A1I87
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | O18 | sing | 1.43Å | 1.42Å | |
| O18 | C17 | sing | 1.36Å | 1.38Å | |
| C17 | C16 | doub | 1.39Å | 1.41Å | Aromatic |
| C17 | C20 | sing | 1.39Å | 1.41Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.41Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.41Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.42Å | Aromatic |
| O38 | C35 | doub | 1.21Å | 1.25Å | |
| C12 | C13 | doub | 1.38Å | 1.41Å | Aromatic |
| C12 | C09 | sing | 1.39Å | 1.41Å | Aromatic |
| C21 | C14 | sing | 1.38Å | 1.42Å | Aromatic |
| C13 | C06 | sing | 1.38Å | 1.42Å | Aromatic |
| C14 | C05 | sing | 1.51Å | 1.56Å | |
| C11 | O10 | sing | 1.43Å | 1.41Å | |
| O10 | C09 | sing | 1.36Å | 1.37Å | |
| C09 | C08 | doub | 1.39Å | 1.40Å | Aromatic |
| O36 | C34 | sing | 1.43Å | 1.41Å | |
| C35 | O37 | sing | 1.34Å | 1.25Å | |
| C35 | C34 | sing | 1.51Å | 1.53Å | |
| C06 | C05 | sing | 1.51Å | 1.57Å | |
| C06 | C07 | doub | 1.38Å | 1.42Å | Aromatic |
| C05 | C22 | sing | 1.51Å | 1.56Å | |
| C05 | C04 | sing | 1.51Å | 1.54Å | |
| C34 | C33 | sing | 1.53Å | 1.56Å | |
| C23 | C22 | doub | 1.38Å | 1.42Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.41Å | Aromatic |
| C08 | C07 | sing | 1.38Å | 1.40Å | Aromatic |
| C22 | C29 | sing | 1.38Å | 1.42Å | Aromatic |
| C24 | C25 | doub | 1.39Å | 1.40Å | Aromatic |
| C04 | C03 | doub | 1.31Å | 1.35Å | |
| C33 | N01 | sing | 1.47Å | 1.50Å | |
| C33 | C32 | sing | 1.54Å | 1.54Å | |
| C03 | C02 | sing | 1.51Å | 1.52Å | |
| C29 | C28 | doub | 1.38Å | 1.41Å | Aromatic |
| C25 | C28 | sing | 1.39Å | 1.42Å | Aromatic |
| C25 | O26 | sing | 1.36Å | 1.38Å | |
| N01 | C02 | sing | 1.47Å | 1.49Å | |
| N01 | C30 | sing | 1.48Å | 1.47Å | |
| O26 | C27 | sing | 1.43Å | 1.42Å | |
| C32 | C31 | sing | 1.55Å | 1.52Å | |
| C30 | C31 | sing | 1.55Å | 1.53Å | |
| C13 | H1 | sing | 1.08Å | 1.08Å | |
| C16 | H2 | sing | 1.08Å | 1.08Å | |
| C21 | H3 | sing | 1.08Å | 1.08Å | |
| C23 | H4 | sing | 1.08Å | 1.08Å | |
| C24 | H5 | sing | 1.08Å | 1.08Å | |
| C27 | H6 | sing | 1.09Å | 1.10Å | |
| C27 | H7 | sing | 1.09Å | 1.10Å | |
| C27 | H8 | sing | 1.09Å | 1.10Å | |
| C28 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C29 | H11 | sing | 1.08Å | 1.08Å | |
| C30 | H12 | sing | 1.09Å | 1.10Å | |
| C30 | H13 | sing | 1.09Å | 1.10Å | |
