A1BUP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O08 | C07 | sing | 1.43Å | 1.42Å | |
| C07 | C06 | sing | 1.53Å | 1.58Å | |
| C29 | C30 | sing | 1.53Å | 1.54Å | |
| C29 | O27 | sing | 1.43Å | 1.44Å | |
| O05 | C04 | sing | 1.43Å | 1.40Å | |
| C10 | C06 | sing | 1.53Å | 1.54Å | |
| C06 | C04 | sing | 1.53Å | 1.61Å | |
| C06 | C09 | sing | 1.53Å | 1.54Å | |
| O27 | C23 | sing | 1.36Å | 1.41Å | |
| N01 | C11 | sing | 1.47Å | 1.49Å | |
| N01 | C02 | sing | 1.35Å | 1.42Å | |
| C11 | C12 | sing | 1.53Å | 1.58Å | |
| C04 | C02 | sing | 1.51Å | 1.58Å | |
| C22 | C23 | doub | 1.38Å | 1.42Å | Aromatic |
| C22 | C20 | sing | 1.40Å | 1.41Å | Aromatic |
| C02 | O03 | doub | 1.21Å | 1.22Å | |
| O21 | C19 | doub | 1.22Å | 1.21Å | |
| C12 | C13 | sing | 1.51Å | 1.56Å | |
| C23 | C24 | sing | 1.40Å | 1.42Å | Aromatic |
| N14 | C13 | sing | 1.35Å | 1.43Å | |
| N14 | C16 | sing | 1.47Å | 1.49Å | |
| C13 | O15 | doub | 1.21Å | 1.22Å | |
| C16 | C17 | sing | 1.53Å | 1.60Å | |
| C19 | C20 | sing | 1.47Å | 1.53Å | |
| C19 | O18 | sing | 1.35Å | 1.43Å | |
| C20 | C26 | doub | 1.40Å | 1.41Å | Aromatic |
| C24 | N28 | sing | 1.39Å | 1.42Å | |
| C24 | C25 | doub | 1.39Å | 1.42Å | Aromatic |
| C17 | O18 | sing | 1.45Å | 1.46Å | |
| C26 | C25 | sing | 1.38Å | 1.41Å | Aromatic |
| C04 | H1 | sing | 1.09Å | 1.10Å | |
| C07 | H2 | sing | 1.09Å | 1.10Å | |
| C07 | H3 | sing | 1.09Å | 1.10Å | |
| C09 | H4 | sing | 1.09Å | 1.10Å | |
| C09 | H5 | sing | 1.09Å | 1.10Å | |
| C09 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H18 | sing | 1.08Å | 1.08Å | |
| C25 | H19 | sing | 1.08Å | 1.08Å | |
| C26 | H20 | sing | 1.08Å | 1.08Å | |
| C29 | H21 | sing | 1.09Å | 1.10Å | |
| C29 | H22 | sing | 1.09Å | 1.10Å | |
| C30 | H23 | sing | 1.09Å | 1.10Å | |
| C30 | H24 | sing | 1.09Å | 1.10Å | |
| C30 | H25 | sing | 1.09Å | 1.10Å | |
| N01 | H26 | sing | 0.97Å | 1.00Å | |
| N14 | H27 | sing | 0.97Å | 1.00Å | |
| N28 | H28 | sing | 0.97Å | 1.00Å | |
| N28 | H29 | sing | 0.97Å | 1.00Å | |
| O05 | H30 | sing | 0.97Å | 0.95Å | |
| O08 | H31 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O08 | C07 | C06 | 108.5° | 109.5° |
| O08 | C07 | H2 | 109.7° | 109.4° |
| O08 | C07 | H3 | 109.7° | 109.4° |
| C07 | O08 | H31 | 109.5° | 114.1° |
| C07 | C06 | C10 | 109.1° | 109.5° |
| C07 | C06 | C04 | 109.6° | 109.5° |
| C07 | C06 | C09 | 108.6° | 109.5° |
| C06 | C07 | H2 | 109.7° | 109.5° |
| C06 | C07 | H3 | 109.7° | 109.5° |
