OWP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C12 | O11 | sing | 1.43Å | 1.40Å | |
| C09 | O08 | sing | 1.43Å | 1.41Å | |
| O08 | C07 | sing | 1.36Å | 1.40Å | |
| O11 | C10 | sing | 1.36Å | 1.39Å | |
| C07 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| C07 | C06 | sing | 1.39Å | 1.38Å | Aromatic |
| C10 | C13 | sing | 1.40Å | 1.39Å | Aromatic |
| C06 | C05 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.47Å | 1.52Å | |
| C13 | C31 | doub | 1.40Å | 1.39Å | Aromatic |
| C14 | C15 | doub | 1.35Å | 1.34Å | |
| C05 | C31 | sing | 1.38Å | 1.40Å | Aromatic |
| C05 | C04 | sing | 1.51Å | 1.52Å | |
| C32 | N33 | doub | 1.33Å | 1.34Å | Aromatic |
| C32 | C03 | sing | 1.38Å | 1.41Å | Aromatic |
| O30 | C16 | doub | 1.22Å | 1.22Å | |
| N33 | C34 | sing | 1.32Å | 1.33Å | Aromatic |
| C15 | C16 | sing | 1.46Å | 1.53Å | |
| C04 | C03 | sing | 1.51Å | 1.52Å | |
| C16 | N17 | sing | 1.35Å | 1.45Å | |
| C03 | C02 | doub | 1.40Å | 1.42Å | Aromatic |
| C34 | N35 | sing | 1.38Å | 1.41Å | |
| C34 | N36 | doub | 1.33Å | 1.31Å | Aromatic |
| C39 | C41 | doub | 1.38Å | 1.40Å | Aromatic |
| C39 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| C21 | C22 | sing | 1.51Å | 1.52Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C41 | C42 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C38 | doub | 1.38Å | 1.40Å | Aromatic |
| C02 | N36 | sing | 1.33Å | 1.33Å | Aromatic |
| C02 | N01 | sing | 1.38Å | 1.42Å | |
| N17 | C20 | sing | 1.47Å | 1.44Å | |
| N17 | N18 | sing | 1.37Å | 1.44Å | |
| C20 | C24 | sing | 1.51Å | 1.54Å | |
| C42 | C40 | doub | 1.38Å | 1.39Å | Aromatic |
| C38 | C40 | sing | 1.38Å | 1.40Å | Aromatic |
| N18 | C19 | sing | 1.47Å | 1.46Å | |
| C24 | C29 | doub | 1.38Å | 1.43Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C25 | sing | 1.51Å | 1.55Å | |
| C25 | C26 | doub | 1.39Å | 1.42Å | Aromatic |
| C28 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.40Å | Aromatic |
| C04 | H1 | sing | 1.09Å | 1.10Å | |
| C04 | H2 | sing | 1.09Å | 1.10Å | |
| C06 | H3 | sing | 1.08Å | 1.08Å | |
| C09 | H4 | sing | 1.09Å | 1.10Å | |
| C09 | H5 | sing | 1.09Å | 1.10Å | |
| C09 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.08Å | 1.08Å | |
| C15 | H11 | sing | 1.08Å | 1.08Å | |
| C19 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C26 | H16 | sing | 1.08Å | 1.08Å | |
| C27 | H17 | sing | 1.08Å | 1.08Å | |
| C28 | H18 | sing | 1.08Å | 1.08Å | |
| C29 | H19 | sing | 1.08Å | 1.08Å | |
| C31 | H20 | sing | 1.08Å | 1.08Å | |
| C32 | H21 | sing | 1.08Å | 1.08Å | |