| C31 | H14 | sing | 1.09Å | 1.10Å | |
| C31 | H15 | sing | 1.09Å | 1.10Å | |
| C32 | H16 | sing | 1.09Å | 1.10Å | |
| C32 | H17 | sing | 1.09Å | 1.10Å | |
| C02 | H18 | sing | 1.09Å | 1.10Å | |
| C02 | H19 | sing | 1.09Å | 1.10Å | |
| C03 | H20 | sing | 1.08Å | 1.08Å | |
| C04 | H21 | sing | 1.08Å | 1.08Å | |
| C07 | H22 | sing | 1.08Å | 1.08Å | |
| C08 | H23 | sing | 1.08Å | 1.08Å | |
| C11 | H24 | sing | 1.09Å | 1.10Å | |
| C11 | H25 | sing | 1.09Å | 1.10Å | |
| C11 | H26 | sing | 1.09Å | 1.10Å | |
| C15 | H27 | sing | 1.08Å | 1.08Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| C19 | H30 | sing | 1.09Å | 1.10Å | |
| C20 | H31 | sing | 1.08Å | 1.08Å | |
| C33 | H32 | sing | 1.09Å | 1.10Å | |
| C34 | H33 | sing | 1.09Å | 1.10Å | |
| O36 | H35 | sing | 0.97Å | 0.95Å | |
| O37 | H36 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | O18 | C17 | 118.6° | 117.0° |
| O18 | C19 | H28 | 109.5° | 109.5° |
| O18 | C19 | H29 | 109.4° | 109.5° |
| O18 | C19 | H30 | 109.5° | 109.5° |
| O18 | C17 | C16 | 117.8° | 120.0° |
| O18 | C17 | C20 | 124.1° | 120.1° |
| C16 | C17 | C20 | 118.0° | 119.9° |
| C17 | C16 | C15 | 121.2° | 119.9° |
| C17 | C16 | H2 | 119.4° | 120.1° |
| C17 | C20 | C21 | 120.5° | 119.9° |
| C17 | C20 | H31 | 119.8° | 120.0° |
| C16 | C15 | C14 | 121.5° | 120.1° |
| C15 | C16 | H2 | 119.4° | 120.1° |
| C16 | C15 | H27 | 119.2° | 119.9° |
| C20 | C21 | C14 | 122.4° | 120.0° |
| C20 | C21 | H3 | 118.8° | 119.9° |
| C21 | C20 | H31 | 119.7° | 120.1° |
| C15 | C14 | C21 | 116.3° | 120.1° |
| C15 | C14 | C05 | 122.4° | 120.0° |
| C14 | C15 | H27 | 119.2° | 120.0° |
| O38 | C35 | O37 | 124.2° | 120.0° |
| O38 | C35 | C34 | 118.4° | 120.0° |
| C13 | C12 | C09 | 120.5° | 120.0° |
| C12 | C13 | C06 | 122.0° | 120.0° |
| C12 | C13 | H1 | 119.0° | 120.0° |
| C13 | C12 | H10 | 119.8° | 120.0° |
| C12 | C09 | O10 | 123.9° | 120.0° |
| C12 | C09 | C08 | 118.7° | 119.9° |
| C09 | C12 | H10 | 119.8° | 120.1° |
| C21 | C14 | C05 | 121.3° | 119.9° |
| C14 | C21 | H3 | 118.8° | 120.0° |
| C13 | C06 | C05 | 120.8° | 119.9° |
| C13 | C06 | C07 | 116.0° | 120.2° |
| C06 | C13 | H1 | 119.0° | 120.0° |
| C14 | C05 | C06 | 108.6° | 109.5° |
| C14 | C05 | C22 | 110.4° | 109.5° |
| C14 | C05 | C04 | 108.9° | 109.5° |
| C11 | O10 | C09 | 116.5° | 116.9° |
| O10 | C11 | H24 | 109.5° | 109.5° |
| O10 | C11 | H25 | 109.5° | 109.5° |