| C30 | C29 | O27 | 111.7° | 109.5° |
| C30 | C29 | H21 | 108.9° | 109.5° |
| C30 | C29 | H22 | 108.9° | 109.5° |
| C29 | C30 | H23 | 109.5° | 109.5° |
| C29 | C30 | H24 | 109.4° | 109.5° |
| C29 | C30 | H25 | 109.4° | 109.5° |
| C29 | O27 | C23 | 115.5° | 117.0° |
| O27 | C29 | H21 | 108.9° | 109.5° |
| O27 | C29 | H22 | 108.9° | 109.5° |
| O05 | C04 | C06 | 107.9° | 109.4° |
| O05 | C04 | C02 | 106.0° | 109.5° |
| O05 | C04 | H1 | 112.4° | 109.5° |
| C04 | O05 | H30 | 109.5° | 114.0° |
| C10 | C06 | C04 | 111.5° | 109.5° |
| C10 | C06 | C09 | 110.9° | 109.5° |
| C06 | C10 | H7 | 109.5° | 109.5° |
| C06 | C10 | H8 | 109.4° | 109.4° |
| C06 | C10 | H9 | 109.5° | 109.5° |
| C04 | C06 | C09 | 107.0° | 109.4° |
| C06 | C04 | C02 | 111.4° | 109.5° |
| C06 | C04 | H1 | 109.4° | 109.5° |
| C06 | C09 | H4 | 109.5° | 109.5° |
| C06 | C09 | H5 | 109.5° | 109.4° |
| C06 | C09 | H6 | 109.5° | 109.5° |
| O27 | C23 | C22 | 120.0° | 120.0° |
| O27 | C23 | C24 | 119.6° | 120.0° |
| C11 | N01 | C02 | 120.7° | 120.0° |
| N01 | C11 | C12 | 111.4° | 109.5° |
| N01 | C11 | H10 | 109.0° | 109.5° |
| N01 | C11 | H11 | 109.0° | 109.5° |
| C11 | N01 | H26 | 119.7° | 120.0° |
| N01 | C02 | C04 | 119.7° | 120.0° |
| N01 | C02 | O03 | 119.3° | 120.1° |
| C02 | N01 | H26 | 119.7° | 120.0° |
| C11 | C12 | C13 | 112.3° | 109.5° |
| C12 | C11 | H10 | 109.0° | 109.5° |
| C12 | C11 | H11 | 109.0° | 109.4° |
| C11 | C12 | H12 | 108.7° | 109.5° |
| C11 | C12 | H13 | 108.8° | 109.5° |
| C04 | C02 | O03 | 121.0° | 119.9° |
| C02 | C04 | H1 | 109.8° | 109.4° |
| C23 | C22 | C20 | 122.7° | 119.8° |
| C22 | C23 | C24 | 120.4° | 120.0° |
| C23 | C22 | H18 | 118.6° | 120.1° |
| C22 | C20 | C19 | 119.3° | 120.0° |
| C22 | C20 | C26 | 117.3° | 119.9° |
| C20 | C22 | H18 | 118.6° | 120.1° |
| O21 | C19 | C20 | 121.8° | 120.0° |
| O21 | C19 | O18 | 117.8° | 120.0° |
| C12 | C13 | N14 | 120.9° | 120.0° |
| C12 | C13 | O15 | 119.9° | 120.0° |
| C13 | C12 | H12 | 108.8° | 109.5° |
| C13 | C12 | H13 | 108.7° | 109.4° |
| C23 | C24 | N28 | 122.1° | 120.0° |
| C23 | C24 | C25 | 116.7° | 120.1° |
| C13 | N14 | C16 | 121.9° | 120.0° |
| N14 | C13 | O15 | 119.3° | 120.0° |
| C13 | N14 | H27 | 119.0° | 120.0° |
| N14 | C16 | C17 | 113.0° | 109.4° |
| N14 | C16 | H14 | 108.6° | 109.5° |
| N14 | C16 | H15 | 108.6° | 109.5° |
| C16 | N14 | H27 | 119.1° | 120.0° |
| C16 | C17 | O18 | 109.2° | 109.5° |
| C17 | C16 | H14 | 108.6° | 109.5° |
