A1A6L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | C01 | sing | 1.53Å | 1.52Å | |
| N03 | C02 | sing | 1.47Å | 1.47Å | |
| N04 | N03 | sing | 1.37Å | 1.44Å | |
| C05 | N04 | sing | 1.35Å | 1.43Å | |
| O06 | C05 | doub | 1.22Å | 1.18Å | |
| C07 | C05 | sing | 1.48Å | 1.52Å | |
| C08 | C07 | doub | 1.40Å | 1.36Å | Aromatic |
| C09 | C08 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | C09 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C11 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | C10 | sing | 1.51Å | 1.55Å | |
| N14 | C13 | sing | 1.46Å | 1.47Å | |
| C16 | C15 | sing | 1.51Å | 1.53Å | |
| O17 | C16 | doub | 1.21Å | 1.21Å | |
| N18 | C16 | sing | 1.35Å | 1.49Å | |
| C19 | N18 | sing | 1.47Å | 1.45Å | |
| C20 | C19 | sing | 1.51Å | 1.52Å | |
| C21 | C20 | doub | 1.38Å | 1.42Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C23 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.41Å | Aromatic |
| C25 | C24 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | N14 | sing | 1.47Å | 1.48Å | |
| C26 | N14 | sing | 1.35Å | 1.47Å | |
| O27 | C26 | doub | 1.22Å | 1.19Å | |
| C28 | C26 | sing | 1.47Å | 1.54Å | |
| C29 | C28 | doub | 1.40Å | 1.38Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.40Å | Aromatic |
| C31 | C30 | doub | 1.39Å | 1.38Å | Aromatic |
| C33 | C32 | doub | 1.38Å | 1.40Å | Aromatic |
| C32 | C31 | sing | 1.39Å | 1.37Å | Aromatic |
| N34 | C31 | sing | 1.39Å | 1.46Å | |
| C35 | N34 | sing | 1.47Å | 1.49Å | |
| C36 | N34 | sing | 1.46Å | 1.49Å | |
| C07 | C12 | sing | 1.40Å | 1.42Å | Aromatic |
| C20 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | C33 | sing | 1.40Å | 1.38Å | Aromatic |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.08Å | 1.08Å | |
| C22 | H20 | sing | 1.08Å | 1.08Å | |
| C24 | H22 | sing | 1.08Å | 1.08Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C02 | H5 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C08 | H8 | sing | 1.08Å | 1.08Å | |
| C09 | H9 | sing | 1.08Å | 1.08Å | |
| C11 | H10 | sing | 1.08Å | 1.08Å | |
| C12 | H11 | sing | 1.08Å | 1.08Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.08Å | 1.08Å | |
| C25 | H23 | sing | 1.08Å | 1.08Å | |
| C29 | H24 | sing | 1.08Å | 1.08Å | |
| C30 | H25 | sing | 1.08Å | 1.08Å | |
| C32 | H26 | sing | 1.08Å | 1.08Å | |
| C33 | H27 | sing | 1.08Å | 1.08Å | |