| O10 | C11 | H26 | 109.5° | 109.5° |
| O10 | C09 | C08 | 117.4° | 120.1° |
| C09 | C08 | C07 | 120.5° | 119.9° |
| C09 | C08 | H23 | 119.8° | 120.1° |
| O36 | C34 | C35 | 106.3° | 109.4° |
| O36 | C34 | C33 | 108.4° | 109.5° |
| O36 | C34 | H33 | 110.2° | 109.5° |
| C34 | O36 | H35 | 109.5° | 114.0° |
| O37 | C35 | C34 | 117.3° | 119.9° |
| C35 | O37 | H36 | 109.5° | 117.0° |
| C35 | C34 | C33 | 115.3° | 109.5° |
| C35 | C34 | H33 | 108.5° | 109.4° |
| C05 | C06 | C07 | 123.2° | 119.9° |
| C06 | C05 | C22 | 114.7° | 109.5° |
| C06 | C05 | C04 | 104.7° | 109.5° |
| C06 | C07 | C08 | 122.3° | 120.1° |
| C06 | C07 | H22 | 118.9° | 120.0° |
| C22 | C05 | C04 | 109.2° | 109.5° |
| C05 | C22 | C23 | 122.6° | 119.9° |
| C05 | C22 | C29 | 120.6° | 120.0° |
| C05 | C04 | C03 | 124.0° | 120.0° |
| C05 | C04 | H21 | 118.0° | 120.0° |
| C34 | C33 | N01 | 115.6° | 109.9° |
| C34 | C33 | C32 | 116.0° | 109.9° |
| C34 | C33 | H32 | 106.9° | 110.0° |
| C33 | C34 | H33 | 108.1° | 109.5° |
| C22 | C23 | C24 | 121.9° | 120.0° |
| C23 | C22 | C29 | 116.8° | 120.1° |
| C22 | C23 | H4 | 119.1° | 120.0° |
| C23 | C24 | C25 | 120.5° | 119.9° |
| C24 | C23 | H4 | 119.0° | 120.0° |
| C23 | C24 | H5 | 119.7° | 120.1° |
| C08 | C07 | H22 | 118.8° | 119.9° |
| C07 | C08 | H23 | 119.7° | 120.0° |
| C22 | C29 | C28 | 121.4° | 120.1° |
| C22 | C29 | H11 | 119.3° | 120.0° |
| C24 | C25 | C28 | 118.6° | 119.9° |
| C24 | C25 | O26 | 117.1° | 120.1° |
| C25 | C24 | H5 | 119.7° | 120.0° |
| C04 | C03 | C02 | 130.3° | 120.0° |
| C04 | C03 | H20 | 114.9° | 120.0° |
| C03 | C04 | H21 | 118.0° | 119.9° |
| N01 | C33 | C32 | 103.0° | 107.2° |
| C33 | N01 | C02 | 122.9° | 111.0° |
| C33 | N01 | C30 | 103.5° | 108.6° |
| N01 | C33 | H32 | 107.6° | 109.9° |
| C33 | C32 | C31 | 106.6° | 103.0° |
| C33 | C32 | H16 | 110.2° | 110.7° |
| C33 | C32 | H17 | 110.2° | 110.9° |
| C32 | C33 | H32 | 107.2° | 109.9° |
| C03 | C02 | N01 | 117.0° | 109.5° |
| C03 | C02 | H18 | 107.6° | 109.4° |
| C03 | C02 | H19 | 107.6° | 109.5° |
| C02 | C03 | H20 | 114.8° | 120.0° |
| C29 | C28 | C25 | 120.6° | 119.9° |
| C29 | C28 | H9 | 119.7° | 120.1° |
| C28 | C29 | H11 | 119.3° | 119.9° |
| C28 | C25 | O26 | 124.3° | 120.0° |
| C25 | C28 | H9 | 119.7° | 120.0° |
| C25 | O26 | C27 | 117.0° | 117.0° |
| C02 | N01 | C30 | 111.3° | 111.0° |
| N01 | C02 | H18 | 107.6° | 109.5° |