| C17 | C16 | H15 | 108.6° | 109.4° |
| C16 | C17 | H16 | 109.5° | 109.4° |
| C16 | C17 | H17 | 109.5° | 109.4° |
| C20 | C19 | O18 | 120.3° | 120.0° |
| C19 | C20 | C26 | 123.4° | 120.1° |
| C19 | O18 | C17 | 116.3° | 117.0° |
| C20 | C26 | C25 | 120.4° | 120.0° |
| C20 | C26 | H20 | 119.8° | 120.0° |
| N28 | C24 | C25 | 121.1° | 119.9° |
| C24 | N28 | H28 | 109.5° | 120.0° |
| C24 | N28 | H29 | 109.5° | 120.0° |
| C24 | C25 | C26 | 122.5° | 120.1° |
| C24 | C25 | H19 | 118.8° | 120.0° |
| O18 | C17 | H16 | 109.5° | 109.5° |
| O18 | C17 | H17 | 109.6° | 109.5° |
| C26 | C25 | H19 | 118.8° | 119.9° |
| C25 | C26 | H20 | 119.8° | 120.0° |
| H2 | C07 | H3 | 109.5° | 109.5° |
| H4 | C09 | H5 | 109.5° | 109.5° |
| H4 | C09 | H6 | 109.5° | 109.5° |
| H5 | C09 | H6 | 109.5° | 109.5° |
| H7 | C10 | H8 | 109.5° | 109.5° |
| H7 | C10 | H9 | 109.4° | 109.4° |
| H8 | C10 | H9 | 109.5° | 109.5° |
| H10 | C11 | H11 | 109.5° | 109.5° |
| H12 | C12 | H13 | 109.5° | 109.4° |
| H14 | C16 | H15 | 109.5° | 109.5° |
| H16 | C17 | H17 | 109.4° | 109.4° |
| H21 | C29 | H22 | 109.5° | 109.5° |
| H23 | C30 | H24 | 109.5° | 109.4° |
| H23 | C30 | H25 | 109.5° | 109.5° |
| H24 | C30 | H25 | 109.5° | 109.5° |
| H28 | N28 | H29 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O08 | C07 | C06 | H2 | 119.9° | 120.0° |
| O08 | C07 | C06 | H3 | 119.8° | 120.0° |
| O08 | C07 | C06 | C10 | 24.5° | 60.0° |
| O08 | C07 | C06 | C04 | 97.9° | 180.0° |
| O08 | C07 | C06 | C09 | 145.5° | 60.0° |
| O08 | C07 | H2 | H3 | 120.4° | 119.9° |
| C07 | C06 | C04 | O05 | 38.6° | 65.6° |
| C07 | C06 | C10 | C04 | 121.2° | 120.0° |
| C07 | C06 | C10 | C09 | 119.6° | 120.0° |
| C07 | C06 | C04 | C09 | 117.6° | 120.0° |
| C07 | C06 | C04 | C02 | 77.4° | 54.4° |
| C07 | C06 | C04 | H1 | 161.1° | 174.3° |
| C06 | C07 | H2 | H3 | 120.4° | 120.1° |
| C07 | C06 | C09 | H4 | 180.0° | 173.2° |
| C07 | C06 | C09 | H5 | 60.0° | 66.8° |
| C07 | C06 | C09 | H6 | 60.0° | 53.2° |
| C07 | C06 | C10 | H7 | 180.0° | 54.6° |
| C07 | C06 | C10 | H8 | 60.0° | 65.3° |
| C07 | C06 | C10 | H9 | 60.0° | 174.6° |
| C06 | C07 | O08 | H31 | 180.0° | 180.0° |
| C30 | C29 | O27 | H21 | 120.3° | 120.0° |
| C30 | C29 | O27 | H22 | 120.3° | 120.0° |
| C30 | C29 | O27 | C23 | 86.4° | 180.0° |
| C30 | C29 | H21 | H22 | 119.0° | 120.0° |
| C29 | C30 | H23 | H24 | 120.0° | 120.0° |
| C29 | C30 | H23 | H25 | 120.0° | 120.0° |
| C29 | C30 | H24 | H25 | 120.0° | 120.0° |
| C29 | O27 | C23 | C22 | 10.4° | 0.0° |