| C35 | H29 | sing | 1.09Å | 1.10Å | |
| C35 | H30 | sing | 1.09Å | 1.10Å | |
| C35 | H28 | sing | 1.09Å | 1.10Å | |
| C36 | H32 | sing | 1.09Å | 1.10Å | |
| C36 | H31 | sing | 1.09Å | 1.10Å | |
| C36 | H33 | sing | 1.09Å | 1.10Å | |
| N03 | H6 | sing | 1.01Å | 1.00Å | |
| N04 | H7 | sing | 0.97Å | 1.00Å | |
| N18 | H16 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | N03 | 114.2° | 109.4° |
| C02 | C01 | H1 | 109.5° | 109.4° |
| C02 | C01 | H3 | 109.4° | 109.4° |
| C02 | C01 | H2 | 109.4° | 109.5° |
| C01 | C02 | H5 | 108.3° | 109.4° |
| C01 | C02 | H4 | 108.3° | 109.5° |
| C02 | N03 | N04 | 109.2° | 111.0° |
| N03 | C02 | H5 | 108.3° | 109.4° |
| N03 | C02 | H4 | 108.3° | 109.5° |
| C02 | N03 | H6 | 109.5° | 111.0° |
| N03 | N04 | C05 | 114.9° | 120.0° |
| N04 | N03 | H6 | 109.6° | 111.0° |
| N03 | N04 | H7 | 122.6° | 120.0° |
| N04 | C05 | O06 | 118.6° | 120.0° |
| N04 | C05 | C07 | 119.3° | 120.0° |
| C05 | N04 | H7 | 122.6° | 120.0° |
| O06 | C05 | C07 | 122.1° | 120.0° |
| C05 | C07 | C08 | 118.7° | 120.2° |
| C05 | C07 | C12 | 120.9° | 120.1° |
| C07 | C08 | C09 | 121.1° | 119.9° |
| C08 | C07 | C12 | 120.4° | 119.7° |
| C07 | C08 | H8 | 119.5° | 120.1° |
| C08 | C09 | C10 | 118.9° | 120.1° |
| C09 | C08 | H8 | 119.5° | 120.0° |
| C08 | C09 | H9 | 120.5° | 120.0° |
| C09 | C10 | C11 | 120.2° | 120.3° |
| C09 | C10 | C13 | 119.5° | 119.8° |
| C10 | C09 | H9 | 120.5° | 119.9° |
| C12 | C11 | C10 | 120.9° | 120.2° |
| C11 | C12 | C07 | 118.5° | 119.8° |
| C12 | C11 | H10 | 119.5° | 119.8° |
| C11 | C12 | H11 | 120.7° | 120.2° |
| C11 | C10 | C13 | 120.3° | 119.9° |
| C10 | C11 | H10 | 119.6° | 120.0° |
| C10 | C13 | N14 | 105.7° | 109.5° |
| C10 | C13 | H12 | 110.4° | 109.4° |
| C10 | C13 | H13 | 110.4° | 109.5° |
| C13 | N14 | C15 | 118.8° | 120.0° |
| C13 | N14 | C26 | 124.8° | 120.0° |
| N14 | C13 | H12 | 110.4° | 109.5° |
| N14 | C13 | H13 | 110.4° | 109.5° |
| C15 | C16 | O17 | 120.9° | 120.0° |
| C15 | C16 | N18 | 118.3° | 120.0° |
| C16 | C15 | N14 | 112.4° | 109.5° |
| C16 | C15 | H14 | 108.7° | 109.5° |
| C16 | C15 | H15 | 108.7° | 109.4° |
| O17 | C16 | N18 | 120.8° | 120.0° |
| C16 | N18 | C19 | 118.6° | 120.0° |
| C16 | N18 | H16 | 120.7° | 120.0° |
| N18 | C19 | C20 | 115.9° | 109.4° |
| N18 | C19 | H17 | 107.8° | 109.5° |
| N18 | C19 | H18 | 107.8° | 109.4° |
| C19 | N18 | H16 | 120.7° | 120.0° |
