53I
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N01 | C02 | sing | 1.39Å | 1.45Å | |
| C02 | N36 | doub | 1.33Å | 1.37Å | Aromatic |
| C02 | C03 | sing | 1.40Å | 1.39Å | Aromatic |
| N36 | C34 | sing | 1.32Å | 1.36Å | Aromatic |
| C04 | C03 | sing | 1.51Å | 1.52Å | |
| C04 | C05 | sing | 1.51Å | 1.51Å | |
| C03 | C32 | doub | 1.38Å | 1.42Å | Aromatic |
| C34 | N35 | sing | 1.38Å | 1.44Å | |
| C34 | N33 | doub | 1.33Å | 1.34Å | Aromatic |
| C05 | C31 | doub | 1.38Å | 1.38Å | Aromatic |
| C05 | C06 | sing | 1.38Å | 1.40Å | Aromatic |
| C37 | C22 | sing | 1.51Å | 1.53Å | |
| C31 | C13 | sing | 1.40Å | 1.44Å | Aromatic |
| C06 | C07 | doub | 1.39Å | 1.44Å | Aromatic |
| C32 | N33 | sing | 1.33Å | 1.40Å | Aromatic |
| C19 | N18 | doub | 1.30Å | 1.42Å | |
| C19 | C25 | sing | 1.47Å | 1.47Å | |
| N18 | N17 | sing | 1.40Å | 1.36Å | |
| C21 | C22 | doub | 1.31Å | 1.36Å | |
| C21 | C20 | sing | 1.51Å | 1.51Å | |
| C13 | C14 | sing | 1.47Å | 1.50Å | |
| C13 | C10 | doub | 1.40Å | 1.40Å | Aromatic |
| C22 | C23 | sing | 1.51Å | 1.53Å | |
| C09 | O08 | sing | 1.43Å | 1.42Å | |
| C07 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C07 | O08 | sing | 1.36Å | 1.40Å | |
| C14 | C15 | doub | 1.35Å | 1.38Å | |
| C10 | O11 | sing | 1.36Å | 1.42Å | |
| C25 | C26 | doub | 1.39Å | 1.44Å | Aromatic |
| C25 | C24 | sing | 1.40Å | 1.33Å | Aromatic |
| N17 | C20 | sing | 1.47Å | 1.45Å | |
| N17 | C16 | sing | 1.35Å | 1.48Å | |
| C26 | C27 | sing | 1.38Å | 1.42Å | Aromatic |
| C20 | C24 | sing | 1.51Å | 1.51Å | |
| C12 | O11 | sing | 1.43Å | 1.38Å | |
| C15 | C16 | sing | 1.46Å | 1.56Å | |
| C24 | C29 | doub | 1.38Å | 1.47Å | Aromatic |
| C16 | O30 | doub | 1.22Å | 1.25Å | |
| C27 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | H1 | sing | 1.08Å | 1.08Å | |
| C26 | H2 | sing | 1.08Å | 1.08Å | |
| C27 | H3 | sing | 1.08Å | 1.08Å | |
| C28 | H4 | sing | 1.08Å | 1.08Å | |
| C29 | H5 | sing | 1.08Å | 1.08Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.08Å | 1.08Å | |
| C23 | H8 | sing | 1.09Å | 1.10Å | |
| C23 | H9 | sing | 1.09Å | 1.10Å | |
| C23 | H10 | sing | 1.09Å | 1.10Å | |
| C37 | H11 | sing | 1.09Å | 1.10Å | |
| C37 | H12 | sing | 1.09Å | 1.10Å | |
