53J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N01 | C02 | sing | 1.38Å | 1.42Å | |
| C02 | N36 | doub | 1.33Å | 1.36Å | Aromatic |
| C02 | C03 | sing | 1.40Å | 1.39Å | Aromatic |
| N36 | C34 | sing | 1.32Å | 1.35Å | Aromatic |
| C27 | C26 | doub | 1.38Å | 1.38Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C04 | C03 | sing | 1.51Å | 1.53Å | |
| C04 | C05 | sing | 1.51Å | 1.53Å | |
| C26 | C25 | sing | 1.39Å | 1.44Å | Aromatic |
| C03 | C32 | doub | 1.38Å | 1.42Å | Aromatic |
| C34 | N35 | sing | 1.38Å | 1.44Å | |
| C34 | N33 | doub | 1.33Å | 1.35Å | Aromatic |
| C28 | C29 | doub | 1.39Å | 1.39Å | Aromatic |
| C05 | C31 | doub | 1.38Å | 1.41Å | Aromatic |
| C05 | C06 | sing | 1.39Å | 1.40Å | Aromatic |
| C31 | C13 | sing | 1.40Å | 1.41Å | Aromatic |
| C25 | C19 | sing | 1.47Å | 1.47Å | |
| C25 | C24 | doub | 1.40Å | 1.33Å | Aromatic |
| C19 | N18 | doub | 1.30Å | 1.41Å | |
| C32 | N33 | sing | 1.32Å | 1.36Å | Aromatic |
| C06 | C07 | doub | 1.38Å | 1.41Å | Aromatic |
| C29 | C24 | sing | 1.38Å | 1.44Å | Aromatic |
| C24 | C20 | sing | 1.51Å | 1.52Å | |
| C13 | C14 | sing | 1.47Å | 1.53Å | |
| C13 | C10 | doub | 1.40Å | 1.41Å | Aromatic |
| N18 | N17 | sing | 1.40Å | 1.36Å | |
| C14 | C15 | doub | 1.35Å | 1.37Å | |
| C07 | C10 | sing | 1.39Å | 1.41Å | Aromatic |
| C07 | O08 | sing | 1.36Å | 1.41Å | |
| C09 | O08 | sing | 1.43Å | 1.40Å | |
| C10 | O11 | sing | 1.36Å | 1.38Å | |
| N17 | C20 | sing | 1.47Å | 1.45Å | |
| N17 | C16 | sing | 1.35Å | 1.44Å | |
| C20 | C21 | sing | 1.51Å | 1.50Å | |
| C12 | O11 | sing | 1.43Å | 1.39Å | |
| C15 | C16 | sing | 1.46Å | 1.52Å | |
| C16 | O30 | doub | 1.22Å | 1.22Å | |
| C37 | C22 | sing | 1.51Å | 1.52Å | |
| C21 | C22 | doub | 1.31Å | 1.39Å | |
| C22 | C23 | sing | 1.51Å | 1.50Å | |
| C12 | H1 | sing | 1.09Å | 1.10Å | |
| C12 | H2 | sing | 1.09Å | 1.10Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.08Å | 1.08Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C19 | H6 | sing | 1.08Å | 1.08Å | |
| N01 | H8 | sing | 0.97Å | 1.00Å | |
| N01 | H9 | sing | 0.97Å | 1.00Å | |
| C04 | H10 | sing | 1.09Å | 1.10Å | |
| C04 | H11 | sing | 1.09Å | 1.10Å | |
| C06 | H12 | sing | 1.08Å | 1.08Å | |
| C09 | H13 | sing | 1.09Å | 1.10Å | |
| C09 | H14 | sing | 1.09Å | 1.10Å | |