| N01 | C02 | H19 | 107.6° | 109.5° |
| N01 | C30 | C31 | 105.5° | 104.8° |
| N01 | C30 | H12 | 110.5° | 110.3° |
| N01 | C30 | H13 | 110.5° | 110.5° |
| O26 | C27 | H6 | 109.5° | 109.4° |
| O26 | C27 | H7 | 109.5° | 109.5° |
| O26 | C27 | H8 | 109.4° | 109.5° |
| C32 | C31 | C30 | 104.4° | 101.7° |
| C32 | C31 | H14 | 110.7° | 111.0° |
| C32 | C31 | H15 | 110.8° | 111.0° |
| C31 | C32 | H16 | 110.2° | 110.7° |
| C31 | C32 | H17 | 110.2° | 110.7° |
| C31 | C30 | H12 | 110.4° | 110.4° |
| C31 | C30 | H13 | 110.4° | 110.4° |
| C30 | C31 | H14 | 110.7° | 111.0° |
| C30 | C31 | H15 | 110.7° | 111.0° |
| H6 | C27 | H7 | 109.5° | 109.5° |
| H6 | C27 | H8 | 109.5° | 109.4° |
| H7 | C27 | H8 | 109.5° | 109.5° |
| H12 | C30 | H13 | 109.5° | 110.3° |
| H14 | C31 | H15 | 109.5° | 110.9° |
| H16 | C32 | H17 | 109.5° | 110.6° |
| H18 | C02 | H19 | 109.4° | 109.5° |
| H24 | C11 | H25 | 109.5° | 109.5° |
| H24 | C11 | H26 | 109.5° | 109.4° |
| H25 | C11 | H26 | 109.5° | 109.4° |
| H28 | C19 | H29 | 109.5° | 109.5° |
| H28 | C19 | H30 | 109.5° | 109.4° |
| H29 | C19 | H30 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | O18 | C17 | C16 | 170.2° | 180.0° |
| C19 | O18 | C17 | C20 | 11.1° | 0.1° |
| O18 | C19 | H28 | H29 | 120.0° | 120.0° |
| O18 | C19 | H28 | H30 | 120.0° | 120.1° |
| O18 | C19 | H29 | H30 | 120.0° | 120.0° |
| O18 | C17 | C16 | C20 | 178.8° | 179.9° |
| O18 | C17 | C16 | C15 | 179.3° | 180.0° |
| O18 | C17 | C20 | C21 | 179.5° | 180.0° |
| O18 | C17 | C16 | H2 | 0.7° | 0.3° |
| C17 | O18 | C19 | H28 | 180.0° | 60.0° |
| C17 | O18 | C19 | H29 | 60.0° | 180.0° |
| C17 | O18 | C19 | H30 | 60.0° | 60.0° |
| O18 | C17 | C20 | H31 | 0.5° | 0.1° |
| C17 | C16 | C15 | H2 | 180.0° | 179.7° |
| C16 | C17 | C20 | C21 | 0.8° | 0.2° |
| C17 | C16 | C15 | C14 | 0.5° | 0.3° |
| C17 | C16 | C15 | H27 | 179.6° | 179.8° |
| C16 | C17 | C20 | H31 | 179.2° | 180.0° |
| C20 | C17 | C16 | C15 | 0.5° | 0.1° |
| C17 | C20 | C21 | H31 | 180.0° | 179.8° |
| C17 | C20 | C21 | C14 | 0.2° | 0.4° |
| C20 | C17 | C16 | H2 | 179.5° | 179.8° |
| C17 | C20 | C21 | H3 | 179.8° | 179.8° |
| C16 | C15 | C14 | H27 | 180.0° | 180.0° |
| C16 | C15 | C14 | C21 | 1.1° | 0.5° |
| C16 | C15 | C14 | C05 | 179.4° | 179.5° |
| C20 | C21 | C14 | C15 | 0.7° | 0.6° |
| C20 | C21 | C14 | H3 | 180.0° | 179.4° |