| C38 | H22 | sing | 1.08Å | 1.08Å | |
| C39 | H23 | sing | 1.08Å | 1.08Å | |
| C40 | H24 | sing | 1.08Å | 1.08Å | |
| C41 | H25 | sing | 1.08Å | 1.08Å | |
| C42 | H26 | sing | 1.08Å | 1.08Å | |
| N01 | H27 | sing | 0.97Å | 1.00Å | |
| N01 | H28 | sing | 0.97Å | 1.00Å | |
| N35 | H29 | sing | 0.97Å | 1.00Å | |
| N35 | H30 | sing | 0.97Å | 1.00Å | |
| C19 | H31 | sing | 1.09Å | 1.10Å | |
| N18 | H32 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | O11 | C10 | 108.6° | 117.0° |
| O11 | C12 | H7 | 109.5° | 109.4° |
| O11 | C12 | H8 | 109.5° | 109.5° |
| O11 | C12 | H9 | 109.5° | 109.5° |
| C09 | O08 | C07 | 116.5° | 117.0° |
| O08 | C09 | H4 | 109.5° | 109.5° |
| O08 | C09 | H5 | 109.5° | 109.4° |
| O08 | C09 | H6 | 109.5° | 109.4° |
| O08 | C07 | C10 | 118.5° | 120.0° |
| O08 | C07 | C06 | 121.6° | 120.0° |
| O11 | C10 | C07 | 119.0° | 120.2° |
| O11 | C10 | C13 | 119.2° | 120.2° |
| C10 | C07 | C06 | 119.8° | 120.0° |
| C07 | C10 | C13 | 121.7° | 119.6° |
| C07 | C06 | C05 | 118.9° | 120.4° |
| C07 | C06 | H3 | 120.5° | 119.8° |
| C10 | C13 | C14 | 119.8° | 120.2° |
| C10 | C13 | C31 | 119.0° | 119.6° |
| C06 | C05 | C31 | 121.5° | 120.4° |
| C06 | C05 | C04 | 117.2° | 119.8° |
| C05 | C06 | H3 | 120.6° | 119.8° |
| C14 | C13 | C31 | 121.2° | 120.2° |
| C13 | C14 | C15 | 126.0° | 120.0° |
| C13 | C14 | H10 | 117.0° | 120.0° |
| C13 | C31 | C05 | 119.1° | 120.0° |
| C13 | C31 | H20 | 120.4° | 120.0° |
| C14 | C15 | C16 | 118.9° | 120.0° |
| C15 | C14 | H10 | 117.0° | 120.0° |
| C14 | C15 | H11 | 120.5° | 120.0° |
| C31 | C05 | C04 | 121.3° | 119.8° |
| C05 | C31 | H20 | 120.4° | 120.0° |
| C05 | C04 | C03 | 114.3° | 109.5° |
| C05 | C04 | H1 | 108.2° | 109.5° |
| C05 | C04 | H2 | 108.2° | 109.5° |
| N33 | C32 | C03 | 118.6° | 119.3° |
| C32 | N33 | C34 | 121.1° | 120.9° |
| N33 | C32 | H21 | 120.7° | 120.4° |
| C32 | C03 | C04 | 123.6° | 120.8° |
| C32 | C03 | C02 | 118.2° | 118.5° |
| C03 | C32 | H21 | 120.7° | 120.3° |
| O30 | C16 | C15 | 117.3° | 120.0° |
| O30 | C16 | N17 | 119.6° | 120.0° |
| N33 | C34 | N35 | 121.5° | 119.2° |
| N33 | C34 | N36 | 121.7° | 121.7° |
| C15 | C16 | N17 | 123.1° | 120.0° |
| C16 | C15 | H11 | 120.6° | 120.0° |
| C04 | C03 | C02 | 118.2° | 120.7° |
| C03 | C04 | H1 | 108.2° | 109.5° |
| C03 | C04 | H2 | 108.2° | 109.5° |
| C16 | N17 | C20 | 116.1° | 121.2° |
| C16 | N17 | N18 | 123.7° | 121.2° |
| C03 | C02 | N36 | 118.4° | 119.0° |
| C03 | C02 | N01 | 121.9° | 120.5° |
| N35 | C34 | N36 | 116.7° | 119.2° |
