A1D5S
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C06 | C05 | doub | 1.38Å | 1.41Å | Aromatic |
| C06 | C01 | sing | 1.38Å | 1.40Å | Aromatic |
| C05 | C04 | sing | 1.38Å | 1.42Å | Aromatic |
| F32 | C01 | sing | 1.35Å | 1.36Å | |
| C01 | C02 | doub | 1.38Å | 1.39Å | Aromatic |
| C04 | C07 | sing | 1.51Å | 1.60Å | |
| C04 | C03 | doub | 1.38Å | 1.40Å | Aromatic |
| C02 | C03 | sing | 1.38Å | 1.41Å | Aromatic |
| C07 | O08 | sing | 1.43Å | 1.43Å | |
| C07 | C26 | sing | 1.51Å | 1.60Å | |
| C09 | O08 | sing | 1.43Å | 1.42Å | |
| C09 | C10 | sing | 1.53Å | 1.55Å | |
| C31 | C26 | doub | 1.38Å | 1.41Å | Aromatic |
| C31 | C30 | sing | 1.38Å | 1.40Å | Aromatic |
| C10 | N11 | sing | 1.47Å | 1.49Å | |
| C26 | C27 | sing | 1.38Å | 1.40Å | Aromatic |
| C30 | C29 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.40Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | N11 | sing | 1.47Å | 1.49Å | |
| C16 | C15 | sing | 1.53Å | 1.54Å | |
| N11 | C12 | sing | 1.47Å | 1.48Å | |
| C21 | C20 | sing | 1.38Å | 1.41Å | Aromatic |
| C27 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C13 | sing | 1.53Å | 1.51Å | |
| C23 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.37Å | Aromatic |
| C29 | F33 | sing | 1.35Å | 1.35Å | |
| C15 | N14 | sing | 1.47Å | 1.50Å | |
| C20 | C19 | sing | 1.51Å | 1.54Å | |
| C20 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| N14 | C13 | sing | 1.47Å | 1.51Å | |
| N14 | C17 | sing | 1.47Å | 1.56Å | |
| C19 | C18 | sing | 1.53Å | 1.56Å | |
| C24 | C25 | sing | 1.38Å | 1.40Å | Aromatic |
| C17 | C18 | sing | 1.53Å | 1.55Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.09Å | 1.10Å | |
| C15 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.08Å | 1.08Å | |
| C22 | H10 | sing | 1.08Å | 1.08Å | |
| C24 | H11 | sing | 1.08Å | 1.08Å | |
| C28 | H12 | sing | 1.08Å | 1.08Å | |
| C02 | H13 | sing | 1.08Å | 1.08Å | |
| C03 | H14 | sing | 1.08Å | 1.08Å | |
| C05 | H15 | sing | 1.08Å | 1.08Å | |
| C06 | H16 | sing | 1.08Å | 1.08Å | |
| C07 | H17 | sing | 1.09Å | 1.10Å | |
| C09 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| C23 | H30 | sing | 1.08Å | 1.08Å | |
| C25 | H31 | sing | 1.08Å | 1.08Å | |
| C27 | H32 | sing | 1.08Å | 1.08Å | |
| C30 | H33 | sing | 1.08Å | 1.08Å | |
| C31 | H34 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C05 | C06 | C01 | 118.4° | 120.0° |
| C06 | C05 | C04 | 123.5° | 120.0° |
| C06 | C05 | H15 | 118.2° | 120.0° |