| C29 | O27 | C23 | C24 | 170.2° | 180.0° |
| O27 | C29 | H21 | H22 | 119.0° | 120.0° |
| O27 | C29 | C30 | H23 | 180.0° | 60.0° |
| O27 | C29 | C30 | H24 | 60.0° | 60.0° |
| O27 | C29 | C30 | H25 | 60.0° | 180.0° |
| O05 | C04 | C06 | C10 | 82.3° | 174.3° |
| O05 | C04 | C06 | C02 | 116.0° | 120.0° |
| O05 | C04 | C06 | H1 | 122.5° | 120.1° |
| O05 | C04 | C06 | C09 | 156.2° | 54.4° |
| O05 | C04 | C02 | N01 | 51.3° | 169.1° |
| O05 | C04 | C02 | H1 | 121.6° | 120.1° |
| O05 | C04 | C02 | O03 | 128.5° | 10.7° |
| C10 | C06 | C04 | C09 | 121.5° | 120.0° |
| C10 | C06 | C04 | C02 | 161.7° | 65.6° |
| C10 | C06 | C04 | H1 | 40.2° | 54.3° |
| C10 | C06 | C07 | H2 | 144.3° | 60.0° |
| C10 | C06 | C07 | H3 | 95.4° | 180.0° |
| C10 | C06 | C09 | H4 | 60.1° | 66.7° |
| C10 | C06 | C09 | H5 | 179.9° | 53.3° |
| C10 | C06 | C09 | H6 | 59.9° | 173.3° |
| C06 | C10 | H7 | H8 | 120.0° | 120.0° |
| C06 | C10 | H7 | H9 | 120.0° | 120.1° |
| C06 | C10 | H8 | H9 | 120.0° | 120.0° |
| C06 | C04 | C02 | N01 | 65.8° | 70.9° |
| C06 | C04 | C02 | H1 | 121.3° | 119.9° |
| C06 | C04 | C02 | O03 | 114.4° | 109.3° |
| C04 | C06 | C07 | H2 | 21.9° | 60.1° |
| C04 | C06 | C07 | H3 | 142.2° | 60.0° |
| C04 | C06 | C09 | H4 | 61.8° | 53.2° |
| C04 | C06 | C09 | H5 | 58.2° | 173.3° |
| C04 | C06 | C09 | H6 | 178.2° | 66.8° |
| C04 | C06 | C10 | H7 | 58.8° | 65.4° |
| C04 | C06 | C10 | H8 | 178.8° | 174.7° |
| C04 | C06 | C10 | H9 | 61.2° | 54.6° |
| C06 | C04 | O05 | H30 | 180.0° | 60.0° |
| C09 | C06 | C04 | C02 | 40.2° | 174.4° |
| C09 | C06 | C04 | H1 | 81.3° | 65.7° |
| C09 | C06 | C07 | H2 | 94.6° | 180.0° |
| C09 | C06 | C07 | H3 | 25.7° | 60.0° |
| C06 | C09 | H4 | H5 | 120.0° | 120.0° |
| C06 | C09 | H4 | H6 | 120.0° | 120.0° |
| C06 | C09 | H5 | H6 | 120.0° | 120.0° |
| C09 | C06 | C10 | H7 | 60.4° | 174.7° |
| C09 | C06 | C10 | H8 | 59.6° | 54.7° |
| C09 | C06 | C10 | H9 | 179.6° | 65.3° |
| O27 | C23 | C22 | C24 | 179.5° | 180.0° |
| O27 | C23 | C22 | C20 | 179.8° | 180.0° |
| O27 | C23 | C24 | N28 | 0.5° | 0.1° |
| O27 | C23 | C24 | C25 | 179.7° | 180.0° |
| O27 | C23 | C22 | H18 | 0.2° | 0.0° |
| C23 | O27 | C29 | H21 | 153.3° | 60.0° |
| C23 | O27 | C29 | H22 | 34.0° | 60.0° |
| C11 | N01 | C02 | H26 | 180.0° | 180.0° |
| N01 | C11 | C12 | H10 | 120.3° | 120.1° |
| N01 | C11 | C12 | H11 | 120.3° | 120.0° |
| C11 | N01 | C02 | C04 | 180.0° | 175.5° |
| C11 | N01 | C02 | O03 | 0.2° | 4.8° |
