | 109.5° |
| H1 | C10 | H2 | 109.5° | 109.4° |
| H4 | C13 | H5 | 109.5° | 109.5° |
| H4 | C13 | H6 | 109.5° | 109.5° |
| H5 | C13 | H6 | 109.5° | 109.5° |
| H7 | C15 | H8 | 109.4° | 109.5° |
| H7 | C15 | H9 | 109.4° | 109.5° |
| H8 | C15 | H9 | 109.5° | 109.4° |
| H13 | C01 | H14 | 109.4° | 109.5° |
| H13 | C01 | H15 | 109.5° | 109.4° |
| H14 | C01 | H15 | 109.5° | 109.5° |
| H16 | C02 | H17 | 109.5° | 109.5° |
| H18 | C07 | H19 | 109.4° | 109.5° |
| H20 | C11 | H21 | 109.5° | 109.4° |
| H22 | C14 | H23 | 109.5° | 109.5° |
| H22 | C14 | H24 | 109.5° | 109.5° |
| H23 | C14 | H24 | 109.5° | 109.5° |
| H26 | C30 | H27 | 109.5° | 109.5° |
| H26 | C30 | H28 | 109.5° | 109.4° |
| H27 | C30 | H28 | 109.5° | 109.5° |
| H31 | N34 | H32 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | N12 | C14 | C11 | 115.4° | 123.9° |
| C13 | N12 | C11 | C10 | 61.6° | 66.0° |
| N12 | C13 | H4 | H5 | 120.0° | 119.9° |
| N12 | C13 | H4 | H6 | 120.0° | 120.0° |
| N12 | C13 | H5 | H6 | 120.0° | 119.9° |
| C13 | N12 | C11 | H20 | 57.4° | 174.0° |
| C13 | N12 | C11 | H21 | 179.5° | 54.0° |
| C13 | N12 | C14 | H22 | 180.0° | 63.9° |
| C13 | N12 | C14 | H23 | 60.0° | 56.0° |
| C13 | N12 | C14 | H24 | 60.0° | 176.0° |
| C14 | N12 | C11 | C10 | 175.5° | 170.0° |
| C14 | N12 | C13 | H4 | 180.0° | 176.1° |
| C14 | N12 | C13 | H5 | 60.0° | 56.1° |
| C14 | N12 | C13 | H6 | 60.0° | 63.9° |
| C14 | N12 | C11 | H20 | 56.6° | 50.0° |
| C14 | N12 | C11 | H21 | 65.6° | 70.0° |
| N12 | C14 | H22 | H23 | 120.0° | 120.0° |
| N12 | C14 | H22 | H24 | 120.0° | 120.0° |
| N12 | C14 | H23 | H24 | 120.0° | 120.0° |
| N12 | C11 | C10 | H20 | 118.9° | 120.0° |
| N12 | C11 | C10 | H21 | 118.9° | 120.1° |
| N12 | C11 | C10 | N09 | 107.7° | 180.0° |
| N12 | C11 | C10 | H1 | 132.7° | 60.0° |
| N12 | C11 | C10 | H2 | 11.9° | 60.0° |
| C11 | N12 | C13 | H4 | 65.5° | 60.0° |
| C11 | N12 | C13 | H5 | 174.5° | 180.0° |
| C11 | N12 | C13 | H6 | 54.5° | 60.1° |
| N12 | C11 | H20 | H21 | 123.0° | 120.0° |
| C11 | N12 | C14 | H22 | 64.6° | 60.0° |
| C11 | N12 | C14 | H23 | 55.3° | 180.0° |
| C11 | N12 | C14 | H24 | 175.4° | 60.1° |
| N20 | C19 | C18 | C17 | 28.3° | 91.7° |
| N20 | C19 | C18 | C04 | 157.6° | 88.3° |
| C15 | N09 | C10 | C11 | 121.1° | 90.0° |
| C15 | N09 | C10 | C08 | 176.1° | 179.9° |
| C15 | N09 | C08 | C07 | 3.1° | 0.1° |
| C15 | N09 | C08 | O16 | 179.6° | 180.0° |
| C15 | N09 | C10 | H1 | 119.3° | 30.0° |
| C15 | N09 | C10 | H2 | 1.5° | 150.0° |
| N09 | C15 | H7 | H8 | 120.0° | 120.0° |
| N09 | C15 | H7 | H9 | 120.0° | 120.0° |