| C05 | C06 | H16 | 120.8° | 120.0° |
| C06 | C01 | F32 | 120.1° | 120.0° |
| C06 | C01 | C02 | 120.4° | 119.9° |
| C01 | C06 | H16 | 120.8° | 120.0° |
| C05 | C04 | C07 | 122.8° | 120.0° |
| C05 | C04 | C03 | 114.7° | 120.0° |
| C04 | C05 | H15 | 118.3° | 119.9° |
| F32 | C01 | C02 | 119.5° | 120.0° |
| C01 | C02 | C03 | 119.2° | 120.0° |
| C01 | C02 | H13 | 120.4° | 120.0° |
| C07 | C04 | C03 | 122.4° | 120.0° |
| C04 | C07 | O08 | 109.3° | 109.5° |
| C04 | C07 | C26 | 111.6° | 109.5° |
| C04 | C07 | H17 | 107.8° | 109.5° |
| C04 | C03 | C02 | 123.6° | 120.0° |
| C04 | C03 | H14 | 118.2° | 120.0° |
| C03 | C02 | H13 | 120.4° | 120.0° |
| C02 | C03 | H14 | 118.2° | 120.0° |
| O08 | C07 | C26 | 110.1° | 109.5° |
| C07 | O08 | C09 | 120.5° | 114.0° |
| O08 | C07 | H17 | 110.1° | 109.5° |
| C07 | C26 | C31 | 122.2° | 120.0° |
| C07 | C26 | C27 | 123.7° | 120.0° |
| C26 | C07 | H17 | 107.9° | 109.4° |
| O08 | C09 | C10 | 108.4° | 109.5° |
| O08 | C09 | H18 | 109.7° | 109.4° |
| O08 | C09 | H19 | 109.7° | 109.5° |
| C09 | C10 | N11 | 106.6° | 109.5° |
| C09 | C10 | H1 | 110.2° | 109.5° |
| C09 | C10 | H2 | 110.2° | 109.4° |
| C10 | C09 | H18 | 109.7° | 109.5° |
| C10 | C09 | H19 | 109.7° | 109.5° |
| C26 | C31 | C30 | 123.5° | 120.0° |
| C31 | C26 | C27 | 114.1° | 120.0° |
| C26 | C31 | H34 | 118.2° | 120.0° |
| C31 | C30 | C29 | 119.0° | 120.0° |
| C31 | C30 | H33 | 120.5° | 120.0° |
| C30 | C31 | H34 | 118.3° | 120.0° |
| C10 | N11 | C16 | 108.2° | 111.1° |
| C10 | N11 | C12 | 104.0° | 111.0° |
| N11 | C10 | H1 | 110.2° | 109.5° |
| N11 | C10 | H2 | 110.2° | 109.5° |
| C26 | C27 | C28 | 123.6° | 120.0° |
| C26 | C27 | H32 | 118.2° | 119.9° |
| C30 | C29 | C28 | 120.3° | 120.0° |
| C30 | C29 | F33 | 120.2° | 120.0° |
| C29 | C30 | H33 | 120.5° | 120.0° |
| C21 | C22 | C23 | 119.7° | 120.0° |
| C22 | C21 | C20 | 122.8° | 120.0° |
| C22 | C21 | H9 | 118.6° | 120.1° |
| C21 | C22 | H10 | 120.1° | 120.0° |
| C22 | C23 | C24 | 118.6° | 120.0° |
| C23 | C22 | H10 | 120.1° | 120.0° |
| C22 | C23 | H30 | 120.7° | 120.0° |
| N11 | C16 | C15 | 113.6° | 109.4° |
| C16 | N11 | C12 | 108.7° | 110.9° |
| N11 | C16 | H24 | 108.4° | 109.5° |
| N11 | C16 | H25 | 108.4° | 109.5° |
| C16 | C15 | N14 | 110.9° | 109.4° |
| C16 | C15 | H5 | 109.1° | 109.5° |
| C16 | C15 | H6 | 109.1° | 109.5° |
| C15 | C16 | H24 | 108.4° | 109.5° |
| C15 | C16 | H25 | 108.4° | 109.5° |
| N11 | C12 | C13 | 110.0° | 109.4° |
