UDQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | N20 | sing | 1.47Å | 1.35Å | |
| C19 | C18 | sing | 1.51Å | 1.55Å | |
| C25 | N20 | sing | 1.47Å | 1.30Å | |
| C25 | C24 | sing | 1.53Å | 1.54Å | |
| C26 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.43Å | Aromatic |
| N20 | C21 | sing | 1.47Å | 1.31Å | |
| C21 | C22 | sing | 1.53Å | 1.55Å | |
| C18 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C24 | C23 | sing | 1.53Å | 1.52Å | |
| C27 | C15 | doub | 1.40Å | 1.41Å | Aromatic |
| C01 | N02 | sing | 1.47Å | 1.49Å | |
| C23 | C22 | sing | 1.53Å | 1.56Å | |
| C17 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| N02 | C03 | sing | 1.39Å | 1.48Å | |
| C15 | C16 | sing | 1.39Å | 1.38Å | Aromatic |
| C15 | C14 | sing | 1.48Å | 1.55Å | |
| C07 | C08 | sing | 1.53Å | 1.51Å | |
| C07 | N06 | sing | 1.47Å | 1.49Å | |
| C08 | C09 | sing | 1.53Å | 1.54Å | |
| C04 | C03 | doub | 1.39Å | 1.36Å | Aromatic |
| C04 | C05 | sing | 1.39Å | 1.36Å | Aromatic |
| C03 | N32 | sing | 1.33Å | 1.34Å | Aromatic |
| C14 | O28 | doub | 1.22Å | 1.22Å | |
| C14 | N13 | sing | 1.35Å | 1.49Å | |
| C09 | C11 | sing | 1.53Å | 1.54Å | |
| N06 | C05 | sing | 1.39Å | 1.47Å | |
| N06 | C10 | sing | 1.47Å | 1.45Å | |
| C05 | N30 | doub | 1.33Å | 1.35Å | Aromatic |
| N13 | C12 | sing | 1.47Å | 1.47Å | |
| C10 | C11 | sing | 1.53Å | 1.55Å | |
| N32 | C31 | doub | 1.32Å | 1.36Å | Aromatic |
| C11 | C12 | sing | 1.53Å | 1.57Å | |
| C11 | O29 | sing | 1.43Å | 1.38Å | |
| N30 | C31 | sing | 1.32Å | 1.37Å | Aromatic |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.08Å | 1.08Å | |
| C21 | H4 | sing | 1.09Å | 1.10Å | |
| C21 | H5 | sing | 1.09Å | 1.10Å | |
| C22 | H6 | sing | 1.09Å | 1.10Å | |
| C22 | H7 | sing | 1.09Å | 1.10Å | |
| C24 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C26 | H10 | sing | 1.08Å | 1.08Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C01 | H12 | sing | 1.09Å | 1.10Å | |
| C01 | H13 | sing | 1.09Å | 1.10Å | |
| C04 | H14 | sing | 1.08Å | 1.08Å | |
| C07 | H15 | sing | 1.09Å | 1.10Å | |
| C07 | H16 | sing | 1.09Å | 1.10Å | |
| C08 | H17 | sing | 1.09Å | 1.10Å | |
| C08 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.09Å | 1.10Å | |
| C09 | H20 | sing | 1.09Å | 1.10Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.08Å | 1.08Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H28 | sing | 1.09Å | 1.10Å | |
| C25 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| N02 | H32 | sing | 0.97Å | 1.00Å | |
| N13 | H33 | sing | 0.97Å | 1.00Å | |
| O29 | H35 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N20 | C19 | C18 | 109.3° | 109.5° |
| C19 | N20 | C25 | 112.3° | 111.0° |
| C19 | N20 | C21 | 112.8° | 111.0° |
| N20 | C19 | H24 | 109.5° | 109.5° |
| N20 | C19 | H25 | 109.5° | 109.5° |
| C19 | C18 | C26 | 122.9° | 119.8° |
| C19 | C18 | C17 | 117.9° | 119.9° |
| C18 | C19 | H24 | 109.5° | 109.4° |
| C18 | C19 | H25 | 109.5° | 109.5° |
| N20 | C25 | C24 | 109.2° | 109.5° |
| C25 | N20 | C21 | 107.5° | 111.2° |
| N20 | C25 | H28 | 109.6° | 109.5° |
| N20 | C25 | H29 | 109.5° | 109.5° |
| C25 | C24 | C23 | 111.8° | 109.3° |
| C25 | C24 | H8 | 108.9° | 109.5° |
| C25 | C24 | H9 | 108.9° | 109.6° |
| C24 | C25 | H28 | 109.5° | 109.5° |
| C24 | C25 | H29 | 109.6° | 109.5° |
| C18 | C26 | C27 | 119.6° | 120.2° |
| C26 | C18 | C17 | 119.2° | 120.3° |
| C18 | C26 | H10 | 120.2° | 119.9° |
| C26 | C27 | C15 | 119.3° | 119.8° |
| C27 | C26 | H10 | 120.2° | 119.9° |
| C26 | C27 | H30 | 120.3° | 120.1° |
| N20 | C21 | C22 | 107.5° | 109.5° |
| N20 | C21 | H4 | 110.0° | 109.4° |
| N20 | C21 | H5 | 109.9° | 109.5° |