| C09 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.08Å | 1.08Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C26 | H24 | sing | 1.08Å | 1.08Å | |
| C27 | H25 | sing | 1.08Å | 1.08Å | |
| C28 | H26 | sing | 1.08Å | 1.08Å | |
| C29 | H27 | sing | 1.08Å | 1.08Å | |
| C31 | H28 | sing | 1.08Å | 1.08Å | |
| C32 | H29 | sing | 1.08Å | 1.08Å | |
| N35 | H30 | sing | 0.97Å | 1.00Å | |
| N35 | H31 | sing | 0.97Å | 1.00Å | |
| C37 | H32 | sing | 1.09Å | 1.10Å | |
| C37 | H33 | sing | 1.09Å | 1.10Å | |
| C37 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N01 | C02 | N36 | 121.2° | 120.5° |
| N01 | C02 | C03 | 119.5° | 120.5° |
| C02 | N01 | H8 | 109.5° | 120.1° |
| C02 | N01 | H9 | 109.5° | 120.0° |
| N36 | C02 | C03 | 119.3° | 119.0° |
| C02 | N36 | C34 | 120.8° | 120.6° |
| C02 | C03 | C04 | 117.6° | 120.8° |
| C02 | C03 | C32 | 118.9° | 118.5° |
| N36 | C34 | N35 | 118.9° | 119.2° |
| N36 | C34 | N33 | 121.2° | 121.6° |
| C26 | C27 | C28 | 119.9° | 120.3° |
| C27 | C26 | C25 | 119.9° | 119.7° |
| C27 | C26 | H24 | 120.0° | 120.2° |
| C26 | C27 | H25 | 120.0° | 119.9° |
| C27 | C28 | C29 | 119.9° | 120.4° |
| C28 | C27 | H25 | 120.0° | 119.9° |
| C27 | C28 | H26 | 120.0° | 119.8° |
| C03 | C04 | C05 | 114.1° | 109.5° |
| C04 | C03 | C32 | 123.5° | 120.7° |
| C03 | C04 | H10 | 108.3° | 109.5° |
| C03 | C04 | H11 | 108.3° | 109.4° |
| C04 | C05 | C31 | 120.0° | 119.8° |
| C04 | C05 | C06 | 119.8° | 119.8° |
| C05 | C04 | H10 | 108.3° | 109.5° |
| C05 | C04 | H11 | 108.3° | 109.5° |
| C26 | C25 | C19 | 119.9° | 120.9° |
| C26 | C25 | C24 | 120.4° | 119.7° |
| C25 | C26 | H24 | 120.0° | 120.2° |
| C03 | C32 | N33 | 118.8° | 119.3° |
| C03 | C32 | H29 | 120.6° | 120.4° |
| N35 | C34 | N33 | 119.9° | 119.2° |
| C34 | N35 | H30 | 109.5° | 120.0° |
| C34 | N35 | H31 | 109.4° | 120.0° |
| C34 | N33 | C32 | 120.9° | 121.0° |
| C28 | C29 | C24 | 120.3° | 119.9° |
| C29 | C28 | H26 | 120.1° | 119.9° |
| C28 | C29 | H27 | 119.9° | 120.0° |
| C31 | C05 | C06 | 120.2° | 120.4° |
| C05 | C31 | C13 | 120.0° | 119.9° |
| C05 | C31 | H28 | 120.0° | 120.1° |
| C05 | C06 | C07 | 120.0° | 120.4° |
| C05 | C06 | H12 | 120.0° | 119.8° |
| C31 | C13 | C14 | 119.1° | 120.2° |
| C31 | C13 | C10 | 119.9° | 119.7° |
| C13 | C31 | H28 | 120.0° | 120.0° |