| N11 | C12 | H21 | 109.3° | 109.5° |
| N11 | C12 | H22 | 109.3° | 109.5° |
| C21 | C20 | C19 | 123.3° | 120.0° |
| C21 | C20 | C25 | 116.0° | 120.0° |
| C20 | C21 | H9 | 118.6° | 120.0° |
| C27 | C28 | C29 | 119.5° | 120.0° |
| C27 | C28 | H12 | 120.3° | 120.0° |
| C28 | C27 | H32 | 118.2° | 120.0° |
| C12 | C13 | N14 | 109.3° | 109.4° |
| C12 | C13 | H3 | 109.5° | 109.5° |
| C12 | C13 | H4 | 109.5° | 109.5° |
| C13 | C12 | H21 | 109.3° | 109.5° |
| C13 | C12 | H22 | 109.4° | 109.5° |
| C23 | C24 | C25 | 121.4° | 120.0° |
| C23 | C24 | H11 | 119.3° | 120.0° |
| C24 | C23 | H30 | 120.7° | 120.0° |
| C28 | C29 | F33 | 119.5° | 120.0° |
| C29 | C28 | H12 | 120.3° | 120.1° |
| C15 | N14 | C13 | 104.6° | 110.9° |
| C15 | N14 | C17 | 113.1° | 111.0° |
| N14 | C15 | H5 | 109.1° | 109.5° |
| N14 | C15 | H6 | 109.1° | 109.5° |
| C19 | C20 | C25 | 120.6° | 120.0° |
| C20 | C19 | C18 | 114.3° | 109.5° |
| C20 | C19 | H28 | 108.3° | 109.5° |
| C20 | C19 | H29 | 108.3° | 109.5° |
| C20 | C25 | C24 | 121.4° | 120.0° |
| C20 | C25 | H31 | 119.3° | 120.0° |
| C13 | N14 | C17 | 108.9° | 111.0° |
| N14 | C13 | H3 | 109.5° | 109.5° |
| N14 | C13 | H4 | 109.5° | 109.5° |
| N14 | C17 | C18 | 112.8° | 109.5° |
| N14 | C17 | H7 | 108.7° | 109.5° |
| N14 | C17 | H8 | 108.6° | 109.5° |
| C19 | C18 | C17 | 116.5° | 109.5° |
| C19 | C18 | H26 | 107.7° | 109.5° |
| C19 | C18 | H27 | 107.7° | 109.5° |
| C18 | C19 | H28 | 108.2° | 109.5° |
| C18 | C19 | H29 | 108.3° | 109.5° |
| C25 | C24 | H11 | 119.3° | 120.0° |
| C24 | C25 | H31 | 119.3° | 120.0° |
| C18 | C17 | H7 | 108.6° | 109.4° |
| C18 | C17 | H8 | 108.7° | 109.5° |
| C17 | C18 | H26 | 107.7° | 109.4° |
| C17 | C18 | H27 | 107.7° | 109.5° |
| H1 | C10 | H2 | 109.5° | 109.4° |
| H3 | C13 | H4 | 109.5° | 109.5° |
| H5 | C15 | H6 | 109.5° | 109.5° |
| H7 | C17 | H8 | 109.5° | 109.4° |
| H18 | C09 | H19 | 109.5° | 109.5° |
| H21 | C12 | H22 | 109.5° | 109.5° |
| H24 | C16 | H25 | 109.5° | 109.5° |
| H26 | C18 | H27 | 109.5° | 109.5° |
| H28 | C19 | H29 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C05 | C06 | C01 | H16 | 180.0° | 180.0° |
| C06 | C05 | C04 | H15 | 180.0° | 179.9° |
| C05 | C06 | C01 | F32 | 179.7° | 179.7° |
| C05 | C06 | C01 | C02 | 0.2° | 0.0° |
| C06 | C05 | C04 | C07 | 179.9° | 180.0° |
| C06 | C05 | C04 | C03 | 0.1° | 0.1° |
| C01 | C06 | C05 | C04 | 0.0° | 0.1° |
| C06 | C01 | F32 | C02 | 180.0° | 179.7° |
| C06 | C01 | C02 | C03 | 0.2° | 0.0° |