| N09 | C15 | H8 | H9 | 120.0° | 120.0° |
| C11 | C10 | N09 | H1 | 119.6° | 120.0° |
| C11 | C10 | N09 | H2 | 119.6° | 120.1° |
| C11 | C10 | N09 | C08 | 62.8° | 90.0° |
| C11 | C10 | H1 | H2 | 121.2° | 120.0° |
| C10 | C11 | H20 | H21 | 123.1° | 119.9° |
| C19 | C18 | C17 | C04 | 175.1° | 180.0° |
| C19 | C18 | C17 | N06 | 179.9° | 180.0° |
| C19 | C18 | C04 | C05 | 178.0° | 180.0° |
| C19 | C18 | C04 | C03 | 8.1° | 0.1° |
| C19 | C18 | C17 | H10 | 0.1° | 0.3° |
| C10 | N09 | C08 | C07 | 179.4° | 180.0° |
| C10 | N09 | C08 | O16 | 4.1° | 0.1° |
| N09 | C10 | H1 | H2 | 121.2° | 120.0° |
| C10 | N09 | C15 | H7 | 180.0° | 90.0° |
| C10 | N09 | C15 | H8 | 60.0° | 149.9° |
| C10 | N09 | C15 | H9 | 60.0° | 29.9° |
| N09 | C10 | C11 | H20 | 11.2° | 59.9° |
| N09 | C10 | C11 | H21 | 133.4° | 60.0° |
| N09 | C08 | C07 | O16 | 176.3° | 179.9° |
| N09 | C08 | C07 | N06 | 34.3° | 180.0° |
| C08 | N09 | C10 | H1 | 56.8° | 150.1° |
| C08 | N09 | C10 | H2 | 177.6° | 30.1° |
| C08 | N09 | C15 | H7 | 3.9° | 90.1° |
| C08 | N09 | C15 | H8 | 116.1° | 30.0° |
| C08 | N09 | C15 | H9 | 123.9° | 150.0° |
| N09 | C08 | C07 | H18 | 87.2° | 60.0° |
| N09 | C08 | C07 | H19 | 155.8° | 59.9° |
| C18 | C17 | N06 | H10 | 180.0° | 179.7° |
| C18 | C17 | N06 | C07 | 179.2° | 180.0° |
| C18 | C17 | N06 | C05 | 5.0° | 0.0° |
| C17 | C18 | C04 | C05 | 2.9° | 0.0° |
| C17 | C18 | C04 | C03 | 176.8° | 179.9° |
| N06 | C17 | C18 | C04 | 5.0° | 0.0° |
| C17 | N06 | C07 | C08 | 128.2° | 95.0° |
| C17 | N06 | C07 | C05 | 175.1° | 180.0° |
| C17 | N06 | C05 | C04 | 3.2° | 0.0° |
| C17 | N06 | C05 | N21 | 177.5° | 179.9° |
| C17 | N06 | C07 | H18 | 6.7° | 145.0° |
| C17 | N06 | C07 | H19 | 110.3° | 25.0° |
| C18 | C04 | C05 | N06 | 0.0° | 0.0° |
| C18 | C04 | C05 | C03 | 175.1° | 179.9° |
| C18 | C04 | C03 | C02 | 7.2° | 0.1° |
| C18 | C04 | C05 | N21 | 174.8° | 179.9° |
| C18 | C04 | C03 | C36 | 175.1° | 179.9° |
| C04 | C18 | C17 | H10 | 175.0° | 179.7° |
| C08 | C07 | N06 | H18 | 121.5° | 119.9° |
| C08 | C07 | N06 | H19 | 121.5° | 120.0° |
| C08 | C07 | N06 | C05 | 56.7° | 85.0° |
| C08 | C07 | H18 | H19 | 115.3° | 119.9° |
| O16 | C08 | C07 | N06 | 149.4° | 0.0° |
| O16 | C08 | C07 | H18 | 89.1° | 120.0° |
| O16 | C08 | C07 | H19 | 27.9° | 120.0° |
| C07 | N06 | C05 | C04 | 179.1° | 180.0° |
| C07 | N06 | C05 | N21 | 6.6° | 0.1° |
| C07 | N06 | C17 | H10 | 0.8° | 0.3° |
| N06 | C07 | H18 | H19 | 115.2° | 120.1° |
| N06 | C05 | C04 | N21 | 174.8° | 179.9° |
| N06 | C05 | C04 | C03 | 175.1° | 179.9° |