| C19 | C25 | C24 | 119.7° | 119.4° |
| C25 | C19 | N18 | 118.4° | 119.5° |
| C25 | C19 | H6 | 120.8° | 120.2° |
| C25 | C24 | C29 | 119.5° | 120.1° |
| C25 | C24 | C20 | 120.1° | 119.1° |
| C19 | N18 | N17 | 120.4° | 120.0° |
| N18 | C19 | H6 | 120.8° | 120.2° |
| N33 | C32 | H29 | 120.6° | 120.4° |
| C06 | C07 | C10 | 120.0° | 120.0° |
| C06 | C07 | O08 | 119.1° | 120.0° |
| C07 | C06 | H12 | 120.0° | 119.8° |
| C29 | C24 | C20 | 120.4° | 120.9° |
| C24 | C29 | H27 | 119.8° | 120.1° |
| C24 | C20 | N17 | 114.0° | 108.7° |
| C24 | C20 | C21 | 109.4° | 109.5° |
| C24 | C20 | H17 | 109.5° | 109.7° |
| C14 | C13 | C10 | 121.0° | 120.2° |
| C13 | C14 | C15 | 122.0° | 120.0° |
| C13 | C14 | H4 | 119.0° | 120.0° |
| C13 | C10 | C07 | 119.9° | 119.6° |
| C13 | C10 | O11 | 120.0° | 120.2° |
| N18 | N17 | C20 | 120.8° | 119.4° |
| N18 | N17 | C16 | 118.7° | 120.3° |
| C14 | C15 | C16 | 119.4° | 120.0° |
| C15 | C14 | H4 | 119.0° | 120.0° |
| C14 | C15 | H5 | 120.3° | 120.0° |
| C10 | C07 | O08 | 120.9° | 120.0° |
| C07 | C10 | O11 | 120.1° | 120.2° |
| C07 | O08 | C09 | 118.8° | 117.0° |
| O08 | C09 | H13 | 109.5° | 109.5° |
| O08 | C09 | H14 | 109.5° | 109.5° |
| O08 | C09 | H15 | 109.5° | 109.5° |
| C10 | O11 | C12 | 119.9° | 117.0° |
| C20 | N17 | C16 | 120.5° | 120.3° |
| N17 | C20 | C21 | 103.6° | 109.6° |
| N17 | C20 | H17 | 110.4° | 109.6° |
| N17 | C16 | C15 | 119.2° | 120.0° |
| N17 | C16 | O30 | 120.6° | 120.0° |
| C20 | C21 | C22 | 123.8° | 119.9° |
| C21 | C20 | H17 | 109.7° | 109.7° |
| C20 | C21 | H18 | 118.1° | 120.0° |
| O11 | C12 | H1 | 109.5° | 109.4° |
| O11 | C12 | H2 | 109.5° | 109.4° |
| O11 | C12 | H3 | 109.5° | 109.5° |
| C15 | C16 | O30 | 120.2° | 120.0° |
| C16 | C15 | H5 | 120.3° | 120.0° |
| C37 | C22 | C21 | 118.0° | 120.0° |
| C37 | C22 | C23 | 118.3° | 120.0° |
| C22 | C37 | H32 | 109.5° | 109.5° |
| C22 | C37 | H33 | 109.5° | 109.5° |
| C22 | C37 | H34 | 109.5° | 109.5° |
| C21 | C22 | C23 | 121.2° | 120.1° |
| C22 | C21 | H18 | 118.1° | 120.1° |
| C22 | C23 | H21 | 109.5° | 109.5° |
| C22 | C23 | H22 | 109.4° | 109.5° |
| C22 | C23 | H23 | 109.5° | 109.5° |
| H1 | C12 | H2 | 109.4° | 109.4° |
| H1 | C12 | H3 | 109.5° | 109.5° |
| H2 | C12 | H3 | 109.5° | 109.5° |