| C19 | C20 | C21 | 122.5° | 120.0° |
| C19 | C20 | C25 | 117.2° | 120.0° |
| C20 | C19 | H17 | 107.8° | 109.5° |
| C20 | C19 | H18 | 107.8° | 109.4° |
| C20 | C21 | C22 | 119.5° | 120.0° |
| C21 | C20 | C25 | 120.3° | 120.0° |
| C20 | C21 | H19 | 120.2° | 120.0° |
| C21 | C22 | C23 | 119.9° | 120.0° |
| C22 | C21 | H19 | 120.2° | 120.0° |
| C21 | C22 | H20 | 120.1° | 120.0° |
| C22 | C23 | C24 | 120.4° | 120.0° |
| C23 | C22 | H20 | 120.1° | 120.0° |
| C22 | C23 | H21 | 119.8° | 120.0° |
| C23 | C24 | C25 | 119.7° | 119.9° |
| C23 | C24 | H22 | 120.1° | 120.0° |
| C24 | C23 | H21 | 119.8° | 119.9° |
| C24 | C25 | C20 | 120.1° | 120.0° |
| C25 | C24 | H22 | 120.1° | 120.0° |
| C24 | C25 | H23 | 119.9° | 119.9° |
| C15 | N14 | C26 | 116.1° | 119.9° |
| N14 | C15 | H14 | 108.7° | 109.5° |
| N14 | C15 | H15 | 108.7° | 109.4° |
| N14 | C26 | O27 | 115.9° | 120.0° |
| N14 | C26 | C28 | 124.6° | 120.0° |
| O27 | C26 | C28 | 119.4° | 120.0° |
| C26 | C28 | C29 | 123.2° | 120.1° |
| C26 | C28 | C33 | 116.1° | 120.0° |
| C28 | C29 | C30 | 119.7° | 120.0° |
| C29 | C28 | C33 | 120.6° | 119.9° |
| C28 | C29 | H24 | 120.2° | 120.0° |
| C29 | C30 | C31 | 119.3° | 120.0° |
| C30 | C29 | H24 | 120.1° | 120.0° |
| C29 | C30 | H25 | 120.4° | 120.0° |
| C30 | C31 | C32 | 120.9° | 120.2° |
| C30 | C31 | N34 | 120.3° | 119.9° |
| C31 | C30 | H25 | 120.4° | 120.0° |
| C33 | C32 | C31 | 120.0° | 120.1° |
| C32 | C33 | C28 | 119.5° | 119.9° |
| C33 | C32 | H26 | 120.0° | 119.9° |
| C32 | C33 | H27 | 120.2° | 120.0° |
| C32 | C31 | N34 | 118.8° | 119.9° |
| C31 | C32 | H26 | 120.0° | 120.0° |
| C31 | N34 | C35 | 118.6° | 120.0° |
| C31 | N34 | C36 | 120.3° | 120.0° |
| C35 | N34 | C36 | 121.0° | 120.0° |
| N34 | C35 | H29 | 109.5° | 109.4° |
| N34 | C35 | H30 | 109.5° | 109.5° |
| N34 | C35 | H28 | 109.5° | 109.5° |
| N34 | C36 | H32 | 109.5° | 109.5° |
| N34 | C36 | H31 | 109.5° | 109.5° |
| N34 | C36 | H33 | 109.4° | 109.5° |
| C07 | C12 | H11 | 120.8° | 120.0° |
| C20 | C25 | H23 | 119.9° | 120.0° |
| C28 | C33 | H27 | 120.3° | 120.0° |
| H12 | C13 | H13 | 109.5° | 109.5° |
| H14 | C15 | H15 | 109.5° | 109.5° |
| H1 | C01 | H3 | 109.5° | 109.4° |
| H1 | C01 | H2 | 109.5° | 109.5° |
| H3 | C01 | H2 | 109.5° | 109.5° |
| H5 | C02 | H4 | 109.5° | 109.5° |
| H17 | C19 | H18 | 109.5° | 109.5° |
| H29 | C35 | H30 | 109.5° | 109.5° |