| N06 | C05 | N21 | C22 | 178.0° | 180.0° |
| C05 | N06 | C17 | H10 | 174.9° | 179.7° |
| C05 | N06 | C07 | H18 | 178.2° | 34.9° |
| C05 | N06 | C07 | H19 | 64.8° | 155.0° |
| C05 | C04 | C03 | C02 | 179.6° | 180.0° |
| C05 | C04 | C03 | C36 | 1.9° | 0.0° |
| C04 | C05 | N21 | C22 | 4.2° | 0.0° |
| C04 | C03 | C02 | C01 | 53.3° | 90.0° |
| C04 | C03 | C02 | C36 | 177.5° | 180.0° |
| C03 | C04 | C05 | N21 | 0.3° | 0.0° |
| C04 | C03 | C36 | C22 | 0.6° | 0.1° |
| C04 | C03 | C36 | C37 | 176.7° | 179.9° |
| C04 | C03 | C02 | H16 | 67.0° | 150.1° |
| C04 | C03 | C02 | H17 | 173.5° | 30.0° |
| C01 | C02 | C03 | H16 | 120.2° | 120.0° |
| C01 | C02 | C03 | H17 | 120.2° | 120.0° |
| C01 | C02 | C03 | C36 | 124.2° | 90.0° |
| C02 | C01 | H13 | H14 | 120.0° | 120.0° |
| C02 | C01 | H13 | H15 | 120.0° | 120.0° |
| C02 | C01 | H14 | H15 | 120.0° | 120.1° |
| C01 | C02 | H16 | H17 | 119.2° | 120.0° |
| C02 | C03 | C36 | C22 | 178.2° | 180.0° |
| C02 | C03 | C36 | C37 | 0.9° | 0.1° |
| C03 | C02 | C01 | H13 | 180.0° | 180.0° |
| C03 | C02 | C01 | H14 | 60.0° | 60.0° |
| C03 | C02 | C01 | H15 | 60.0° | 60.1° |
| C03 | C02 | H16 | H17 | 119.3° | 120.0° |
| C05 | N21 | C22 | C36 | 5.8° | 0.1° |
| C05 | N21 | C22 | S23 | 177.9° | 180.0° |
| C03 | C36 | C22 | N21 | 3.3° | 0.1° |
| C03 | C36 | C22 | C37 | 177.2° | 179.8° |
| C03 | C36 | C22 | S23 | 179.1° | 180.0° |
| C03 | C36 | C37 | N38 | 91.0° | 122.2° |
| C36 | C03 | C02 | H16 | 115.5° | 30.0° |
| C36 | C03 | C02 | H17 | 4.0° | 150.0° |
| N21 | C22 | C36 | S23 | 175.8° | 179.9° |
| N21 | C22 | C36 | C37 | 179.5° | 179.9° |
| N21 | C22 | S23 | C24 | 7.4° | 0.0° |
| O35 | C33 | N34 | C24 | 177.7° | 179.9° |
| O35 | C33 | C24 | S23 | 10.3° | 117.3° |
| O35 | C33 | C24 | C25 | 101.7° | 122.7° |
| O35 | C33 | C24 | H11 | 131.8° | 2.6° |
| O35 | C33 | N34 | H31 | 0.0° | 174.0° |
| O35 | C33 | N34 | H32 | 180.0° | 6.1° |
| C22 | C36 | C37 | N38 | 91.8° | 57.9° |
| C36 | C22 | S23 | C24 | 176.4° | 180.0° |
| C37 | C36 | C22 | S23 | 3.6° | 0.1° |
| N34 | C33 | C24 | S23 | 171.9° | 62.8° |
| N34 | C33 | C24 | C25 | 76.1° | 57.3° |
| N34 | C33 | C24 | H11 | 50.4° | 177.3° |
| C33 | N34 | H31 | H32 | 179.9° | 180.0° |
| C22 | S23 | C24 | C33 | 86.1° | 65.0° |
| C22 | S23 | C24 | C25 | 162.8° | 175.0° |
| C22 | S23 | C24 | H11 | 38.1° | 55.0° |
| C33 | C24 | S23 | C25 | 111.0° | 120.0° |
| C33 | C24 | S23 | H11 | 124.2° | 119.9° |
| C33 | C24 | C25 | H11 | 126.6° | 120.0° |
| C33 | C24 | C25 | C32 | 31.0° | 110.2° |
| C33 | C24 | C25 | C26 | 150.0° | 69.8° |
| C24 | C33 | N34 | H31 | 177.7° | 5.9° |