| C06 | C01 | C02 | H13 | 179.8° | 180.0° |
| C01 | C06 | C05 | H15 | 180.0° | 180.0° |
| C05 | C04 | C07 | C03 | 179.7° | 179.9° |
| C05 | C04 | C03 | C02 | 0.1° | 0.0° |
| C05 | C04 | C07 | O08 | 62.7° | 35.0° |
| C05 | C04 | C07 | C26 | 175.3° | 85.0° |
| C05 | C04 | C03 | H14 | 179.9° | 179.9° |
| C04 | C05 | C06 | H16 | 180.0° | 180.0° |
| C05 | C04 | C07 | H17 | 57.0° | 155.0° |
| F32 | C01 | C02 | C03 | 179.7° | 179.7° |
| F32 | C01 | C02 | H13 | 0.3° | 0.3° |
| F32 | C01 | C06 | H16 | 0.2° | 0.2° |
| C01 | C02 | C03 | C04 | 0.0° | 0.0° |
| C01 | C02 | C03 | H13 | 180.0° | 180.0° |
| C01 | C02 | C03 | H14 | 179.9° | 180.0° |
| C02 | C01 | C06 | H16 | 179.8° | 180.0° |
| C07 | C04 | C03 | C02 | 179.9° | 180.0° |
| C04 | C07 | O08 | C26 | 122.9° | 120.0° |
| C04 | C07 | O08 | H17 | 118.3° | 120.0° |
| C04 | C07 | C26 | H17 | 118.3° | 120.0° |
| C04 | C07 | O08 | C09 | 152.4° | 150.0° |
| C04 | C07 | C26 | C31 | 79.1° | 80.2° |
| C04 | C07 | C26 | C27 | 100.6° | 99.9° |
| C07 | C04 | C03 | H14 | 0.1° | 0.0° |
| C07 | C04 | C05 | H15 | 0.1° | 0.1° |
| C04 | C03 | C02 | H14 | 180.0° | 180.0° |
| C03 | C04 | C07 | O08 | 117.0° | 145.0° |
| C03 | C04 | C07 | C26 | 5.0° | 95.0° |
| C04 | C03 | C02 | H13 | 180.0° | 180.0° |
| C03 | C04 | C05 | H15 | 179.9° | 180.0° |
| C03 | C04 | C07 | H17 | 123.3° | 25.0° |
| O08 | C07 | C26 | H17 | 120.2° | 120.0° |
| C07 | O08 | C09 | C10 | 175.1° | 180.0° |
| O08 | C07 | C26 | C31 | 159.4° | 39.8° |
| O08 | C07 | C26 | C27 | 20.9° | 140.0° |
| C07 | O08 | C09 | H18 | 55.2° | 60.0° |
| C07 | O08 | C09 | H19 | 65.1° | 59.9° |
| C26 | C07 | O08 | C09 | 84.7° | 89.9° |
| C07 | C26 | C31 | C27 | 179.7° | 179.9° |
| C07 | C26 | C31 | C30 | 179.7° | 179.7° |
| C07 | C26 | C27 | C28 | 179.8° | 179.9° |
| C07 | C26 | C27 | H32 | 0.2° | 0.1° |
| C07 | C26 | C31 | H34 | 0.3° | 0.2° |
| O08 | C09 | C10 | H18 | 119.9° | 120.0° |
| O08 | C09 | C10 | H19 | 119.8° | 120.0° |
| O08 | C09 | C10 | N11 | 109.5° | 64.8° |
| O08 | C09 | C10 | H1 | 10.0° | 175.2° |
| O08 | C09 | C10 | H2 | 130.9° | 55.3° |
| C09 | O08 | C07 | H17 | 34.1° | 30.0° |
| O08 | C09 | H18 | H19 | 120.5° | 120.0° |
| C09 | C10 | N11 | H1 | 119.6° | 120.0° |
| C09 | C10 | N11 | H2 | 119.5° | 120.0° |
| C09 | C10 | N11 | C16 | 67.8° | 160.5° |
| C09 | C10 | N11 | C12 | 176.7° | 75.7° |
| C09 | C10 | H1 | H2 | 121.3° | 119.9° |
| C10 | C09 | H18 | H19 | 120.5° | 120.0° |