| H29 | C35 | H28 | 109.5° | 109.5° |
| H30 | C35 | H28 | 109.5° | 109.5° |
| H32 | C36 | H31 | 109.5° | 109.4° |
| H32 | C36 | H33 | 109.5° | 109.5° |
| H31 | C36 | H33 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | N03 | H5 | 120.7° | 119.9° |
| C01 | C02 | N03 | H4 | 120.7° | 120.0° |
| C01 | C02 | N03 | N04 | 42.9° | 180.0° |
| C02 | C01 | H1 | H3 | 120.0° | 119.9° |
| C02 | C01 | H1 | H2 | 120.0° | 120.0° |
| C02 | C01 | H3 | H2 | 120.0° | 120.0° |
| C01 | C02 | H5 | H4 | 117.9° | 120.0° |
| C01 | C02 | N03 | H6 | 77.0° | 56.1° |
| C02 | N03 | N04 | H6 | 119.9° | 123.9° |
| C02 | N03 | N04 | C05 | 85.4° | 180.0° |
| N03 | C02 | C01 | H1 | 180.0° | 60.1° |
| N03 | C02 | C01 | H3 | 60.0° | 180.0° |
| N03 | C02 | C01 | H2 | 60.0° | 60.0° |
| N03 | C02 | H5 | H4 | 117.9° | 120.0° |
| C02 | N03 | N04 | H7 | 94.5° | 0.0° |
| N03 | N04 | C05 | H7 | 180.0° | 180.0° |
| N03 | N04 | C05 | O06 | 0.0° | 0.0° |
| N03 | N04 | C05 | C07 | 179.4° | 180.0° |
| N04 | N03 | C02 | H5 | 163.6° | 60.0° |
| N04 | N03 | C02 | H4 | 77.7° | 60.0° |
| N04 | C05 | O06 | C07 | 179.4° | 180.0° |
| N04 | C05 | C07 | C08 | 162.1° | 0.3° |
| N04 | C05 | C07 | C12 | 18.5° | 180.0° |
| C05 | N04 | N03 | H6 | 154.6° | 56.1° |
| O06 | C05 | C07 | C08 | 18.5° | 179.7° |
| O06 | C05 | C07 | C12 | 161.0° | 0.0° |
| O06 | C05 | N04 | H7 | 180.0° | 180.0° |
| C05 | C07 | C08 | C12 | 179.5° | 179.7° |
| C05 | C07 | C08 | C09 | 178.6° | 179.7° |
| C05 | C07 | C12 | C11 | 179.9° | 180.0° |
| C05 | C07 | C08 | H8 | 1.4° | 0.0° |
| C05 | C07 | C12 | H11 | 0.1° | 0.3° |
| C07 | C05 | N04 | H7 | 0.6° | 0.0° |
| C07 | C08 | C09 | H8 | 180.0° | 179.7° |
| C07 | C08 | C09 | C10 | 1.3° | 0.6° |
| C08 | C07 | C12 | C11 | 0.5° | 0.3° |
| C07 | C08 | C09 | H9 | 178.7° | 179.4° |
| C08 | C07 | C12 | H11 | 179.5° | 180.0° |
| C08 | C09 | C10 | H9 | 180.0° | 180.0° |
| C08 | C09 | C10 | C11 | 0.5° | 0.3° |
| C08 | C09 | C10 | C13 | 180.0° | 180.0° |
| C09 | C08 | C07 | C12 | 0.9° | 0.6° |
| C09 | C10 | C11 | C12 | 0.9° | 0.0° |
| C09 | C10 | C11 | C13 | 179.6° | 179.8° |
| C09 | C10 | C13 | N14 | 51.6° | 83.7° |
| C09 | C10 | C13 | H12 | 67.8° | 156.3° |
| C09 | C10 | C13 | H13 | 171.0° | 36.3° |
| C10 | C09 | C08 | H8 | 178.6° | 179.7° |
| C09 | C10 | C11 | H10 | 179.1° | 180.0° |
| C12 | C11 | C10 | H10 | 180.0° | 180.0° |
| C12 | C11 | C10 | C13 | 178.7° | 179.7° |