| H8 | N01 | H9 | 109.5° | 120.0° |
| H10 | C04 | H11 | 109.5° | 109.5° |
| H13 | C09 | H14 | 109.4° | 109.4° |
| H13 | C09 | H15 | 109.5° | 109.5° |
| H14 | C09 | H15 | 109.5° | 109.4° |
| H21 | C23 | H22 | 109.5° | 109.5° |
| H21 | C23 | H23 | 109.5° | 109.5° |
| H22 | C23 | H23 | 109.5° | 109.4° |
| H30 | N35 | H31 | 109.5° | 120.0° |
| H32 | C37 | H33 | 109.5° | 109.4° |
| H32 | C37 | H34 | 109.5° | 109.5° |
| H33 | C37 | H34 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N01 | C02 | N36 | C03 | 179.9° | 179.7° |
| N01 | C02 | N36 | C34 | 179.8° | 179.8° |
| N01 | C02 | C03 | C04 | 0.2° | 0.0° |
| N01 | C02 | C03 | C32 | 179.9° | 180.0° |
| C02 | N01 | H8 | H9 | 120.0° | 180.0° |
| N36 | C02 | C03 | C04 | 179.9° | 179.7° |
| N36 | C02 | C03 | C32 | 0.0° | 0.3° |
| C02 | N36 | C34 | N35 | 179.9° | 179.7° |
| C02 | N36 | C34 | N33 | 0.3° | 0.5° |
| N36 | C02 | N01 | H8 | 0.0° | 0.0° |
| N36 | C02 | N01 | H9 | 120.0° | 180.0° |
| C03 | C02 | N36 | C34 | 0.1° | 0.5° |
| C02 | C03 | C04 | C32 | 180.0° | 180.0° |
| C02 | C03 | C04 | C05 | 165.0° | 85.0° |
| C02 | C03 | C32 | N33 | 0.2° | 0.0° |
| C03 | C02 | N01 | H8 | 179.9° | 179.7° |
| C03 | C02 | N01 | H9 | 59.9° | 0.3° |
| C02 | C03 | C04 | H10 | 44.3° | 155.0° |
| C02 | C03 | C04 | H11 | 74.4° | 35.0° |
| C02 | C03 | C32 | H29 | 179.8° | 179.9° |
| N36 | C34 | N35 | N33 | 179.8° | 179.7° |
| N36 | C34 | N33 | C32 | 0.5° | 0.3° |
| N36 | C34 | N35 | H30 | 0.0° | 179.8° |
| N36 | C34 | N35 | H31 | 120.0° | 0.3° |
| C26 | C27 | C28 | H25 | 180.0° | 179.9° |
| C27 | C26 | C25 | H24 | 180.0° | 179.9° |
| C26 | C27 | C28 | C29 | 0.0° | 0.1° |
| C27 | C26 | C25 | C19 | 180.0° | 179.8° |
| C27 | C26 | C25 | C24 | 0.1° | 0.1° |
| C26 | C27 | C28 | H26 | 180.0° | 180.0° |
| C28 | C27 | C26 | C25 | 0.0° | 0.1° |
| C27 | C28 | C29 | H26 | 180.0° | 179.9° |
| C27 | C28 | C29 | C24 | 0.1° | 0.0° |
| C28 | C27 | C26 | H24 | 180.0° | 180.0° |
| C27 | C28 | C29 | H27 | 179.9° | 179.9° |
| C03 | C04 | C05 | H10 | 120.7° | 120.0° |
| C03 | C04 | C05 | H11 | 120.7° | 119.9° |
| C03 | C04 | C05 | C31 | 63.3° | 90.0° |
| C03 | C04 | C05 | C06 | 117.9° | 89.7° |
| C04 | C03 | C32 | N33 | 179.8° | 180.0° |
| C03 | C04 | H10 | H11 | 117.9° | 119.9° |
| C04 | C03 | C32 | H29 | 0.2° | 0.1° |