| N01 | C11 | C12 | C13 | 169.0° | 180.0° |
| N01 | C11 | H10 | H11 | 119.1° | 120.0° |
| N01 | C11 | C12 | H12 | 70.6° | 60.0° |
| N01 | C11 | C12 | H13 | 48.6° | 60.0° |
| C02 | N01 | C11 | C12 | 72.3° | 180.0° |
| N01 | C02 | C04 | O03 | 179.8° | 179.8° |
| N01 | C02 | C04 | H1 | 172.9° | 49.0° |
| C02 | N01 | C11 | H10 | 167.3° | 60.0° |
| C02 | N01 | C11 | H11 | 47.9° | 60.0° |
| C11 | C12 | C13 | H12 | 120.4° | 120.0° |
| C11 | C12 | C13 | H13 | 120.4° | 120.1° |
| C11 | C12 | C13 | N14 | 151.6° | 180.0° |
| C11 | C12 | C13 | O15 | 28.3° | 0.0° |
| C12 | C11 | H10 | H11 | 119.1° | 120.0° |
| C11 | C12 | H12 | H13 | 118.7° | 120.0° |
| C12 | C11 | N01 | H26 | 107.6° | 0.1° |
| C04 | C02 | N01 | H26 | 0.0° | 4.5° |
| C02 | C04 | O05 | H30 | 60.6° | 60.0° |
| C23 | C22 | C20 | H18 | 180.0° | 179.9° |
| C23 | C22 | C20 | C19 | 179.9° | 180.0° |
| C23 | C22 | C20 | C26 | 0.1° | 0.2° |
| C22 | C23 | C24 | N28 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.2° | 0.1° |
| C22 | C20 | C19 | O21 | 6.6° | 0.3° |
| C20 | C22 | C23 | C24 | 0.3° | 0.0° |
| C22 | C20 | C19 | C26 | 179.9° | 179.8° |
| C22 | C20 | C19 | O18 | 173.6° | 179.7° |
| C22 | C20 | C26 | C25 | 0.2° | 0.5° |
| C22 | C20 | C26 | H20 | 179.8° | 179.7° |
| O03 | C02 | C04 | H1 | 6.9° | 130.8° |
| O03 | C02 | N01 | H26 | 179.8° | 175.2° |
| O21 | C19 | C20 | O18 | 179.8° | 180.0° |
| O21 | C19 | C20 | C26 | 173.5° | 180.0° |
| O21 | C19 | O18 | C17 | 3.0° | 0.0° |
| C12 | C13 | N14 | O15 | 179.9° | 180.0° |
| C12 | C13 | N14 | C16 | 179.6° | 180.0° |
| C13 | C12 | C11 | H10 | 48.7° | 60.0° |
| C13 | C12 | C11 | H11 | 70.8° | 60.0° |
| C13 | C12 | H12 | H13 | 118.7° | 119.9° |
| C12 | C13 | N14 | H27 | 0.4° | 0.0° |
| C23 | C24 | N28 | C25 | 179.8° | 179.9° |
| C23 | C24 | C25 | C26 | 0.1° | 0.3° |
| C24 | C23 | C22 | H18 | 179.7° | 180.0° |
| C23 | C24 | C25 | H19 | 179.9° | 180.0° |
| C23 | C24 | N28 | H28 | 180.0° | 0.1° |
| C23 | C24 | N28 | H29 | 60.0° | 180.0° |
| C13 | N14 | C16 | H27 | 180.0° | 180.0° |
| C13 | N14 | C16 | C17 | 116.1° | 180.0° |
| N14 | C13 | C12 | H12 | 88.0° | 59.9° |
| N14 | C13 | C12 | H13 | 31.1° | 60.0° |
| C13 | N14 | C16 | H14 | 123.4° | 60.0° |
| C13 | N14 | C16 | H15 | 4.4° | 60.0° |
| C16 | N14 | C13 | O15 | 0.2° | 0.0° |
| N14 | C16 | C17 | H14 | 120.5° | 120.0° |
| N14 | C16 | C17 | H15 | 120.5° | 119.9° |
| N14 | C16 | C17 | O18 | 169.2° | 65.0° |
| N14 | C16 | H14 | H15 | 118.4° | 120.0° |