| C11 | C12 | C07 | H11 | 180.0° | 179.7° |
| C11 | C10 | C13 | N14 | 128.8° | 96.5° |
| C10 | C11 | C12 | C07 | 1.4° | 0.1° |
| C11 | C10 | C13 | H12 | 111.8° | 23.5° |
| C11 | C10 | C13 | H13 | 9.4° | 143.5° |
| C11 | C10 | C09 | H9 | 179.6° | 179.7° |
| C10 | C11 | C12 | H11 | 178.6° | 179.7° |
| C10 | C13 | N14 | H12 | 119.4° | 120.0° |
| C10 | C13 | N14 | H13 | 119.4° | 120.0° |
| C10 | C13 | N14 | C15 | 64.7° | 95.6° |
| C10 | C13 | N14 | C26 | 108.8° | 84.4° |
| C10 | C13 | H12 | H13 | 121.7° | 120.0° |
| C13 | C10 | C09 | H9 | 0.0° | 0.0° |
| C13 | C10 | C11 | H10 | 1.3° | 0.3° |
| C13 | N14 | C15 | C16 | 119.7° | 78.1° |
| C13 | N14 | C15 | C26 | 174.1° | 180.0° |
| C13 | N14 | C26 | O27 | 176.1° | 0.8° |
| C13 | N14 | C26 | C28 | 5.4° | 179.1° |
| N14 | C13 | H12 | H13 | 121.7° | 120.0° |
| C13 | N14 | C15 | H14 | 119.8° | 161.9° |
| C13 | N14 | C15 | H15 | 0.7° | 41.9° |
| C15 | C16 | O17 | N18 | 179.5° | 180.0° |
| C15 | C16 | N18 | C19 | 178.4° | 180.0° |
| C16 | C15 | N14 | H14 | 120.4° | 120.0° |
| C16 | C15 | N14 | H15 | 120.4° | 119.9° |
| C16 | C15 | N14 | C26 | 66.1° | 101.9° |
| C16 | C15 | H14 | H15 | 118.6° | 120.0° |
| C15 | C16 | N18 | H16 | 1.7° | 0.1° |
| O17 | C16 | N18 | C19 | 2.2° | 0.1° |
| O17 | C16 | C15 | N14 | 150.4° | 0.1° |
| O17 | C16 | C15 | H14 | 29.9° | 120.0° |
| O17 | C16 | C15 | H15 | 89.2° | 120.0° |
| O17 | C16 | N18 | H16 | 177.8° | 180.0° |
| C16 | N18 | C19 | H16 | 180.0° | 179.9° |
| C16 | N18 | C19 | C20 | 90.5° | 180.0° |
| N18 | C16 | C15 | N14 | 29.1° | 180.0° |
| N18 | C16 | C15 | H14 | 149.5° | 60.0° |
| N18 | C16 | C15 | H15 | 91.4° | 60.0° |
| C16 | N18 | C19 | H17 | 148.5° | 60.0° |
| C16 | N18 | C19 | H18 | 30.4° | 60.1° |
| N18 | C19 | C20 | H17 | 120.9° | 120.0° |
| N18 | C19 | C20 | H18 | 120.9° | 119.9° |
| N18 | C19 | C20 | C21 | 27.0° | 90.4° |
| N18 | C19 | C20 | C25 | 154.1° | 90.0° |
| N18 | C19 | H17 | H18 | 117.1° | 120.0° |
| C19 | C20 | C21 | C25 | 178.8° | 179.7° |
| C19 | C20 | C21 | C22 | 179.7° | 180.0° |
| C19 | C20 | C25 | C24 | 179.9° | 179.8° |
| C19 | C20 | C21 | H19 | 0.3° | 0.1° |
| C20 | C19 | H17 | H18 | 117.1° | 120.0° |
| C19 | C20 | C25 | H23 | 0.1° | 0.0° |
| C20 | C19 | N18 | H16 | 89.4° | 0.1° |
| C20 | C21 | C22 | H19 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 0.4° | 0.1° |
| C21 | C20 | C25 | C24 | 1.0° | 0.6° |