| C05 | C04 | C03 | C32 | 15.0° | 95.0° |
| C04 | C05 | C31 | C06 | 178.7° | 179.7° |
| C04 | C05 | C31 | C13 | 179.3° | 180.0° |
| C04 | C05 | C06 | C07 | 179.1° | 180.0° |
| C05 | C04 | H10 | H11 | 117.9° | 120.1° |
| C04 | C05 | C06 | H12 | 0.9° | 0.0° |
| C04 | C05 | C31 | H28 | 0.8° | 0.3° |
| C26 | C25 | C19 | C24 | 179.9° | 180.0° |
| C26 | C25 | C19 | N18 | 161.5° | 164.5° |
| C26 | C25 | C24 | C29 | 0.1° | 0.1° |
| C26 | C25 | C24 | C20 | 179.7° | 179.7° |
| C26 | C25 | C19 | H6 | 18.5° | 15.9° |
| C25 | C26 | C27 | H25 | 180.0° | 180.0° |
| C03 | C32 | N33 | C34 | 0.4° | 0.0° |
| C03 | C32 | N33 | H29 | 180.0° | 179.9° |
| C32 | C03 | C04 | H10 | 135.7° | 25.0° |
| C32 | C03 | C04 | H11 | 105.7° | 145.0° |
| N35 | C34 | N33 | C32 | 179.7° | 180.0° |
| C34 | N35 | H30 | H31 | 120.0° | 180.0° |
| C34 | N33 | C32 | H29 | 179.6° | 180.0° |
| N33 | C34 | N35 | H30 | 179.8° | 0.0° |
| N33 | C34 | N35 | H31 | 59.8° | 180.0° |
| C28 | C29 | C24 | C25 | 0.0° | 0.1° |
| C28 | C29 | C24 | H27 | 180.0° | 180.0° |
| C28 | C29 | C24 | C20 | 179.8° | 179.6° |
| C29 | C28 | C27 | H25 | 180.0° | 179.9° |
| C05 | C31 | C13 | H28 | 180.0° | 179.6° |
| C31 | C05 | C06 | C07 | 0.4° | 0.3° |
| C05 | C31 | C13 | C14 | 179.9° | 180.0° |
| C05 | C31 | C13 | C10 | 0.4° | 0.0° |
| C31 | C05 | C04 | H10 | 57.4° | 30.0° |
| C31 | C05 | C04 | H11 | 176.0° | 150.0° |
| C31 | C05 | C06 | H12 | 179.6° | 179.7° |
| C06 | C05 | C31 | C13 | 0.5° | 0.3° |
| C05 | C06 | C07 | H12 | 180.0° | 180.0° |
| C05 | C06 | C07 | C10 | 0.1° | 0.1° |
| C05 | C06 | C07 | O08 | 179.6° | 180.0° |
| C06 | C05 | C04 | H10 | 121.4° | 150.3° |
| C06 | C05 | C04 | H11 | 2.7° | 30.3° |
| C06 | C05 | C31 | H28 | 179.5° | 180.0° |
| C31 | C13 | C14 | C10 | 179.7° | 180.0° |
| C31 | C13 | C14 | C15 | 137.7° | 0.0° |
| C31 | C13 | C10 | C07 | 0.1° | 0.2° |
| C31 | C13 | C10 | O11 | 179.7° | 180.0° |
| C31 | C13 | C14 | H4 | 42.3° | 179.9° |
| C25 | C19 | N18 | H6 | 180.0° | 179.6° |
| C19 | C25 | C24 | C29 | 180.0° | 179.8° |
| C19 | C25 | C24 | C20 | 0.2° | 0.3° |
| C25 | C19 | N18 | N17 | 15.2° | 0.4° |
| C19 | C25 | C26 | H24 | 0.0° | 0.1° |
| C24 | C25 | C19 | N18 | 18.5° | 15.5° |
| C25 | C24 | C29 | C20 | 179.8° | 179.5° |
| C25 | C24 | C20 | N17 | 20.9° | 26.5° |