| C26 | C31 | C30 | H34 | 180.0° | 179.9° |
| C26 | C31 | C30 | C29 | 0.3° | 0.7° |
| C31 | C26 | C27 | C28 | 0.1° | 0.2° |
| C31 | C26 | C07 | H17 | 39.2° | 159.8° |
| C31 | C26 | C27 | H32 | 179.9° | 179.8° |
| C26 | C31 | C30 | H33 | 179.7° | 179.8° |
| C30 | C31 | C26 | C27 | 0.1° | 0.1° |
| C31 | C30 | C29 | H33 | 180.0° | 179.1° |
| C31 | C30 | C29 | C28 | 0.4° | 0.9° |
| C31 | C30 | C29 | F33 | 179.6° | 179.6° |
| C10 | N11 | C16 | C12 | 112.4° | 123.9° |
| C10 | N11 | C16 | C15 | 163.7° | 176.8° |
| C10 | N11 | C12 | C13 | 172.4° | 176.8° |
| N11 | C10 | H1 | H2 | 121.3° | 120.0° |
| N11 | C10 | C09 | H18 | 130.6° | 175.3° |
| N11 | C10 | C09 | H19 | 10.3° | 55.2° |
| C10 | N11 | C12 | H21 | 67.6° | 63.3° |
| C10 | N11 | C12 | H22 | 52.3° | 56.8° |
| C10 | N11 | C16 | H24 | 43.1° | 56.8° |
| C10 | N11 | C16 | H25 | 75.7° | 63.2° |
| C26 | C27 | C28 | H32 | 180.0° | 180.0° |
| C26 | C27 | C28 | C29 | 0.0° | 0.0° |
| C26 | C27 | C28 | H12 | 180.0° | 180.0° |
| C27 | C26 | C07 | H17 | 141.1° | 20.1° |
| C27 | C26 | C31 | H34 | 179.9° | 180.0° |
| C30 | C29 | C28 | C27 | 0.3° | 0.6° |
| C30 | C29 | C28 | F33 | 180.0° | 179.4° |
| C30 | C29 | C28 | H12 | 179.8° | 179.4° |
| C29 | C30 | C31 | H34 | 179.7° | 179.4° |
| C21 | C22 | C23 | H10 | 180.0° | 180.0° |
| C22 | C21 | C20 | H9 | 180.0° | 180.0° |
| C21 | C22 | C23 | C24 | 0.3° | 0.0° |
| C22 | C21 | C20 | C19 | 180.0° | 180.0° |
| C22 | C21 | C20 | C25 | 0.3° | 0.3° |
| C21 | C22 | C23 | H30 | 179.7° | 180.0° |
| C23 | C22 | C21 | C20 | 0.3° | 0.0° |
| C22 | C23 | C24 | H30 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.3° | 0.3° |
| C23 | C22 | C21 | H9 | 179.7° | 180.0° |
| C22 | C23 | C24 | H11 | 179.6° | 179.8° |
| N11 | C16 | C15 | H24 | 120.6° | 120.0° |
| N11 | C16 | C15 | H25 | 120.6° | 119.9° |
| C16 | N11 | C12 | C13 | 57.3° | 59.2° |
| N11 | C16 | C15 | N14 | 54.7° | 58.3° |
| C16 | N11 | C10 | H1 | 172.6° | 79.5° |
| C16 | N11 | C10 | H2 | 51.7° | 40.4° |
| N11 | C16 | C15 | H5 | 174.9° | 61.6° |
| N11 | C16 | C15 | H6 | 65.6° | 178.4° |
| C16 | N11 | C12 | H21 | 177.3° | 60.7° |
| C16 | N11 | C12 | H22 | 62.8° | 179.2° |
| N11 | C16 | H24 | H25 | 118.1° | 120.0° |
| C15 | C16 | N11 | C12 | 51.4° | 59.2° |
| C16 | C15 | N14 | H5 | 120.2° | 119.9° |
| C16 | C15 | N14 | H6 | 120.2° | 120.0° |
| C16 | C15 | N14 | C13 | 59.1° | 59.3° |
| C16 | C15 | N14 | C17 | 177.5° | 176.8° |
| C16 | C15 | H5 | H6 | 119.3° | 120.1° |