| C20 | C21 | C14 | C05 | 179.1° | 179.4° |
| C15 | C14 | C21 | C05 | 178.3° | 180.0° |
| C15 | C14 | C05 | C06 | 79.6° | 113.0° |
| C15 | C14 | C05 | C22 | 47.0° | 7.0° |
| C15 | C14 | C05 | C04 | 166.9° | 127.0° |
| C14 | C15 | C16 | H2 | 179.6° | 180.0° |
| C15 | C14 | C21 | H3 | 179.3° | 180.0° |
| O38 | C35 | C34 | O36 | 1.2° | 7.9° |
| O38 | C35 | O37 | C34 | 179.9° | 180.0° |
| O38 | C35 | C34 | C33 | 119.0° | 112.1° |
| O38 | C35 | C34 | H33 | 119.6° | 127.9° |
| O38 | C35 | O37 | H36 | 0.0° | 0.1° |
| C13 | C12 | C09 | H10 | 180.0° | 179.9° |
| C12 | C13 | C06 | H1 | 180.0° | 179.7° |
| C13 | C12 | C09 | O10 | 180.0° | 180.0° |
| C13 | C12 | C09 | C08 | 0.3° | 0.6° |
| C12 | C13 | C06 | C05 | 179.2° | 179.7° |
| C12 | C13 | C06 | C07 | 1.0° | 0.3° |
| C09 | C12 | C13 | C06 | 0.2° | 0.0° |
| C12 | C09 | O10 | C11 | 57.1° | 180.0° |
| C12 | C09 | O10 | C08 | 179.7° | 179.4° |
| C12 | C09 | C08 | C07 | 0.0° | 0.9° |
| C09 | C12 | C13 | H1 | 179.8° | 179.7° |
| C12 | C09 | C08 | H23 | 180.0° | 179.7° |
| C21 | C14 | C05 | C06 | 98.7° | 66.9° |
| C21 | C14 | C05 | C22 | 134.7° | 173.1° |
| C21 | C14 | C05 | C04 | 14.8° | 53.1° |
| C21 | C14 | C15 | H27 | 179.0° | 179.5° |
| C14 | C21 | C20 | H31 | 179.8° | 179.7° |
| C13 | C06 | C05 | C14 | 17.7° | 178.3° |
| C13 | C06 | C05 | C07 | 178.1° | 180.0° |
| C13 | C06 | C05 | C22 | 141.8° | 58.3° |
| C13 | C06 | C05 | C04 | 98.5° | 61.7° |
| C13 | C06 | C07 | C08 | 1.3° | 0.0° |
| C06 | C13 | C12 | H10 | 179.8° | 180.0° |
| C13 | C06 | C07 | H22 | 178.7° | 180.0° |
| C14 | C05 | C06 | C22 | 124.1° | 120.0° |
| C14 | C05 | C06 | C04 | 116.3° | 120.0° |
| C14 | C05 | C06 | C07 | 164.2° | 1.7° |
| C14 | C05 | C22 | C04 | 119.8° | 120.0° |
| C14 | C05 | C22 | C23 | 92.6° | 68.8° |
| C14 | C05 | C22 | C29 | 89.8° | 111.2° |
| C14 | C05 | C04 | C03 | 107.5° | 120.0° |
| C05 | C14 | C21 | H3 | 0.9° | 0.1° |
| C14 | C05 | C04 | H21 | 72.5° | 60.0° |
| C05 | C14 | C15 | H27 | 0.7° | 0.4° |
| C11 | O10 | C09 | C08 | 122.6° | 0.7° |
| O10 | C11 | H24 | H25 | 120.0° | 120.1° |
| O10 | C11 | H24 | H26 | 120.0° | 120.0° |
| O10 | C11 | H25 | H26 | 120.0° | 120.0° |
| O10 | C09 | C08 | C07 | 179.7° | 179.7° |
| O10 | C09 | C12 | H10 | 0.0° | 0.0° |
| O10 | C09 | C08 | H23 | 0.3° | 0.4° |
| C09 | O10 | C11 | H24 | 180.0° | 60.0° |
| C09 | O10 | C11 | H25 | 60.0° | 60.1° |