| C25 | C24 | C20 | C21 | 94.7° | 93.2° |
| C24 | C25 | C19 | H6 | 161.5° | 164.2° |
| C25 | C24 | C20 | H17 | 145.1° | 146.4° |
| C24 | C25 | C26 | H24 | 180.0° | 180.0° |
| C25 | C24 | C29 | H27 | 180.0° | 179.9° |
| C19 | N18 | N17 | C20 | 7.0° | 32.1° |
| C19 | N18 | N17 | C16 | 173.4° | 147.5° |
| C06 | C07 | C10 | C13 | 0.1° | 0.2° |
| C06 | C07 | C10 | O08 | 179.7° | 180.0° |
| C06 | C07 | O08 | C09 | 28.7° | 0.0° |
| C06 | C07 | C10 | O11 | 179.5° | 180.0° |
| C29 | C24 | C20 | N17 | 159.3° | 153.0° |
| C29 | C24 | C20 | C21 | 85.1° | 87.2° |
| C29 | C24 | C20 | H17 | 35.1° | 33.2° |
| C24 | C29 | C28 | H26 | 180.0° | 180.0° |
| C24 | C20 | N17 | N18 | 24.5° | 43.4° |
| C24 | C20 | N17 | C21 | 118.9° | 119.7° |
| C24 | C20 | N17 | H17 | 123.8° | 119.9° |
| C24 | C20 | N17 | C16 | 155.9° | 136.2° |
| C24 | C20 | C21 | H17 | 120.2° | 120.4° |
| C24 | C20 | C21 | C22 | 32.9° | 127.5° |
| C24 | C20 | C21 | H18 | 147.1° | 52.4° |
| C20 | C24 | C29 | H27 | 0.2° | 0.3° |
| C13 | C14 | C15 | H4 | 180.0° | 180.0° |
| C14 | C13 | C10 | C07 | 179.8° | 179.7° |
| C14 | C13 | C10 | O11 | 0.6° | 0.0° |
| C13 | C14 | C15 | C16 | 177.6° | 180.0° |
| C13 | C14 | C15 | H5 | 2.4° | 0.0° |
| C14 | C13 | C31 | H28 | 0.1° | 0.4° |
| C10 | C13 | C14 | C15 | 42.5° | 180.0° |
| C13 | C10 | C07 | O11 | 179.6° | 179.8° |
| C13 | C10 | C07 | O08 | 179.8° | 179.8° |
| C13 | C10 | O11 | C12 | 101.9° | 90.0° |
| C10 | C13 | C14 | H4 | 137.5° | 0.0° |
| C10 | C13 | C31 | H28 | 179.7° | 179.7° |
| N18 | N17 | C20 | C16 | 179.5° | 179.6° |
| N18 | N17 | C20 | C21 | 94.3° | 76.3° |
| N18 | N17 | C16 | C15 | 0.1° | 0.4° |
| N18 | N17 | C16 | O30 | 179.9° | 179.6° |
| N17 | N18 | C19 | H6 | 164.8° | 179.9° |
| N18 | N17 | C20 | H17 | 148.3° | 163.2° |
| C14 | C15 | C16 | N17 | 49.4° | 180.0° |
| C14 | C15 | C16 | H5 | 180.0° | 180.0° |
| C14 | C15 | C16 | O30 | 130.5° | 0.0° |
| C10 | C07 | O08 | C09 | 151.6° | 179.9° |
| C07 | C10 | O11 | C12 | 78.5° | 90.2° |
| C10 | C07 | C06 | H12 | 179.9° | 180.0° |
| O08 | C07 | C10 | O11 | 0.2° | 0.0° |
| O08 | C07 | C06 | H12 | 0.4° | 0.0° |
| C07 | O08 | C09 | H13 | 180.0° | 60.0° |
| C07 | O08 | C09 | H14 | 60.0° | 180.0° |
| C07 | O08 | C09 | H15 | 60.0° | 60.1° |
| O08 | C09 | H13 | H14 | 120.0° | 120.0° |