| C15 | C16 | H24 | H25 | 118.1° | 120.1° |
| N11 | C12 | C13 | H21 | 120.1° | 119.9° |
| N11 | C12 | C13 | H22 | 120.1° | 120.0° |
| N11 | C12 | C13 | N14 | 67.7° | 58.4° |
| C12 | N11 | C10 | H1 | 57.2° | 44.3° |
| C12 | N11 | C10 | H2 | 63.7° | 164.3° |
| N11 | C12 | C13 | H3 | 52.3° | 61.6° |
| N11 | C12 | C13 | H4 | 172.3° | 178.3° |
| N11 | C12 | H21 | H22 | 119.7° | 120.1° |
| C12 | N11 | C16 | H24 | 69.3° | 179.2° |
| C12 | N11 | C16 | H25 | 172.0° | 60.7° |
| C21 | C20 | C19 | C25 | 179.7° | 179.7° |
| C21 | C20 | C19 | C18 | 140.2° | 90.3° |
| C21 | C20 | C25 | C24 | 0.4° | 0.6° |
| C20 | C21 | C22 | H10 | 179.7° | 180.0° |
| C21 | C20 | C19 | H28 | 19.5° | 29.7° |
| C21 | C20 | C19 | H29 | 99.1° | 149.7° |
| C21 | C20 | C25 | H31 | 179.6° | 179.7° |
| C27 | C28 | C29 | H12 | 180.0° | 180.0° |
| C27 | C28 | C29 | F33 | 179.7° | 180.0° |
| C12 | C13 | N14 | C15 | 66.4° | 59.3° |
| C12 | C13 | N14 | H3 | 120.0° | 120.0° |
| C12 | C13 | N14 | H4 | 120.0° | 119.9° |
| C12 | C13 | N14 | C17 | 172.4° | 176.8° |
| C12 | C13 | H3 | H4 | 120.1° | 120.0° |
| C13 | C12 | H21 | H22 | 119.8° | 120.1° |
| C23 | C24 | C25 | C20 | 0.4° | 0.6° |
| C23 | C24 | C25 | H11 | 180.0° | 179.5° |
| C24 | C23 | C22 | H10 | 179.7° | 180.0° |
| C23 | C24 | C25 | H31 | 179.6° | 179.7° |
| C29 | C28 | C27 | H32 | 180.0° | 180.0° |
| C28 | C29 | C30 | H33 | 179.6° | 180.0° |
| F33 | C29 | C28 | H12 | 0.3° | 0.0° |
| F33 | C29 | C30 | H33 | 0.4° | 0.6° |
| C15 | N14 | C13 | C17 | 121.2° | 123.9° |
| C15 | N14 | C17 | C18 | 27.3° | 170.0° |
| C15 | N14 | C13 | H3 | 53.6° | 60.7° |
| C15 | N14 | C13 | H4 | 173.6° | 179.3° |
| N14 | C15 | H5 | H6 | 119.3° | 120.0° |
| C15 | N14 | C17 | H7 | 93.1° | 50.0° |
| C15 | N14 | C17 | H8 | 147.9° | 70.0° |
| N14 | C15 | C16 | H24 | 66.0° | 178.3° |
| N14 | C15 | C16 | H25 | 175.2° | 61.6° |
| C20 | C19 | C18 | H28 | 120.7° | 120.1° |
| C20 | C19 | C18 | H29 | 120.7° | 120.0° |
| C19 | C20 | C25 | C24 | 179.9° | 179.7° |
| C20 | C19 | C18 | C17 | 155.7° | 180.0° |
| C19 | C20 | C21 | H9 | 0.0° | 0.0° |
| C20 | C19 | C18 | H26 | 83.3° | 60.0° |
| C20 | C19 | C18 | H27 | 34.7° | 60.0° |
| C20 | C19 | H28 | H29 | 117.8° | 120.0° |
| C19 | C20 | C25 | H31 | 0.0° | 0.0° |
| C25 | C20 | C19 | C18 | 39.4° | 90.0° |
| C20 | C25 | C24 | H31 | 180.0° | 179.8° |
| C25 | C20 | C21 | H9 | 179.6° | 179.8° |
| C20 | C25 | C24 | H11 | 179.6° | 180.0° |
| C25 | C20 | C19 | H28 | 160.1° | 150.0° |