| C37 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.08Å | 1.08Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.09Å | 1.10Å | |
| C09 | H20 | sing | 1.09Å | 1.10Å | |
| C09 | H21 | sing | 1.09Å | 1.10Å | |
| C06 | H22 | sing | 1.08Å | 1.08Å | |
| C04 | H23 | sing | 1.09Å | 1.10Å | |
| C04 | H24 | sing | 1.09Å | 1.10Å | |
| C32 | H25 | sing | 1.08Å | 1.08Å | |
| N35 | H26 | sing | 0.97Å | 1.00Å | |
| N35 | H27 | sing | 0.97Å | 1.00Å | |
| N01 | H28 | sing | 0.97Å | 1.00Å | |
| N01 | H29 | sing | 0.97Å | 1.00Å | |
| C31 | H30 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N01 | C02 | N36 | 121.3° | 120.5° |
| N01 | C02 | C03 | 119.3° | 120.5° |
| C02 | N01 | H28 | 109.5° | 120.0° |
| C02 | N01 | H29 | 109.5° | 120.0° |
| N36 | C02 | C03 | 119.4° | 119.0° |
| C02 | N36 | C34 | 121.5° | 120.6° |
| C02 | C03 | C04 | 115.9° | 120.8° |
| C02 | C03 | C32 | 118.7° | 118.5° |
| N36 | C34 | N35 | 117.5° | 119.2° |
| N36 | C34 | N33 | 120.9° | 121.7° |
| C03 | C04 | C05 | 116.5° | 109.5° |
| C04 | C03 | C32 | 125.4° | 120.7° |
| C03 | C04 | H23 | 107.7° | 109.5° |
| C03 | C04 | H24 | 107.7° | 109.5° |
| C04 | C05 | C31 | 119.3° | 119.8° |
| C04 | C05 | C06 | 120.7° | 119.8° |
| C05 | C04 | H23 | 107.7° | 109.4° |
| C05 | C04 | H24 | 107.7° | 109.5° |
| C03 | C32 | N33 | 119.0° | 119.3° |
| C03 | C32 | H25 | 120.5° | 120.4° |
| N35 | C34 | N33 | 121.6° | 119.1° |
| C34 | N35 | H26 | 109.5° | 120.0° |
| C34 | N35 | H27 | 109.5° | 120.0° |
| C34 | N33 | C32 | 120.4° | 120.9° |
| C31 | C05 | C06 | 119.9° | 120.4° |
| C05 | C31 | C13 | 120.3° | 120.0° |
| C05 | C31 | H30 | 119.8° | 120.0° |
| C05 | C06 | C07 | 119.8° | 120.4° |
| C05 | C06 | H22 | 120.1° | 119.8° |
| C37 | C22 | C21 | 118.9° | 120.0° |
| C37 | C22 | C23 | 118.8° | 120.0° |
| C22 | C37 | H11 | 109.5° | 109.5° |
| C22 | C37 | H12 | 109.5° | 109.4° |
| C22 | C37 | H13 | 109.5° | 109.4° |
| C31 | C13 | C14 | 117.7° | 120.2° |
| C31 | C13 | C10 | 119.8° | 119.6° |
| C13 | C31 | H30 | 119.8° | 120.0° |
| C06 | C07 | C10 | 120.3° | 120.0° |
| C06 | C07 | O08 | 121.1° | 120.0° |
| C07 | C06 | H22 | 120.1° | 119.8° |
| N33 | C32 | H25 | 120.5° | 120.3° |
| N18 | C19 | C25 | 118.2° | 119.6° |
| C19 | N18 | N17 | 117.2° | 119.9° |
| N18 | C19 | H1 | 120.9° | 120.2° |
| C19 | C25 | C26 | 121.7° | 120.8° |