| C24 | C33 | N34 | H32 | 2.2° | 174.0° |
| S23 | C24 | C25 | H11 | 122.4° | 120.0° |
| S23 | C24 | C25 | C32 | 80.0° | 129.7° |
| S23 | C24 | C25 | C26 | 99.0° | 50.3° |
| C24 | C25 | C32 | C26 | 179.0° | 180.0° |
| C24 | C25 | C32 | C31 | 179.9° | 180.0° |
| C24 | C25 | C26 | C27 | 179.8° | 180.0° |
| C24 | C25 | C26 | H12 | 0.2° | 0.3° |
| C24 | C25 | C32 | H30 | 0.1° | 0.0° |
| C25 | C32 | C31 | H30 | 180.0° | 180.0° |
| C25 | C32 | C31 | C28 | 0.3° | 0.2° |
| C32 | C25 | C26 | C27 | 0.9° | 0.0° |
| C32 | C25 | C24 | H11 | 157.7° | 9.7° |
| C32 | C25 | C26 | H12 | 179.2° | 179.7° |
| C25 | C32 | C31 | H29 | 179.7° | 179.8° |
| C31 | C32 | C25 | C26 | 0.9° | 0.0° |
| C32 | C31 | C28 | H29 | 180.0° | 179.5° |
| C32 | C31 | C28 | C27 | 0.3° | 0.5° |
| C32 | C31 | C28 | O29 | 179.5° | 180.0° |
| C25 | C26 | C27 | H12 | 180.0° | 179.7° |
| C25 | C26 | C27 | C28 | 0.3° | 0.3° |
| C26 | C25 | C24 | H11 | 23.3° | 170.3° |
| C25 | C26 | C27 | H25 | 179.7° | 179.8° |
| C26 | C25 | C32 | H30 | 179.2° | 180.0° |
| C31 | C28 | C27 | C26 | 0.3° | 0.5° |
| C31 | C28 | C27 | O29 | 179.2° | 179.5° |
| C31 | C28 | O29 | C30 | 29.6° | 0.5° |
| C31 | C28 | C27 | H25 | 179.7° | 179.5° |
| C28 | C31 | C32 | H30 | 179.7° | 179.7° |
| C26 | C27 | C28 | H25 | 180.0° | 179.9° |
| C26 | C27 | C28 | O29 | 179.5° | 180.0° |
| C27 | C28 | O29 | C30 | 149.6° | 180.0° |
| C28 | C27 | C26 | H12 | 179.7° | 180.0° |
| C27 | C28 | C31 | H29 | 179.7° | 180.0° |
| O29 | C28 | C27 | H25 | 0.5° | 0.1° |
| C28 | O29 | C30 | H26 | 180.0° | 60.0° |
| C28 | O29 | C30 | H27 | 60.0° | 60.0° |
| C28 | O29 | C30 | H28 | 60.0° | 180.0° |
| O29 | C28 | C31 | H29 | 0.5° | 0.5° |
| O29 | C30 | H26 | H27 | 120.0° | 120.0° |
| O29 | C30 | H26 | H28 | 120.0° | 120.0° |
| O29 | C30 | H27 | H28 | 119.9° | 120.0° |
| H1 | C10 | C11 | H20 | 108.4° | 60.1° |
| H1 | C10 | C11 | H21 | 13.8° | 180.0° |
| H2 | C10 | C11 | H20 | 130.8° | 180.0° |
| H2 | C10 | C11 | H21 | 107.1° | 60.1° |
| H4 | C13 | H5 | H6 | 120.0° | 120.1° |
| H7 | C15 | H8 | H9 | 119.9° | 120.0° |
| H12 | C26 | C27 | H25 | 0.2° | 0.1° |
| H13 | C01 | H14 | H15 | 120.0° | 119.9° |
| H13 | C01 | C02 | H16 | 59.8° | 60.1° |
| H13 | C01 | C02 | H17 | 59.7° | 60.0° |
| H14 | C01 | C02 | H16 | 60.2° | 59.9° |
| H14 | C01 | C02 | H17 | 179.7° | 180.0° |
| H15 | C01 | C02 | H16 | 179.8° | 180.0° |
| H15 | C01 | C02 | H17 | 60.3° | 60.0° |
| H22 | C14 | H23 | H24 | 120.0° | 120.0° |
| H26 | C30 | H27 | H28 | 120.0° | 119.9° |
| H29 | C31 | C32 | H30 | 0.2° | 0.2° |