| C09 | O10 | C11 | H26 | 60.0° | 180.0° |
| C09 | C08 | C07 | C06 | 0.8° | 0.6° |
| C09 | C08 | C07 | H23 | 180.0° | 179.4° |
| C08 | C09 | C12 | H10 | 179.7° | 179.3° |
| C09 | C08 | C07 | H22 | 179.2° | 179.4° |
| O36 | C34 | C35 | O37 | 179.0° | 172.2° |
| O36 | C34 | C35 | C33 | 120.2° | 120.0° |
| O36 | C34 | C35 | H33 | 118.5° | 120.0° |
| O36 | C34 | C33 | H33 | 119.4° | 120.0° |
| O36 | C34 | C33 | N01 | 57.4° | 69.3° |
| O36 | C34 | C33 | C32 | 178.3° | 173.0° |
| O36 | C34 | C33 | H32 | 62.3° | 51.9° |
| O37 | C35 | C34 | C33 | 60.8° | 67.9° |
| O37 | C35 | C34 | H33 | 60.5° | 52.2° |
| C35 | C34 | C33 | H33 | 121.6° | 120.0° |
| C35 | C34 | C33 | N01 | 176.5° | 170.8° |
| C35 | C34 | C33 | C32 | 62.7° | 53.0° |
| C35 | C34 | C33 | H32 | 56.8° | 68.1° |
| C35 | C34 | O36 | H35 | 0.6° | 64.9° |
| C34 | C35 | O37 | H36 | 179.9° | 180.0° |
| C06 | C05 | C22 | C04 | 117.1° | 120.0° |
| C06 | C05 | C22 | C23 | 30.6° | 51.2° |
| C05 | C06 | C07 | C08 | 179.5° | 180.0° |
| C06 | C05 | C22 | C29 | 147.1° | 128.8° |
| C06 | C05 | C04 | C03 | 8.6° | 0.0° |
| C05 | C06 | C13 | H1 | 0.8° | 0.0° |
| C06 | C05 | C04 | H21 | 171.4° | 180.0° |
| C05 | C06 | C07 | H22 | 0.5° | 0.0° |
| C07 | C06 | C05 | C22 | 40.1° | 121.7° |
| C07 | C06 | C05 | C04 | 79.5° | 118.3° |
| C06 | C07 | C08 | H22 | 180.0° | 180.0° |
| C07 | C06 | C13 | H1 | 179.0° | 180.0° |
| C06 | C07 | C08 | H23 | 179.2° | 180.0° |
| C05 | C22 | C23 | C29 | 177.7° | 180.0° |
| C05 | C22 | C23 | C24 | 179.1° | 179.9° |
| C22 | C05 | C04 | C03 | 131.9° | 120.0° |
| C05 | C22 | C29 | C28 | 178.8° | 180.0° |
| C05 | C22 | C23 | H4 | 0.9° | 0.3° |
| C05 | C22 | C29 | H11 | 1.2° | 0.1° |
| C22 | C05 | C04 | H21 | 48.2° | 60.0° |
| C04 | C05 | C22 | C23 | 147.7° | 171.2° |
| C04 | C05 | C22 | C29 | 30.0° | 8.8° |
| C05 | C04 | C03 | H21 | 180.0° | 179.9° |
| C05 | C04 | C03 | C02 | 179.9° | 180.0° |
| C05 | C04 | C03 | H20 | 0.2° | 0.0° |
| C34 | C33 | N01 | C32 | 127.7° | 119.4° |
| C34 | C33 | N01 | H32 | 119.3° | 121.2° |
| C34 | C33 | C32 | H32 | 119.3° | 121.2° |
| C34 | C33 | N01 | C02 | 40.5° | 3.9° |
| C34 | C33 | N01 | C30 | 167.4° | 118.4° |
| C34 | C33 | C32 | C31 | 152.0° | 141.7° |
| C34 | C33 | C32 | H16 | 88.4° | 23.3° |
| C34 | C33 | C32 | H17 | 32.5° | 99.9° |
| C33 | C34 | O36 | H35 | 124.0° | 55.1° |
| C22 | C23 | C24 | H4 | 180.0° | 179.7° |