| C19 | C25 | C24 | 119.0° | 119.4° |
| C25 | C19 | H1 | 120.9° | 120.2° |
| N18 | N17 | C20 | 117.9° | 119.4° |
| N18 | N17 | C16 | 123.4° | 120.3° |
| C22 | C21 | C20 | 120.4° | 120.1° |
| C21 | C22 | C23 | 121.5° | 120.0° |
| C22 | C21 | H7 | 119.8° | 120.0° |
| C21 | C20 | N17 | 109.5° | 109.7° |
| C21 | C20 | C24 | 109.5° | 109.4° |
| C21 | C20 | H6 | 108.8° | 109.8° |
| C20 | C21 | H7 | 119.8° | 120.0° |
| C14 | C13 | C10 | 122.4° | 120.2° |
| C13 | C14 | C15 | 122.5° | 120.0° |
| C13 | C14 | H15 | 118.7° | 120.0° |
| C13 | C10 | C07 | 119.8° | 119.6° |
| C13 | C10 | O11 | 121.1° | 120.2° |
| C22 | C23 | H8 | 109.5° | 109.5° |
| C22 | C23 | H9 | 109.5° | 109.5° |
| C22 | C23 | H10 | 109.4° | 109.5° |
| C09 | O08 | C07 | 121.6° | 117.0° |
| O08 | C09 | H19 | 109.5° | 109.5° |
| O08 | C09 | H20 | 109.5° | 109.5° |
| O08 | C09 | H21 | 109.5° | 109.4° |
| C10 | C07 | O08 | 118.6° | 120.0° |
| C07 | C10 | O11 | 119.1° | 120.2° |
| C14 | C15 | C16 | 120.2° | 120.0° |
| C14 | C15 | H14 | 119.9° | 120.1° |
| C15 | C14 | H15 | 118.7° | 120.0° |
| C10 | O11 | C12 | 120.3° | 117.0° |
| C26 | C25 | C24 | 119.3° | 119.8° |
| C25 | C26 | C27 | 120.2° | 119.6° |
| C25 | C26 | H2 | 119.9° | 120.2° |
| C25 | C24 | C20 | 117.8° | 119.1° |
| C25 | C24 | C29 | 120.7° | 120.0° |
| C20 | N17 | C16 | 118.7° | 120.3° |
| N17 | C20 | C24 | 110.5° | 108.5° |
| N17 | C20 | H6 | 109.6° | 109.6° |
| N17 | C16 | C15 | 122.3° | 120.0° |
| N17 | C16 | O30 | 118.7° | 120.0° |
| C26 | C27 | C28 | 120.3° | 120.3° |
| C27 | C26 | H2 | 119.9° | 120.2° |
| C26 | C27 | H3 | 119.9° | 119.9° |
| C20 | C24 | C29 | 121.5° | 120.9° |
| C24 | C20 | H6 | 108.8° | 109.8° |
| O11 | C12 | H16 | 109.5° | 109.5° |
| O11 | C12 | H17 | 109.5° | 109.5° |
| O11 | C12 | H18 | 109.4° | 109.5° |
| C15 | C16 | O30 | 119.0° | 120.0° |
| C16 | C15 | H14 | 119.9° | 119.9° |
| C24 | C29 | C28 | 119.8° | 119.9° |
| C24 | C29 | H5 | 120.1° | 120.0° |
| C27 | C28 | C29 | 119.7° | 120.4° |
| C28 | C27 | H3 | 119.8° | 119.9° |
| C27 | C28 | H4 | 120.2° | 119.8° |
| C29 | C28 | H4 | 120.1° | 119.8° |
| C28 | C29 | H5 | 120.1° | 120.1° |
| H8 | C23 | H9 | 109.5° | 109.5° |
| H8 | C23 | H10 | 109.5° | 109.4° |
| H9 | C23 | H10 | 109.5° | 109.4° |
| H11 | C37 | H12 | 109.5° | 109.5° |