| C34 | N35 | H29 | 109.5° | 120.0° |
| C34 | N35 | H30 | 109.5° | 120.0° |
| C34 | N36 | C02 | 122.0° | 120.6° |
| C41 | C39 | C22 | 120.0° | 120.0° |
| C39 | C41 | C42 | 120.2° | 120.0° |
| C41 | C39 | H23 | 120.0° | 120.0° |
| C39 | C41 | H25 | 119.9° | 120.0° |
| C39 | C22 | C21 | 120.6° | 120.0° |
| C39 | C22 | C38 | 119.8° | 120.0° |
| C22 | C39 | H23 | 120.0° | 120.0° |
| C22 | C21 | C20 | 112.0° | 109.4° |
| C21 | C22 | C38 | 119.6° | 120.0° |
| C22 | C21 | H14 | 108.8° | 109.5° |
| C22 | C21 | H15 | 108.8° | 109.5° |
| C21 | C20 | N17 | 111.7° | 109.7° |
| C21 | C20 | C24 | 111.6° | 109.6° |
| C21 | C20 | H13 | 107.1° | 109.6° |
| C20 | C21 | H14 | 108.8° | 109.5° |
| C20 | C21 | H15 | 108.8° | 109.5° |
| C41 | C42 | C40 | 119.7° | 120.0° |
| C42 | C41 | H25 | 119.9° | 120.0° |
| C41 | C42 | H26 | 120.1° | 120.0° |
| C22 | C38 | C40 | 119.9° | 120.0° |
| C22 | C38 | H22 | 120.0° | 120.0° |
| N36 | C02 | N01 | 119.8° | 120.4° |
| C02 | N01 | H27 | 109.5° | 120.1° |
| C02 | N01 | H28 | 109.5° | 120.0° |
| C20 | N17 | N18 | 120.2° | 117.6° |
| N17 | C20 | C24 | 110.8° | 108.9° |
| N17 | C20 | H13 | 108.3° | 109.5° |
| N17 | N18 | C19 | 117.4° | 110.1° |
| N17 | N18 | H32 | 107.4° | 111.0° |
| C20 | C24 | C29 | 121.6° | 118.9° |
| C20 | C24 | C25 | 117.7° | 121.0° |
| C24 | C20 | H13 | 107.1° | 109.6° |
| C42 | C40 | C38 | 120.4° | 120.0° |
| C42 | C40 | H24 | 119.8° | 119.9° |
| C40 | C42 | H26 | 120.1° | 120.0° |
| C40 | C38 | H22 | 120.1° | 120.0° |
| C38 | C40 | H24 | 119.8° | 120.0° |
| N18 | C19 | C25 | 115.2° | 110.7° |
| N18 | C19 | H12 | 108.0° | 109.2° |
| N18 | C19 | H31 | 108.0° | 109.2° |
| C19 | N18 | H32 | 107.4° | 111.0° |
| C29 | C24 | C25 | 120.7° | 120.1° |
| C24 | C29 | C28 | 120.6° | 120.2° |
| C24 | C29 | H19 | 119.7° | 119.9° |
| C24 | C25 | C19 | 120.9° | 121.7° |
| C24 | C25 | C26 | 117.6° | 119.6° |
| C29 | C28 | C27 | 119.2° | 119.8° |
| C29 | C28 | H18 | 120.4° | 120.1° |
| C28 | C29 | H19 | 119.7° | 119.9° |
| C19 | C25 | C26 | 121.5° | 118.7° |
| C25 | C19 | H12 | 108.0° | 109.2° |
| C25 | C19 | H31 | 108.0° | 109.2° |
| C25 | C26 | C27 | 122.0° | 120.3° |
| C25 | C26 | H16 | 119.0° | 119.9° |
| C28 | C27 | C26 | 119.9° | 120.0° |
| C28 | C27 | H17 | 120.1° | 120.0° |
| C27 | C28 | H18 | 120.4° | 120.1° |
| C27 | C26 | H16 | 119.0° | 119.8° |
| C26 | C27 | H17 | 120.1° | 120.0° |
| H1 | C04 | H2 | 109.5° | 109.4° |
| H4 | C09 | H5 | 109.5° | 109.5° |
| H4 | C09 | H6 | 109.4° | 109.5° |
| H5 | C09 | H6 | 109.5° | 109.5° |