| C20 | C21 | C22 | H20 | 179.6° | 180.0° |
| C21 | C20 | C19 | H17 | 148.0° | 29.7° |
| C21 | C20 | C19 | H18 | 93.9° | 149.7° |
| C21 | C20 | C25 | H23 | 179.0° | 179.7° |
| C21 | C22 | C23 | H20 | 180.0° | 180.0° |
| C21 | C22 | C23 | C24 | 0.1° | 0.0° |
| C22 | C21 | C20 | C25 | 0.9° | 0.3° |
| C21 | C22 | C23 | H21 | 179.9° | 179.8° |
| C22 | C23 | C24 | H21 | 180.0° | 179.7° |
| C22 | C23 | C24 | C25 | 0.0° | 0.3° |
| C23 | C22 | C21 | H19 | 179.6° | 179.9° |
| C22 | C23 | C24 | H22 | 180.0° | 180.0° |
| C23 | C24 | C25 | H22 | 180.0° | 179.7° |
| C23 | C24 | C25 | C20 | 0.5° | 0.6° |
| C24 | C23 | C22 | H20 | 179.9° | 180.0° |
| C23 | C24 | C25 | H23 | 179.4° | 179.7° |
| C24 | C25 | C20 | H23 | 180.0° | 179.7° |
| C25 | C24 | C23 | H21 | 180.0° | 180.0° |
| C15 | N14 | C26 | O27 | 2.4° | 179.2° |
| C15 | N14 | C26 | C28 | 179.1° | 0.9° |
| C15 | N14 | C13 | H12 | 175.9° | 24.4° |
| C15 | N14 | C13 | H13 | 54.7° | 144.4° |
| N14 | C15 | H14 | H15 | 118.6° | 120.0° |
| N14 | C26 | O27 | C28 | 178.6° | 180.0° |
| N14 | C26 | C28 | C29 | 43.5° | 27.7° |
| N14 | C26 | C28 | C33 | 140.7° | 152.0° |
| C26 | N14 | C13 | H12 | 10.6° | 155.6° |
| C26 | N14 | C13 | H13 | 131.8° | 35.6° |
| C26 | N14 | C15 | H14 | 54.3° | 18.1° |
| C26 | N14 | C15 | H15 | 173.4° | 138.2° |
| O27 | C26 | C28 | C29 | 135.0° | 152.2° |
| O27 | C26 | C28 | C33 | 40.9° | 28.0° |
| C26 | C28 | C29 | C33 | 175.7° | 179.8° |
| C26 | C28 | C29 | C30 | 178.1° | 180.0° |
| C26 | C28 | C33 | C32 | 178.1° | 179.7° |
| C26 | C28 | C29 | H24 | 1.9° | 0.0° |
| C26 | C28 | C33 | H27 | 1.9° | 0.0° |
| C28 | C29 | C30 | H24 | 180.0° | 180.0° |
| C28 | C29 | C30 | C31 | 1.0° | 0.0° |
| C29 | C28 | C33 | C32 | 2.1° | 0.6° |
| C28 | C29 | C30 | H25 | 179.0° | 180.0° |
| C29 | C28 | C33 | H27 | 177.9° | 179.7° |
| C29 | C30 | C31 | H25 | 180.0° | 180.0° |
| C29 | C30 | C31 | C32 | 0.8° | 0.1° |
| C29 | C30 | C31 | N34 | 178.8° | 180.0° |
| C30 | C29 | C28 | C33 | 2.4° | 0.3° |
| C30 | C31 | C32 | C33 | 1.1° | 0.4° |
| C30 | C31 | C32 | N34 | 178.0° | 179.9° |
| C30 | C31 | N34 | C35 | 174.8° | 0.1° |
| C30 | C31 | N34 | C36 | 1.4° | 180.0° |
| C31 | C30 | C29 | H24 | 179.1° | 180.0° |
| C30 | C31 | C32 | H26 | 178.9° | 180.0° |
| C33 | C32 | C31 | H26 | 180.0° | 179.6° |
| C33 | C32 | C31 | N34 | 179.1° | 179.7° |
| C32 | C33 | C28 | H27 | 180.0° | 179.7° |