| H11 | C37 | H13 | 109.5° | 109.5° |
| H12 | C37 | H13 | 109.4° | 109.5° |
| H16 | C12 | H17 | 109.5° | 109.4° |
| H16 | C12 | H18 | 109.5° | 109.5° |
| H17 | C12 | H18 | 109.5° | 109.4° |
| H19 | C09 | H20 | 109.5° | 109.5° |
| H19 | C09 | H21 | 109.5° | 109.4° |
| H20 | C09 | H21 | 109.5° | 109.5° |
| H23 | C04 | H24 | 109.5° | 109.5° |
| H26 | N35 | H27 | 109.5° | 120.0° |
| H28 | N01 | H29 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N01 | C02 | N36 | C03 | 179.1° | 179.5° |
| N01 | C02 | N36 | C34 | 179.2° | 180.0° |
| N01 | C02 | C03 | C04 | 1.1° | 0.2° |
| N01 | C02 | C03 | C32 | 179.6° | 179.9° |
| C02 | N01 | H28 | H29 | 120.0° | 180.0° |
| N36 | C02 | C03 | C04 | 179.8° | 179.7° |
| N36 | C02 | C03 | C32 | 1.3° | 0.5° |
| C02 | N36 | C34 | N35 | 179.0° | 179.7° |
| C02 | N36 | C34 | N33 | 1.6° | 0.2° |
| N36 | C02 | N01 | H28 | 0.0° | 0.1° |
| N36 | C02 | N01 | H29 | 120.0° | 180.0° |
| C03 | C02 | N36 | C34 | 1.8° | 0.5° |
| C02 | C03 | C04 | C32 | 178.4° | 179.7° |
| C02 | C03 | C04 | C05 | 169.3° | 84.7° |
| C02 | C03 | C32 | N33 | 0.6° | 0.3° |
| C02 | C03 | C04 | H23 | 48.3° | 35.2° |
| C02 | C03 | C04 | H24 | 69.7° | 155.3° |
| C02 | C03 | C32 | H25 | 179.4° | 179.7° |
| C03 | C02 | N01 | H28 | 179.1° | 179.5° |
| C03 | C02 | N01 | H29 | 60.9° | 0.5° |
| N36 | C34 | N35 | N33 | 179.4° | 179.9° |
| N36 | C34 | N33 | C32 | 0.8° | 0.1° |
| N36 | C34 | N35 | H26 | 0.0° | 180.0° |
| N36 | C34 | N35 | H27 | 120.0° | 0.1° |
| C03 | C04 | C05 | H23 | 121.0° | 120.0° |
| C03 | C04 | C05 | H24 | 121.0° | 120.0° |
| C03 | C04 | C05 | C31 | 55.6° | 90.0° |
| C03 | C04 | C05 | C06 | 126.0° | 90.5° |
| C04 | C03 | C32 | N33 | 179.0° | 180.0° |
| C03 | C04 | H23 | H24 | 116.8° | 120.0° |
| C04 | C03 | C32 | H25 | 1.0° | 0.0° |
| C05 | C04 | C03 | C32 | 12.3° | 95.0° |
| C04 | C05 | C31 | C06 | 178.4° | 179.4° |
| C04 | C05 | C31 | C13 | 179.2° | 180.0° |
| C04 | C05 | C06 | C07 | 179.0° | 179.7° |
| C04 | C05 | C06 | H22 | 1.0° | 0.2° |
| C05 | C04 | H23 | H24 | 116.8° | 120.0° |
| C04 | C05 | C31 | H30 | 0.8° | 0.5° |
| C03 | C32 | N33 | C34 | 0.4° | 0.0° |
| C03 | C32 | N33 | H25 | 180.0° | 180.0° |
| C32 | C03 | C04 | H23 | 133.3° | 145.0° |
| C32 | C03 | C04 | H24 | 108.7° | 25.0° |