| H7 | C12 | H8 | 109.5° | 109.5° |
| H7 | C12 | H9 | 109.5° | 109.5° |
| H8 | C12 | H9 | 109.5° | 109.5° |
| H12 | C19 | H31 | 109.5° | 109.2° |
| H14 | C21 | H15 | 109.5° | 109.5° |
| H27 | N01 | H28 | 109.5° | 120.0° |
| H29 | N35 | H30 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | O11 | C10 | C07 | 86.0° | 90.0° |
| C12 | O11 | C10 | C13 | 91.7° | 90.0° |
| O11 | C12 | H7 | H8 | 120.0° | 120.0° |
| O11 | C12 | H7 | H9 | 120.0° | 120.0° |
| O11 | C12 | H8 | H9 | 120.0° | 120.0° |
| C09 | O08 | C07 | C10 | 179.6° | 180.0° |
| C09 | O08 | C07 | C06 | 1.7° | 0.0° |
| O08 | C09 | H4 | H5 | 120.0° | 120.0° |
| O08 | C09 | H4 | H6 | 120.0° | 120.0° |
| O08 | C09 | H5 | H6 | 120.0° | 119.9° |
| O08 | C07 | C10 | O11 | 2.6° | 0.1° |
| O08 | C07 | C10 | C06 | 178.7° | 180.0° |
| O08 | C07 | C10 | C13 | 179.8° | 180.0° |
| O08 | C07 | C06 | C05 | 179.3° | 180.0° |
| O08 | C07 | C06 | H3 | 0.7° | 0.0° |
| C07 | O08 | C09 | H4 | 180.0° | 180.0° |
| C07 | O08 | C09 | H5 | 60.0° | 60.0° |
| C07 | O08 | C09 | H6 | 60.0° | 60.0° |
| O11 | C10 | C07 | C13 | 177.6° | 180.0° |
| O11 | C10 | C07 | C06 | 178.7° | 180.0° |
| O11 | C10 | C13 | C14 | 0.2° | 0.0° |
| O11 | C10 | C13 | C31 | 177.6° | 180.0° |
| C10 | O11 | C12 | H7 | 180.0° | 180.0° |
| C10 | O11 | C12 | H8 | 60.0° | 60.0° |
| C10 | O11 | C12 | H9 | 60.0° | 60.0° |
| C10 | C07 | C06 | C05 | 2.1° | 0.0° |
| C07 | C10 | C13 | C14 | 177.4° | 180.0° |
| C07 | C10 | C13 | C31 | 0.0° | 0.0° |
| C10 | C07 | C06 | H3 | 177.9° | 180.0° |
| C06 | C07 | C10 | C13 | 1.1° | 0.0° |
| C07 | C06 | C05 | H3 | 180.0° | 180.0° |
| C07 | C06 | C05 | C31 | 1.9° | 0.0° |
| C07 | C06 | C05 | C04 | 179.9° | 179.7° |
| C10 | C13 | C14 | C31 | 177.4° | 180.0° |
| C10 | C13 | C14 | C15 | 92.1° | 180.0° |
| C10 | C13 | C31 | C05 | 0.2° | 0.0° |
| C10 | C13 | C14 | H10 | 87.9° | 0.1° |
| C10 | C13 | C31 | H20 | 179.8° | 179.8° |
| C06 | C05 | C31 | C13 | 0.8° | 0.0° |
| C06 | C05 | C31 | C04 | 178.1° | 179.8° |
| C06 | C05 | C04 | C03 | 121.5° | 89.7° |
| C06 | C05 | C04 | H1 | 0.8° | 150.2° |
| C06 | C05 | C04 | H2 | 117.8° | 30.3° |
| C06 | C05 | C31 | H20 | 179.2° | 179.8° |
| C13 | C14 | C15 | H10 | 180.0° | 179.9° |
| C14 | C13 | C31 | C05 | 177.6° | 180.0° |
| C13 | C14 | C15 | C16 | 179.5° | 180.0° |
| C13 | C14 | C15 | H11 | 0.5° | 0.1° |
| C14 | C13 | C31 | H20 | 2.5° | 0.3° |
| C31 | C13 | C14 | C15 | 90.5° | 0.0° |
| C13 | C31 | C05 | H20 | 180.0° | 179.7° |
| C13 | C31 | C05 | C04 | 178.9° | 179.7° |
| C31 | C13 | C14 | H10 | 89.5° | 180.0° |