| N14 | C16 | C17 | H16 | 49.2° | 175.0° |
| N14 | C16 | C17 | H17 | 70.8° | 55.1° |
| O15 | C13 | C12 | H12 | 92.1° | 120.1° |
| O15 | C13 | C12 | H13 | 148.7° | 120.1° |
| O15 | C13 | N14 | H27 | 179.8° | 180.0° |
| C16 | C17 | O18 | C19 | 70.0° | 180.0° |
| C16 | C17 | O18 | H16 | 120.0° | 120.0° |
| C16 | C17 | O18 | H17 | 120.0° | 120.0° |
| C17 | C16 | H14 | H15 | 118.4° | 120.0° |
| C16 | C17 | H16 | H17 | 120.1° | 119.9° |
| C17 | C16 | N14 | H27 | 64.0° | 0.1° |
| C20 | C19 | O18 | C17 | 177.2° | 180.0° |
| C19 | C20 | C26 | C25 | 179.8° | 179.8° |
| C19 | C20 | C22 | H18 | 0.1° | 0.1° |
| C19 | C20 | C26 | H20 | 0.3° | 0.0° |
| O18 | C19 | C20 | C26 | 6.3° | 0.0° |
| C19 | O18 | C17 | H16 | 170.0° | 60.0° |
| C19 | O18 | C17 | H17 | 49.9° | 59.9° |
| C20 | C26 | C25 | C24 | 0.3° | 0.5° |
| C20 | C26 | C25 | H20 | 180.0° | 179.8° |
| C26 | C20 | C22 | H18 | 179.9° | 179.8° |
| C20 | C26 | C25 | H19 | 179.7° | 179.8° |
| N28 | C24 | C25 | C26 | 179.7° | 179.8° |
| N28 | C24 | C25 | H19 | 0.3° | 0.1° |
| C24 | N28 | H28 | H29 | 120.1° | 180.0° |
| C24 | C25 | C26 | H19 | 180.0° | 179.8° |
| C24 | C25 | C26 | H20 | 179.7° | 179.7° |
| C25 | C24 | N28 | H28 | 0.2° | 179.9° |
| C25 | C24 | N28 | H29 | 119.8° | 0.1° |
| O18 | C17 | C16 | H14 | 70.3° | 175.0° |
| O18 | C17 | C16 | H15 | 48.7° | 55.0° |
| O18 | C17 | H16 | H17 | 120.1° | 120.0° |
| H1 | C04 | O05 | H30 | 59.3° | 180.0° |
| H2 | C07 | O08 | H31 | 60.1° | 60.0° |
| H3 | C07 | O08 | H31 | 60.2° | 60.0° |
| H4 | C09 | H5 | H6 | 120.0° | 120.0° |
| H7 | C10 | H8 | H9 | 120.0° | 120.0° |
| H10 | C11 | C12 | H12 | 169.1° | 60.1° |
| H10 | C11 | C12 | H13 | 71.7° | 180.0° |
| H10 | C11 | N01 | H26 | 12.7° | 120.0° |
| H11 | C11 | C12 | H12 | 49.7° | 179.9° |
| H11 | C11 | C12 | H13 | 168.8° | 60.0° |
| H11 | C11 | N01 | H26 | 132.1° | 120.0° |
| H14 | C16 | C17 | H16 | 169.7° | 55.0° |
| H14 | C16 | C17 | H17 | 49.7° | 64.9° |
| H14 | C16 | N14 | H27 | 56.6° | 120.0° |
| H15 | C16 | C17 | H16 | 71.3° | 65.1° |
| H15 | C16 | C17 | H17 | 168.7° | 175.0° |
| H15 | C16 | N14 | H27 | 175.5° | 120.0° |
| H19 | C25 | C26 | H20 | 0.3° | 0.0° |
| H21 | C29 | C30 | H23 | 59.7° | 60.0° |
| H21 | C29 | C30 | H24 | 60.4° | 179.9° |
| H21 | C29 | C30 | H25 | 179.7° | 60.0° |
| H22 | C29 | C30 | H23 | 59.6° | 180.0° |
| H22 | C29 | C30 | H24 | 179.7° | 60.1° |
| H22 | C29 | C30 | H25 | 60.4° | 60.0° |
| H23 | C30 | H24 | H25 | 120.0° | 120.0° |