| N35 | C34 | N33 | C32 | 179.8° | 180.0° |
| C34 | N35 | H26 | H27 | 120.0° | 179.9° |
| C34 | N33 | C32 | H25 | 179.6° | 180.0° |
| N33 | C34 | N35 | H26 | 179.4° | 0.1° |
| N33 | C34 | N35 | H27 | 59.4° | 180.0° |
| C05 | C31 | C13 | H30 | 180.0° | 179.5° |
| C31 | C05 | C06 | C07 | 0.6° | 0.3° |
| C05 | C31 | C13 | C14 | 179.8° | 179.8° |
| C05 | C31 | C13 | C10 | 0.6° | 0.6° |
| C31 | C05 | C06 | H22 | 179.4° | 179.7° |
| C31 | C05 | C04 | H23 | 65.4° | 150.0° |
| C31 | C05 | C04 | H24 | 176.7° | 30.0° |
| C06 | C05 | C31 | C13 | 0.8° | 0.6° |
| C05 | C06 | C07 | H22 | 180.0° | 179.9° |
| C05 | C06 | C07 | C10 | 0.3° | 0.0° |
| C05 | C06 | C07 | O08 | 179.3° | 180.0° |
| C06 | C05 | C04 | H23 | 113.0° | 29.4° |
| C06 | C05 | C04 | H24 | 4.9° | 149.5° |
| C06 | C05 | C31 | H30 | 179.3° | 180.0° |
| C37 | C22 | C21 | C23 | 169.6° | 180.0° |
| C37 | C22 | C21 | C20 | 178.0° | 174.3° |
| C37 | C22 | C21 | H7 | 2.0° | 5.7° |
| C37 | C22 | C23 | H8 | 180.0° | 94.2° |
| C37 | C22 | C23 | H9 | 60.0° | 25.9° |
| C37 | C22 | C23 | H10 | 60.0° | 145.8° |
| C22 | C37 | H11 | H12 | 120.0° | 120.0° |
| C22 | C37 | H11 | H13 | 120.0° | 119.9° |
| C22 | C37 | H12 | H13 | 120.0° | 119.9° |
| C31 | C13 | C14 | C10 | 179.3° | 179.7° |
| C31 | C13 | C10 | C07 | 0.2° | 0.3° |
| C31 | C13 | C14 | C15 | 179.4° | 0.3° |
| C31 | C13 | C10 | O11 | 179.7° | 179.7° |
| C31 | C13 | C14 | H15 | 0.5° | 179.7° |
| C06 | C07 | C10 | C13 | 0.1° | 0.0° |
| C06 | C07 | O08 | C09 | 18.1° | 0.0° |
| C06 | C07 | C10 | O08 | 179.6° | 180.0° |
| C06 | C07 | C10 | O11 | 179.6° | 180.0° |
| N18 | C19 | C25 | H1 | 180.0° | 179.9° |
| N18 | C19 | C25 | C26 | 155.0° | 164.6° |
| N18 | C19 | C25 | C24 | 24.9° | 15.4° |
| C19 | N18 | N17 | C20 | 26.0° | 32.0° |
| C19 | N18 | N17 | C16 | 153.4° | 148.3° |
| C25 | C19 | N18 | N17 | 11.8° | 0.1° |
| C19 | C25 | C26 | C24 | 180.0° | 179.9° |
| C19 | C25 | C26 | C27 | 179.7° | 179.9° |
| C19 | C25 | C24 | C20 | 0.2° | 0.4° |
| C19 | C25 | C24 | C29 | 179.7° | 179.8° |
| C19 | C25 | C26 | H2 | 0.3° | 0.1° |
| N18 | N17 | C20 | C21 | 71.8° | 75.7° |
| N18 | N17 | C20 | C16 | 179.3° | 179.7° |
| N18 | N17 | C20 | C24 | 48.9° | 43.8° |
| N18 | N17 | C16 | C15 | 0.5° | 0.6° |
| N18 | N17 | C16 | O30 | 179.7° | 179.6° |