| C32 | C31 | N34 | C35 | 3.2° | 180.0° |
| C32 | C31 | N34 | C36 | 179.4° | 0.1° |
| C31 | C32 | C33 | C28 | 0.4° | 0.6° |
| C32 | C31 | C30 | H25 | 179.2° | 179.9° |
| C31 | C32 | C33 | H27 | 179.7° | 179.7° |
| C31 | N34 | C35 | C36 | 176.2° | 179.9° |
| N34 | C31 | C30 | H25 | 1.2° | 0.0° |
| N34 | C31 | C32 | H26 | 0.9° | 0.1° |
| C31 | N34 | C35 | H29 | 180.0° | 90.1° |
| C31 | N34 | C35 | H30 | 60.0° | 29.9° |
| C31 | N34 | C35 | H28 | 60.0° | 150.0° |
| C31 | N34 | C36 | H32 | 180.0° | 89.9° |
| C31 | N34 | C36 | H31 | 60.0° | 30.0° |
| C31 | N34 | C36 | H33 | 60.0° | 150.0° |
| N34 | C35 | H29 | H30 | 120.0° | 120.0° |
| N34 | C35 | H29 | H28 | 120.0° | 120.0° |
| N34 | C35 | H30 | H28 | 120.0° | 120.0° |
| C35 | N34 | C36 | H32 | 3.9° | 90.0° |
| C35 | N34 | C36 | H31 | 123.9° | 150.0° |
| C35 | N34 | C36 | H33 | 116.1° | 30.0° |
| C36 | N34 | C35 | H29 | 3.8° | 90.0° |
| C36 | N34 | C35 | H30 | 116.2° | 150.0° |
| C36 | N34 | C35 | H28 | 123.8° | 30.0° |
| N34 | C36 | H32 | H31 | 120.0° | 120.0° |
| N34 | C36 | H32 | H33 | 120.0° | 120.0° |
| N34 | C36 | H31 | H33 | 120.0° | 120.0° |
| C12 | C07 | C08 | H8 | 179.1° | 179.7° |
| C07 | C12 | C11 | H10 | 178.6° | 180.0° |
| C25 | C20 | C21 | H19 | 179.1° | 179.8° |
| C20 | C25 | C24 | H22 | 179.5° | 179.7° |
| C25 | C20 | C19 | H17 | 33.2° | 150.0° |
| C25 | C20 | C19 | H18 | 85.0° | 29.9° |
| C33 | C28 | C29 | H24 | 177.6° | 179.7° |
| C28 | C33 | C32 | H26 | 179.7° | 179.7° |
| H19 | C21 | C22 | H20 | 0.4° | 0.1° |
| H20 | C22 | C23 | H21 | 0.1° | 0.2° |
| H22 | C24 | C23 | H21 | 0.0° | 0.3° |
| H22 | C24 | C25 | H23 | 0.6° | 0.0° |
| H1 | C01 | H3 | H2 | 120.0° | 120.0° |
| H1 | C01 | C02 | H5 | 59.3° | 180.0° |
| H1 | C01 | C02 | H4 | 59.3° | 60.0° |
| H3 | C01 | C02 | H5 | 60.7° | 60.1° |
| H3 | C01 | C02 | H4 | 179.3° | 59.9° |
| H2 | C01 | C02 | H5 | 179.3° | 59.9° |
| H2 | C01 | C02 | H4 | 60.7° | 180.0° |
| H5 | C02 | N03 | H6 | 43.6° | 176.0° |
| H4 | C02 | N03 | H6 | 162.3° | 63.9° |
| H8 | C08 | C09 | H9 | 1.3° | 0.3° |
| H10 | C11 | C12 | H11 | 1.4° | 0.3° |
| H17 | C19 | N18 | H16 | 31.5° | 120.0° |
| H18 | C19 | N18 | H16 | 149.6° | 120.0° |
| H24 | C29 | C30 | H25 | 0.9° | 0.0° |
| H26 | C32 | C33 | H27 | 0.3° | 0.0° |
| H29 | C35 | H30 | H28 | 120.0° | 120.0° |
| H32 | C36 | H31 | H33 | 120.0° | 120.0° |
| H6 | N03 | N04 | H7 | 25.4° | 124.0° |