| C14 | C15 | C16 | O30 | 89.6° | 0.0° |
| C14 | C15 | C16 | H11 | 180.0° | 179.9° |
| C14 | C15 | C16 | N17 | 91.1° | 180.0° |
| C31 | C05 | C04 | C03 | 60.3° | 90.0° |
| C31 | C05 | C04 | H1 | 179.0° | 30.0° |
| C31 | C05 | C04 | H2 | 60.4° | 149.9° |
| C31 | C05 | C06 | H3 | 178.0° | 180.0° |
| C05 | C04 | C03 | C32 | 13.1° | 95.0° |
| C05 | C04 | C03 | H1 | 120.7° | 120.0° |
| C05 | C04 | C03 | H2 | 120.7° | 120.0° |
| C05 | C04 | C03 | C02 | 166.9° | 85.0° |
| C05 | C04 | H1 | H2 | 117.8° | 120.0° |
| C04 | C05 | C06 | H3 | 0.2° | 0.3° |
| C04 | C05 | C31 | H20 | 1.0° | 0.0° |
| N33 | C32 | C03 | H21 | 180.0° | 179.9° |
| N33 | C32 | C03 | C04 | 178.9° | 180.0° |
| N33 | C32 | C03 | C02 | 1.1° | 0.0° |
| C32 | N33 | C34 | N35 | 178.5° | 180.0° |
| C32 | N33 | C34 | N36 | 0.0° | 0.1° |
| C03 | C32 | N33 | C34 | 0.3° | 0.0° |
| C32 | C03 | C04 | C02 | 180.0° | 180.0° |
| C32 | C03 | C02 | N36 | 1.7° | 0.0° |
| C32 | C03 | C02 | N01 | 178.8° | 179.7° |
| C32 | C03 | C04 | H1 | 107.6° | 25.0° |
| C32 | C03 | C04 | H2 | 133.8° | 145.0° |
| O30 | C16 | C15 | N17 | 179.4° | 180.0° |
| O30 | C16 | N17 | C20 | 0.4° | 0.0° |
| O30 | C16 | N17 | N18 | 178.7° | 180.0° |
| O30 | C16 | C15 | H11 | 90.4° | 179.9° |
| N33 | C34 | N35 | N36 | 178.6° | 179.9° |
| N33 | C34 | N36 | C02 | 0.7° | 0.1° |
| C34 | N33 | C32 | H21 | 179.7° | 180.0° |
| N33 | C34 | N35 | H29 | 0.0° | 180.0° |
| N33 | C34 | N35 | H30 | 120.0° | 0.1° |
| C15 | C16 | N17 | C20 | 178.9° | 180.0° |
| C15 | C16 | N17 | N18 | 0.6° | 0.1° |
| C16 | C15 | C14 | H10 | 0.5° | 0.1° |
| C04 | C03 | C02 | N36 | 178.3° | 180.0° |
| C04 | C03 | C02 | N01 | 1.2° | 0.3° |
| C03 | C04 | H1 | H2 | 117.8° | 120.0° |
| C04 | C03 | C32 | H21 | 1.1° | 0.1° |
| C16 | N17 | C20 | C21 | 104.8° | 105.0° |
| C16 | N17 | C20 | N18 | 178.3° | 179.9° |
| C16 | N17 | C20 | C24 | 130.1° | 135.1° |
| C16 | N17 | N18 | C19 | 151.3° | 113.5° |
| N17 | C16 | C15 | H11 | 89.0° | 0.0° |
| C16 | N17 | C20 | H13 | 13.0° | 15.3° |
| C16 | N17 | N18 | H32 | 87.5° | 123.2° |
| C03 | C02 | N36 | C34 | 1.5° | 0.1° |
| C03 | C02 | N36 | N01 | 179.5° | 179.7° |
| C02 | C03 | C04 | H1 | 72.4° | 155.0° |
| C02 | C03 | C04 | H2 | 46.2° | 35.0° |
| C02 | C03 | C32 | H21 | 178.9° | 180.0° |
| C03 | C02 | N01 | H27 | 179.5° | 179.7° |
| C03 | C02 | N01 | H28 | 60.5° | 0.3° |
| N35 | C34 | N36 | C02 | 179.2° | 180.0° |
| C34 | N35 | H29 | H30 | 120.0° | 179.9° |
| C34 | N36 | C02 | N01 | 179.0° | 179.8° |
| N36 | C34 | N35 | H29 | 178.5° | 0.1° |