| O08 | C09 | H13 | H15 | 120.0° | 120.0° |
| O08 | C09 | H14 | H15 | 120.0° | 120.0° |
| C10 | O11 | C12 | H1 | 180.0° | 180.0° |
| C10 | O11 | C12 | H2 | 60.0° | 60.0° |
| C10 | O11 | C12 | H3 | 60.0° | 60.0° |
| N17 | C20 | C21 | H17 | 117.8° | 120.4° |
| C20 | N17 | C16 | C15 | 179.6° | 180.0° |
| C20 | N17 | C16 | O30 | 0.4° | 0.0° |
| N17 | C20 | C21 | C22 | 154.9° | 113.3° |
| N17 | C20 | C21 | H18 | 25.1° | 66.8° |
| C16 | N17 | C20 | C21 | 85.2° | 104.1° |
| N17 | C16 | C15 | O30 | 180.0° | 180.0° |
| N17 | C16 | C15 | H5 | 130.6° | 0.0° |
| C16 | N17 | C20 | H17 | 32.1° | 16.3° |
| C20 | C21 | C22 | C37 | 100.3° | 172.7° |
| C20 | C21 | C22 | H18 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 98.1° | 7.3° |
| O11 | C12 | H1 | H2 | 120.0° | 119.9° |
| O11 | C12 | H1 | H3 | 120.0° | 120.0° |
| O11 | C12 | H2 | H3 | 120.0° | 120.0° |
| C16 | C15 | C14 | H4 | 2.4° | 0.0° |
| O30 | C16 | C15 | H5 | 49.5° | 180.0° |
| C37 | C22 | C21 | C23 | 161.6° | 180.0° |
| C37 | C22 | C21 | H18 | 79.7° | 7.3° |
| C37 | C22 | C23 | H21 | 180.0° | 174.5° |
| C37 | C22 | C23 | H22 | 60.0° | 54.5° |
| C37 | C22 | C23 | H23 | 60.0° | 65.5° |
| C22 | C37 | H32 | H33 | 120.0° | 120.0° |
| C22 | C37 | H32 | H34 | 120.0° | 120.0° |
| C22 | C37 | H33 | H34 | 120.0° | 120.0° |
| C22 | C21 | C20 | H17 | 87.3° | 7.1° |
| C21 | C22 | C23 | H21 | 18.5° | 5.5° |
| C21 | C22 | C23 | H22 | 101.5° | 125.5° |
| C21 | C22 | C23 | H23 | 138.4° | 114.5° |
| C21 | C22 | C37 | H32 | 180.0° | 90.1° |
| C21 | C22 | C37 | H33 | 60.0° | 150.0° |
| C21 | C22 | C37 | H34 | 60.0° | 30.0° |
| C23 | C22 | C21 | H18 | 81.9° | 172.7° |
| C22 | C23 | H21 | H22 | 120.0° | 120.0° |
| C22 | C23 | H21 | H23 | 120.0° | 120.0° |
| C22 | C23 | H22 | H23 | 120.0° | 120.0° |
| C23 | C22 | C37 | H32 | 17.9° | 90.0° |
| C23 | C22 | C37 | H33 | 102.2° | 30.0° |
| C23 | C22 | C37 | H34 | 137.8° | 150.0° |
| H1 | C12 | H2 | H3 | 120.0° | 120.1° |
| H4 | C14 | C15 | H5 | 177.6° | 180.0° |
| H13 | C09 | H14 | H15 | 120.0° | 120.0° |
| H17 | C20 | C21 | H18 | 92.7° | 172.8° |
| H21 | C23 | H22 | H23 | 120.0° | 120.0° |
| H24 | C26 | C27 | H25 | 0.0° | 0.1° |
| H25 | C27 | C28 | H26 | 0.0° | 0.2° |
| H26 | C28 | C29 | H27 | 0.1° | 0.0° |
| H32 | C37 | H33 | H34 | 120.0° | 120.0° |