| N17 | N18 | C19 | H1 | 168.2° | 179.8° |
| N18 | N17 | C20 | H6 | 168.8° | 163.7° |
| C22 | C21 | C20 | H7 | 180.0° | 180.0° |
| C22 | C21 | C20 | N17 | 118.2° | 114.8° |
| C22 | C21 | C20 | C24 | 120.5° | 126.4° |
| C22 | C21 | C20 | H6 | 1.6° | 5.8° |
| C21 | C22 | C23 | H8 | 10.4° | 85.8° |
| C21 | C22 | C23 | H9 | 130.4° | 154.1° |
| C21 | C22 | C23 | H10 | 109.6° | 34.2° |
| C21 | C22 | C37 | H11 | 180.0° | 0.1° |
| C21 | C22 | C37 | H12 | 60.0° | 120.0° |
| C21 | C22 | C37 | H13 | 60.0° | 120.0° |
| C20 | C21 | C22 | C23 | 8.4° | 5.7° |
| C21 | C20 | C24 | C25 | 85.8° | 92.3° |
| C21 | C20 | N17 | C24 | 120.8° | 119.5° |
| C21 | C20 | N17 | H6 | 119.3° | 120.6° |
| C21 | C20 | N17 | C16 | 108.8° | 104.0° |
| C21 | C20 | C24 | H6 | 118.9° | 120.6° |
| C21 | C20 | C24 | C29 | 94.3° | 87.5° |
| C14 | C13 | C10 | C07 | 179.5° | 180.0° |
| C13 | C14 | C15 | H15 | 180.0° | 180.0° |
| C14 | C13 | C10 | O11 | 1.1° | 0.0° |
| C13 | C14 | C15 | C16 | 174.7° | 180.0° |
| C13 | C14 | C15 | H14 | 5.3° | 0.0° |
| C14 | C13 | C31 | H30 | 0.2° | 0.3° |
| C13 | C10 | C07 | O11 | 179.5° | 180.0° |
| C13 | C10 | C07 | O08 | 179.6° | 180.0° |
| C10 | C13 | C14 | C15 | 1.3° | 180.0° |
| C13 | C10 | O11 | C12 | 116.3° | 90.0° |
| C10 | C13 | C14 | H15 | 178.7° | 0.0° |
| C10 | C13 | C31 | H30 | 179.5° | 180.0° |
| C23 | C22 | C21 | H7 | 171.6° | 174.3° |
| C22 | C23 | H8 | H9 | 120.0° | 120.1° |
| C22 | C23 | H8 | H10 | 120.0° | 120.0° |
| C22 | C23 | H9 | H10 | 120.0° | 120.0° |
| C23 | C22 | C37 | H11 | 10.1° | 180.0° |
| C23 | C22 | C37 | H12 | 130.1° | 60.0° |
| C23 | C22 | C37 | H13 | 109.9° | 60.0° |
| C09 | O08 | C07 | C10 | 162.3° | 180.0° |
| O08 | C09 | H19 | H20 | 120.0° | 120.0° |
| O08 | C09 | H19 | H21 | 120.0° | 119.9° |
| O08 | C09 | H20 | H21 | 120.0° | 119.9° |
| C07 | C10 | O11 | C12 | 64.2° | 90.0° |
| C10 | C07 | C06 | H22 | 179.8° | 180.0° |
| O08 | C07 | C10 | O11 | 0.1° | 0.0° |
| C07 | O08 | C09 | H19 | 180.0° | 60.0° |
| C07 | O08 | C09 | H20 | 60.0° | 60.1° |
| C07 | O08 | C09 | H21 | 60.0° | 180.0° |
| O08 | C07 | C06 | H22 | 0.6° | 0.1° |
| C14 | C15 | C16 | N17 | 0.7° | 179.7° |
| C14 | C15 | C16 | H14 | 180.0° | 180.0° |
| C14 | C15 | C16 | O30 | 179.5° | 0.1° |
| C10 | O11 | C12 | H16 | 180.0° | 60.0° |