| N36 | C34 | N35 | H30 | 61.5° | 180.0° |
| C41 | C39 | C22 | H23 | 180.0° | 180.0° |
| C41 | C39 | C22 | C21 | 179.6° | 180.0° |
| C39 | C41 | C42 | H25 | 180.0° | 180.0° |
| C41 | C39 | C22 | C38 | 0.0° | 0.3° |
| C39 | C41 | C42 | C40 | 0.6° | 0.4° |
| C39 | C41 | C42 | H26 | 179.4° | 180.0° |
| C39 | C22 | C21 | C38 | 179.5° | 179.7° |
| C39 | C22 | C21 | C20 | 70.0° | 90.3° |
| C22 | C39 | C41 | C42 | 0.5° | 0.0° |
| C39 | C22 | C38 | C40 | 0.4° | 0.3° |
| C39 | C22 | C21 | H14 | 169.6° | 149.7° |
| C39 | C22 | C21 | H15 | 50.4° | 29.7° |
| C39 | C22 | C38 | H22 | 179.6° | 179.7° |
| C22 | C39 | C41 | H25 | 179.5° | 180.0° |
| C22 | C21 | C20 | H14 | 120.4° | 120.0° |
| C22 | C21 | C20 | H15 | 120.4° | 120.0° |
| C22 | C21 | C20 | N17 | 166.5° | 65.6° |
| C22 | C21 | C20 | C24 | 41.9° | 175.0° |
| C21 | C22 | C38 | C40 | 180.0° | 179.9° |
| C22 | C21 | C20 | H13 | 75.0° | 54.7° |
| C22 | C21 | H14 | H15 | 118.8° | 120.0° |
| C21 | C22 | C38 | H22 | 0.0° | 0.1° |
| C21 | C22 | C39 | H23 | 0.4° | 0.0° |
| C20 | C21 | C22 | C38 | 109.6° | 90.1° |
| C21 | C20 | N17 | C24 | 125.1° | 119.9° |
| C21 | C20 | N17 | H13 | 117.7° | 120.3° |
| C21 | C20 | N17 | N18 | 76.9° | 75.0° |
| C21 | C20 | C24 | H13 | 116.9° | 120.3° |
| C21 | C20 | C24 | C29 | 89.8° | 70.7° |
| C21 | C20 | C24 | C25 | 91.8° | 109.2° |
| C20 | C21 | H14 | H15 | 118.8° | 120.0° |
| C41 | C42 | C40 | H26 | 180.0° | 179.6° |
| C41 | C42 | C40 | C38 | 0.2° | 0.4° |
| C42 | C41 | C39 | H23 | 179.5° | 180.0° |
| C41 | C42 | C40 | H24 | 179.8° | 179.7° |
| C22 | C38 | C40 | C42 | 0.3° | 0.1° |
| C22 | C38 | C40 | H22 | 180.0° | 180.0° |
| C38 | C22 | C21 | H14 | 10.8° | 29.9° |
| C38 | C22 | C21 | H15 | 130.1° | 150.0° |
| C38 | C22 | C39 | H23 | 180.0° | 179.7° |
| C22 | C38 | C40 | H24 | 179.7° | 179.9° |
| N36 | C02 | N01 | H27 | 0.0° | 0.0° |
| N36 | C02 | N01 | H28 | 120.0° | 180.0° |
| C02 | N01 | H27 | H28 | 120.0° | 180.0° |
| N17 | C20 | C24 | H13 | 117.9° | 119.7° |
| C20 | N17 | N18 | C19 | 26.8° | 66.6° |
| N17 | C20 | C24 | C29 | 145.1° | 169.3° |
| N17 | C20 | C24 | C25 | 33.4° | 10.8° |
| N17 | C20 | C21 | H14 | 46.2° | 54.5° |
| N17 | C20 | C21 | H15 | 73.1° | 174.5° |
| C20 | N17 | N18 | H32 | 94.3° | 56.7° |
| N18 | N17 | C20 | C24 | 48.2° | 44.9° |
| N17 | N18 | C19 | H32 | 121.1° | 123.3° |
| N17 | N18 | C19 | C25 | 9.4° | 48.9° |
| N17 | N18 | C19 | H12 | 111.4° | 71.4° |
| N18 | N17 | C20 | H13 | 165.4° | 164.7° |
| N17 | N18 | C19 | H31 | 130.2° | 169.2° |
| C20 | C24 | C29 | C25 | 178.4° | 179.9° |