| C22 | C23 | C24 | C25 | 0.5° | 0.1° |
| C23 | C22 | C29 | C28 | 1.0° | 0.0° |
| C22 | C23 | C24 | H5 | 179.5° | 180.0° |
| C23 | C22 | C29 | H11 | 179.0° | 179.9° |
| C24 | C23 | C22 | C29 | 1.3° | 0.0° |
| C23 | C24 | C25 | H5 | 180.0° | 179.9° |
| C23 | C24 | C25 | C28 | 0.7° | 0.0° |
| C23 | C24 | C25 | O26 | 179.2° | 180.0° |
| C22 | C29 | C28 | H11 | 180.0° | 179.9° |
| C22 | C29 | C28 | C25 | 0.1° | 0.1° |
| C29 | C22 | C23 | H4 | 178.7° | 179.7° |
| C22 | C29 | C28 | H9 | 179.9° | 180.0° |
| C24 | C25 | C28 | C29 | 1.0° | 0.0° |
| C24 | C25 | C28 | O26 | 178.4° | 180.0° |
| C24 | C25 | O26 | C27 | 160.9° | 180.0° |
| C25 | C24 | C23 | H4 | 179.5° | 179.7° |
| C24 | C25 | C28 | H9 | 179.0° | 180.0° |
| C04 | C03 | C02 | H20 | 180.0° | 180.0° |
| C04 | C03 | C02 | N01 | 81.1° | 125.0° |
| C04 | C03 | C02 | H18 | 157.8° | 115.0° |
| C04 | C03 | C02 | H19 | 40.0° | 5.0° |
| N01 | C33 | C32 | H32 | 113.3° | 119.4° |
| C33 | N01 | C02 | C03 | 84.4° | 177.7° |
| C33 | N01 | C02 | C30 | 123.5° | 120.9° |
| N01 | C33 | C32 | C31 | 24.6° | 22.3° |
| C33 | N01 | C30 | C31 | 40.1° | 24.1° |
| C33 | N01 | C30 | H12 | 159.5° | 142.9° |
| C33 | N01 | C30 | H13 | 79.2° | 94.8° |
| N01 | C33 | C32 | H16 | 144.2° | 96.1° |
| N01 | C33 | C32 | H17 | 94.9° | 140.8° |
| C33 | N01 | C02 | H18 | 36.7° | 57.7° |
| C33 | N01 | C02 | H19 | 154.5° | 62.3° |
| N01 | C33 | C34 | H33 | 62.0° | 50.8° |
| C32 | C33 | N01 | C02 | 87.2° | 123.2° |
| C32 | C33 | N01 | C30 | 39.7° | 1.0° |
| C33 | C32 | C31 | H16 | 119.5° | 118.3° |
| C33 | C32 | C31 | H17 | 119.6° | 118.6° |
| C33 | C32 | C31 | C30 | 0.8° | 35.6° |
| C33 | C32 | C31 | H14 | 118.4° | 153.8° |
| C33 | C32 | C31 | H15 | 120.0° | 82.5° |
| C33 | C32 | H16 | H17 | 121.4° | 123.3° |
| C32 | C33 | C34 | H33 | 58.9° | 67.0° |
| C03 | C02 | N01 | H18 | 121.1° | 120.0° |
| C03 | C02 | N01 | H19 | 121.1° | 120.0° |
| C03 | C02 | N01 | C30 | 152.2° | 61.4° |
| C03 | C02 | H18 | H19 | 116.6° | 120.0° |
| C02 | C03 | C04 | H21 | 0.2° | 0.1° |
| C29 | C28 | C25 | H9 | 180.0° | 180.0° |
| C29 | C28 | C25 | O26 | 179.4° | 180.0° |
| C28 | C25 | O26 | C27 | 17.5° | 0.0° |
| C28 | C25 | C24 | H5 | 179.3° | 180.0° |
| C25 | C28 | C29 | H11 | 179.9° | 180.0° |
| O26 | C25 | C24 | H5 | 0.8° | 0.0° |
| C25 | O26 | C27 | H6 | 180.0° | 60.0° |
| C25 | O26 | C27 | H7 | 60.0° | 60.0° |