| C10 | O11 | C12 | H17 | 60.0° | 60.0° |
| C10 | O11 | C12 | H18 | 60.0° | 180.0° |
| C25 | C26 | C27 | H2 | 180.0° | 180.0° |
| C26 | C25 | C24 | C20 | 179.8° | 179.7° |
| C26 | C25 | C24 | C29 | 0.3° | 0.1° |
| C25 | C26 | C27 | C28 | 0.0° | 0.1° |
| C26 | C25 | C19 | H1 | 25.0° | 15.4° |
| C25 | C26 | C27 | H3 | 180.0° | 180.0° |
| C25 | C24 | C20 | N17 | 35.0° | 27.3° |
| C24 | C25 | C26 | C27 | 0.3° | 0.0° |
| C25 | C24 | C20 | C29 | 179.9° | 179.8° |
| C25 | C24 | C29 | C28 | 0.1° | 0.1° |
| C24 | C25 | C19 | H1 | 155.0° | 164.7° |
| C24 | C25 | C26 | H2 | 179.8° | 180.0° |
| C25 | C24 | C29 | H5 | 179.9° | 179.9° |
| C25 | C24 | C20 | H6 | 155.3° | 147.1° |
| N17 | C20 | C24 | H6 | 120.4° | 119.8° |
| C20 | N17 | C16 | C15 | 179.8° | 179.8° |
| N17 | C20 | C24 | C29 | 144.9° | 152.9° |
| C20 | N17 | C16 | O30 | 0.4° | 0.0° |
| N17 | C20 | C21 | H7 | 61.8° | 65.2° |
| C16 | N17 | C20 | C24 | 130.4° | 136.6° |
| N17 | C16 | C15 | O30 | 179.8° | 179.8° |
| C16 | N17 | C20 | H6 | 10.5° | 16.6° |
| N17 | C16 | C15 | H14 | 179.3° | 0.3° |
| C26 | C27 | C28 | H3 | 180.0° | 179.9° |
| C26 | C27 | C28 | C29 | 0.2° | 0.1° |
| C26 | C27 | C28 | H4 | 179.8° | 180.0° |
| C20 | C24 | C29 | C28 | 180.0° | 179.7° |
| C20 | C24 | C29 | H5 | 0.0° | 0.3° |
| C24 | C20 | C21 | H7 | 59.5° | 53.6° |
| O11 | C12 | H16 | H17 | 120.0° | 120.0° |
| O11 | C12 | H16 | H18 | 120.0° | 120.0° |
| O11 | C12 | H17 | H18 | 120.0° | 120.0° |
| C16 | C15 | C14 | H15 | 5.4° | 0.0° |
| C24 | C29 | C28 | C27 | 0.1° | 0.0° |
| C24 | C29 | C28 | H5 | 180.0° | 180.0° |
| C24 | C29 | C28 | H4 | 179.9° | 180.0° |
| C29 | C24 | C20 | H6 | 24.6° | 33.1° |
| O30 | C16 | C15 | H14 | 0.5° | 179.9° |
| C27 | C28 | C29 | H4 | 180.0° | 179.9° |
| C28 | C27 | C26 | H2 | 180.0° | 179.9° |
| C27 | C28 | C29 | H5 | 179.9° | 180.0° |
| C29 | C28 | C27 | H3 | 179.8° | 180.0° |
| H2 | C26 | C27 | H3 | 0.0° | 0.0° |
| H3 | C27 | C28 | H4 | 0.2° | 0.0° |
| H4 | C28 | C29 | H5 | 0.1° | 0.0° |
| H6 | C20 | C21 | H7 | 178.4° | 174.2° |
| H8 | C23 | H9 | H10 | 120.0° | 119.9° |
| H11 | C37 | H12 | H13 | 120.0° | 120.0° |
| H14 | C15 | C14 | H15 | 174.6° | 180.0° |
| H16 | C12 | H17 | H18 | 120.0° | 120.0° |
| H19 | C09 | H20 | H21 | 120.0° | 120.0° |