| C20 | C24 | C29 | C28 | 180.0° | 179.6° |
| C20 | C24 | C25 | C19 | 0.1° | 0.5° |
| C20 | C24 | C25 | C26 | 179.3° | 179.5° |
| C24 | C20 | C21 | H14 | 78.5° | 65.0° |
| C24 | C20 | C21 | H15 | 162.2° | 55.0° |
| C20 | C24 | C29 | H19 | 0.0° | 0.3° |
| C42 | C40 | C38 | H24 | 180.0° | 179.9° |
| C42 | C40 | C38 | H22 | 179.7° | 179.9° |
| C40 | C42 | C41 | H25 | 179.4° | 179.7° |
| C38 | C40 | C42 | H26 | 179.8° | 180.0° |
| N18 | C19 | C25 | C24 | 22.4° | 18.8° |
| N18 | C19 | C25 | H12 | 120.8° | 120.3° |
| N18 | C19 | C25 | H31 | 120.9° | 120.3° |
| N18 | C19 | C25 | C26 | 157.0° | 161.2° |
| N18 | C19 | H12 | H31 | 117.4° | 119.4° |
| C24 | C29 | C28 | H19 | 180.0° | 180.0° |
| C29 | C24 | C25 | C19 | 178.5° | 179.5° |
| C29 | C24 | C25 | C26 | 0.9° | 0.4° |
| C24 | C29 | C28 | C27 | 1.5° | 0.0° |
| C29 | C24 | C20 | H13 | 27.1° | 49.6° |
| C24 | C29 | C28 | H18 | 178.5° | 180.0° |
| C25 | C24 | C29 | C28 | 1.6° | 0.3° |
| C24 | C25 | C19 | C26 | 179.4° | 180.0° |
| C24 | C25 | C26 | C27 | 0.0° | 0.3° |
| C24 | C25 | C19 | H12 | 98.4° | 101.5° |
| C25 | C24 | C20 | H13 | 151.3° | 130.5° |
| C24 | C25 | C26 | H16 | 180.0° | 179.7° |
| C25 | C24 | C29 | H19 | 178.4° | 179.7° |
| C24 | C25 | C19 | H31 | 143.3° | 139.2° |
| C29 | C28 | C27 | H18 | 180.0° | 180.0° |
| C29 | C28 | C27 | C26 | 0.6° | 0.2° |
| C29 | C28 | C27 | H17 | 179.4° | 179.8° |
| C19 | C25 | C26 | C27 | 179.4° | 179.7° |
| C25 | C19 | H12 | H31 | 117.4° | 119.3° |
| C19 | C25 | C26 | H16 | 0.6° | 0.3° |
| C25 | C19 | N18 | H32 | 130.5° | 74.4° |
| C25 | C26 | C27 | C28 | 0.1° | 0.0° |
| C25 | C26 | C27 | H16 | 180.0° | 180.0° |
| C26 | C25 | C19 | H12 | 82.2° | 78.5° |
| C25 | C26 | C27 | H17 | 179.8° | 180.0° |
| C26 | C25 | C19 | H31 | 36.1° | 40.9° |
| C28 | C27 | C26 | H17 | 180.0° | 180.0° |
| C28 | C27 | C26 | H16 | 179.9° | 180.0° |
| C27 | C28 | C29 | H19 | 178.6° | 180.0° |
| C26 | C27 | C28 | H18 | 179.4° | 179.9° |
| H4 | C09 | H5 | H6 | 120.0° | 120.0° |
| H7 | C12 | H8 | H9 | 120.0° | 120.0° |
| H10 | C14 | C15 | H11 | 179.4° | 180.0° |
| H12 | C19 | N18 | H32 | 9.7° | 165.3° |
| H13 | C20 | C21 | H14 | 164.6° | 174.7° |
| H13 | C20 | C21 | H15 | 45.4° | 65.3° |
| H16 | C26 | C27 | H17 | 0.1° | 0.1° |
| H17 | C27 | C28 | H18 | 0.6° | 0.2° |
| H18 | C28 | C29 | H19 | 1.4° | 0.0° |
| H22 | C38 | C40 | H24 | 0.3° | 0.1° |
| H23 | C39 | C41 | H25 | 0.5° | 0.1° |
| H24 | C40 | C42 | H26 | 0.2° | 0.1° |
| H25 | C41 | C42 | H26 | 0.6° | 0.1° |
| H31 | C19 | N18 | H32 | 108.6° | 45.9° |