| C25 | C20 | C19 | H29 | 81.3° | 30.1° |
| C13 | N14 | C17 | C18 | 143.2° | 66.2° |
| N14 | C13 | H3 | H4 | 120.1° | 120.0° |
| C13 | N14 | C15 | H5 | 179.4° | 60.6° |
| C13 | N14 | C15 | H6 | 61.1° | 179.4° |
| C13 | N14 | C17 | H7 | 22.7° | 173.8° |
| C13 | N14 | C17 | H8 | 96.3° | 53.8° |
| N14 | C13 | C12 | H21 | 172.2° | 61.5° |
| N14 | C13 | C12 | H22 | 52.4° | 178.4° |
| N14 | C17 | C18 | C19 | 82.6° | 180.0° |
| N14 | C17 | C18 | H7 | 120.5° | 120.0° |
| N14 | C17 | C18 | H8 | 120.5° | 120.1° |
| C17 | N14 | C13 | H3 | 67.6° | 63.2° |
| C17 | N14 | C13 | H4 | 52.4° | 56.9° |
| C17 | N14 | C15 | H5 | 62.3° | 63.2° |
| C17 | N14 | C15 | H6 | 57.3° | 56.8° |
| N14 | C17 | H7 | H8 | 118.5° | 120.0° |
| N14 | C17 | C18 | H26 | 156.4° | 60.0° |
| N14 | C17 | C18 | H27 | 38.4° | 60.0° |
| C19 | C18 | C17 | H26 | 121.0° | 120.0° |
| C19 | C18 | C17 | H27 | 121.0° | 120.0° |
| C19 | C18 | C17 | H7 | 156.9° | 60.0° |
| C19 | C18 | C17 | H8 | 37.9° | 59.9° |
| C19 | C18 | H26 | H27 | 116.8° | 120.0° |
| C18 | C19 | H28 | H29 | 117.8° | 120.0° |
| C25 | C24 | C23 | H30 | 179.7° | 179.7° |
| C18 | C17 | H7 | H8 | 118.5° | 120.0° |
| C17 | C18 | H26 | H27 | 116.8° | 120.0° |
| C17 | C18 | C19 | H28 | 35.0° | 59.9° |
| C17 | C18 | C19 | H29 | 83.6° | 60.0° |
| H1 | C10 | C09 | H18 | 109.8° | 55.3° |
| H1 | C10 | C09 | H19 | 129.9° | 64.8° |
| H2 | C10 | C09 | H18 | 11.1° | 64.7° |
| H2 | C10 | C09 | H19 | 109.3° | 175.3° |
| H3 | C13 | C12 | H21 | 67.8° | 178.5° |
| H3 | C13 | C12 | H22 | 172.3° | 58.4° |
| H4 | C13 | C12 | H21 | 52.3° | 58.4° |
| H4 | C13 | C12 | H22 | 67.6° | 61.7° |
| H5 | C15 | C16 | H24 | 54.2° | 58.4° |
| H5 | C15 | C16 | H25 | 64.5° | 178.5° |
| H6 | C15 | C16 | H24 | 173.8° | 61.6° |
| H6 | C15 | C16 | H25 | 55.0° | 58.4° |
| H7 | C17 | C18 | H26 | 35.9° | 180.0° |
| H7 | C17 | C18 | H27 | 82.1° | 60.0° |
| H8 | C17 | C18 | H26 | 83.1° | 60.0° |
| H8 | C17 | C18 | H27 | 158.9° | 180.0° |
| H9 | C21 | C22 | H10 | 0.3° | 0.0° |
| H10 | C22 | C23 | H30 | 0.3° | 0.0° |
| H11 | C24 | C23 | H30 | 0.3° | 0.2° |
| H11 | C24 | C25 | H31 | 0.4° | 0.2° |
| H12 | C28 | C27 | H32 | 0.0° | 0.0° |
| H13 | C02 | C03 | H14 | 0.1° | 0.0° |
| H15 | C05 | C06 | H16 | 0.0° | 0.1° |
| H26 | C18 | C19 | H28 | 156.0° | 60.0° |
| H26 | C18 | C19 | H29 | 37.4° | 180.0° |
| H27 | C18 | C19 | H28 | 86.0° | 180.0° |
| H27 | C18 | C19 | H29 | 155.4° | 60.0° |
| H33 | C30 | C31 | H34 | 0.3° | 0.3° |