| C25 | O26 | C27 | H8 | 60.0° | 180.0° |
| O26 | C25 | C28 | H9 | 0.6° | 0.0° |
| C02 | N01 | C30 | C31 | 93.8° | 146.4° |
| C02 | N01 | C30 | H12 | 25.6° | 94.8° |
| C02 | N01 | C30 | H13 | 146.9° | 27.5° |
| N01 | C02 | H18 | H19 | 116.6° | 120.0° |
| N01 | C02 | C03 | H20 | 98.9° | 55.0° |
| C02 | N01 | C33 | H32 | 159.8° | 117.3° |
| N01 | C30 | C31 | C32 | 24.1° | 37.0° |
| N01 | C30 | C31 | H12 | 119.4° | 118.8° |
| N01 | C30 | C31 | H13 | 119.4° | 119.0° |
| N01 | C30 | H12 | H13 | 121.9° | 122.3° |
| N01 | C30 | C31 | H14 | 143.3° | 155.2° |
| N01 | C30 | C31 | H15 | 95.1° | 81.1° |
| C30 | N01 | C02 | H18 | 86.7° | 178.6° |
| C30 | N01 | C02 | H19 | 31.1° | 58.6° |
| C30 | N01 | C33 | H32 | 73.3° | 120.4° |
| O26 | C27 | H6 | H7 | 120.0° | 120.0° |
| O26 | C27 | H6 | H8 | 120.0° | 120.0° |
| O26 | C27 | H7 | H8 | 120.0° | 120.0° |
| C32 | C31 | C30 | H14 | 119.2° | 118.1° |
| C32 | C31 | C30 | H15 | 119.2° | 118.1° |
| C32 | C31 | C30 | H12 | 143.5° | 155.9° |
| C32 | C31 | C30 | H13 | 95.3° | 81.9° |
| C32 | C31 | H14 | H15 | 122.4° | 123.8° |
| C31 | C32 | H16 | H17 | 121.3° | 123.1° |
| C31 | C32 | C33 | H32 | 88.7° | 97.2° |
| C31 | C30 | H12 | H13 | 121.8° | 122.3° |
| C30 | C31 | H14 | H15 | 122.3° | 123.8° |
| C30 | C31 | C32 | H16 | 120.3° | 82.7° |
| C30 | C31 | C32 | H17 | 118.8° | 154.2° |
| H1 | C13 | C12 | H10 | 0.2° | 0.4° |
| H2 | C16 | C15 | H27 | 0.4° | 0.0° |
| H3 | C21 | C20 | H31 | 0.2° | 0.3° |
| H4 | C23 | C24 | H5 | 0.5° | 0.3° |
| H6 | C27 | H7 | H8 | 120.0° | 120.0° |
| H9 | C28 | C29 | H11 | 0.1° | 0.1° |
| H12 | C30 | C31 | H14 | 97.3° | 86.0° |
| H12 | C30 | C31 | H15 | 24.2° | 37.7° |
| H13 | C30 | C31 | H14 | 23.9° | 36.2° |
| H13 | C30 | C31 | H15 | 145.5° | 160.0° |
| H14 | C31 | C32 | H16 | 1.2° | 35.4° |
| H14 | C31 | C32 | H17 | 122.1° | 87.7° |
| H15 | C31 | C32 | H16 | 120.5° | 159.2° |
| H15 | C31 | C32 | H17 | 0.4° | 36.1° |
| H16 | C32 | C33 | H32 | 30.8° | 144.5° |
| H17 | C32 | C33 | H32 | 151.8° | 21.3° |
| H18 | C02 | C03 | H20 | 22.2° | 65.0° |
| H19 | C02 | C03 | H20 | 140.0° | 175.0° |
| H20 | C03 | C04 | H21 | 179.8° | 180.0° |
| H22 | C07 | C08 | H23 | 0.8° | 0.1° |
| H24 | C11 | H25 | H26 | 120.0° | 119.9° |
| H28 | C19 | H29 | H30 | 120.0° | 119.9° |
| H32 | C33 | C34 | H33 | 178.3° | 171.9° |
| H33 | C34 | O36 | H35 | 117.9° | 175.1° |