| C21 | C22 | C23 | 107.8° | 109.3° |
| C22 | C21 | H4 | 110.0° | 109.5° |
| C22 | C21 | H5 | 110.0° | 109.5° |
| C21 | C22 | H6 | 109.9° | 109.5° |
| C21 | C22 | H7 | 109.9° | 109.5° |
| C18 | C17 | C16 | 121.8° | 120.1° |
| C18 | C17 | H3 | 119.1° | 119.9° |
| C24 | C23 | C22 | 110.8° | 109.1° |
| C23 | C24 | H8 | 108.9° | 109.5° |
| C23 | C24 | H9 | 108.9° | 109.5° |
| C24 | C23 | H26 | 109.1° | 109.6° |
| C24 | C23 | H27 | 109.1° | 109.5° |
| C27 | C15 | C16 | 120.9° | 119.7° |
| C27 | C15 | C14 | 127.0° | 120.1° |
| C15 | C27 | H30 | 120.3° | 120.1° |
| C01 | N02 | C03 | 119.4° | 120.0° |
| N02 | C01 | H11 | 109.5° | 109.5° |
| N02 | C01 | H12 | 109.5° | 109.5° |
| N02 | C01 | H13 | 109.5° | 109.5° |
| C01 | N02 | H32 | 107.0° | 120.0° |
| C23 | C22 | H6 | 109.9° | 109.5° |
| C23 | C22 | H7 | 109.9° | 109.5° |
| C22 | C23 | H26 | 109.2° | 109.5° |
| C22 | C23 | H27 | 109.1° | 109.5° |
| C17 | C16 | C15 | 119.0° | 119.9° |
| C16 | C17 | H3 | 119.1° | 120.0° |
| C17 | C16 | H23 | 120.5° | 120.0° |
| N02 | C03 | C04 | 117.8° | 120.5° |
| N02 | C03 | N32 | 122.0° | 120.5° |
| C03 | N02 | H32 | 107.0° | 120.0° |
| C16 | C15 | C14 | 112.1° | 120.2° |
| C15 | C16 | H23 | 120.5° | 120.1° |
| C15 | C14 | O28 | 118.0° | 120.0° |
| C15 | C14 | N13 | 122.4° | 120.0° |
| C08 | C07 | N06 | 109.5° | 109.5° |
| C07 | C08 | C09 | 108.9° | 109.2° |
| C08 | C07 | H15 | 109.4° | 109.5° |
| C08 | C07 | H16 | 109.4° | 109.4° |
| C07 | C08 | H17 | 109.6° | 109.5° |
| C07 | C08 | H18 | 109.6° | 109.5° |
| C07 | N06 | C05 | 120.5° | 111.0° |
| C07 | N06 | C10 | 119.3° | 111.2° |
| N06 | C07 | H15 | 109.5° | 109.4° |
| N06 | C07 | H16 | 109.5° | 109.5° |
| C08 | C09 | C11 | 111.7° | 109.2° |
| C09 | C08 | H17 | 109.7° | 109.5° |
| C09 | C08 | H18 | 109.7° | 109.5° |
| C08 | C09 | H19 | 108.9° | 109.5° |
| C08 | C09 | H20 | 108.9° | 109.6° |
| C03 | C04 | C05 | 120.1° | 118.2° |
| C04 | C03 | N32 | 120.3° | 119.1° |
| C03 | C04 | H14 | 119.9° | 120.9° |
| C04 | C05 | N06 | 118.0° | 120.4° |
| C04 | C05 | N30 | 119.9° | 119.0° |
| C05 | C04 | H14 | 120.0° | 120.9° |
| C03 | N32 | C31 | 119.9° | 120.9° |
| O28 | C14 | N13 | 119.5° | 120.0° |
| C14 | N13 | C12 | 115.5° | 120.0° |
| C14 | N13 | H33 | 122.3° | 120.0° |
| C09 | C11 | C10 | 113.5° | 109.3° |
| C09 | C11 | C12 | 109.3° | 109.6° |
| C09 | C11 | O29 | 109.3° | 109.5° |
| C11 | C09 | H19 | 108.9° | 109.5° |
| C11 | C09 | H20 | 108.9° | 109.5° |
| C05 | N06 | C10 | 120.2° | 111.0° |
| N06 | C05 | N30 | 122.1° | 120.5° |
| N06 | C10 | C11 | 111.9° | 109.5° |
| N06 | C10 | H1 | 108.9° | 109.4° |
| N06 | C10 | H2 | 108.9° | 109.4° |
| C05 | N30 | C31 | 119.9° | 120.9° |
| N13 | C12 | C11 | 111.6° | 109.4° |
| N13 | C12 | H21 | 108.9° | 109.5° |
| N13 | C12 | H22 | 108.9° | 109.5° |
| C12 | N13 | H33 | 122.2° | 120.0° |
| C10 | C11 | C12 | 106.5° | 109.5° |
| C10 | C11 | O29 | 110.6° | 109.5° |
| C11 | C10 | H1 | 108.9° | 109.5° |
| C11 | C10 | H2 | 108.9° | 109.5° |
| N32 | C31 | N30 | 119.9° | 121.9° |
| N32 | C31 | H31 | 120.0° | 119.1° |
| C12 | C11 | O29 | 107.4° | 109.6° |
| C11 | C12 | H21 | 109.0° | 109.5° |
| C11 | C12 | H22 | 108.9° | 109.5° |
| C11 | O29 | H35 | 109.5° | 114.0° |
| N30 | C31 | H31 | 120.0° | 119.1° |
| H1 | C10 | H2 | 109.4° | 109.4° |
| H4 | C21 | H5 | 109.5° | 109.5° |
| H6 | C22 | H7 | 109.5° | 109.5° |
| H8 | C24 | H9 | 109.5° | 109.5° |
| H11 | C01 | H12 | 109.5° | 109.5° |
| H11 | C01 | H13 | 109.4° | 109.5° |
| H12 | C01 | H13 | 109.5° | 109.5° |
| H15 | C07 | H16 | 109.5° | 109.4° |
| H17 | C08 | H18 | 109.4° | 109.6° |
| H19 | C09 | H20 | 109.5° | 109.6° |
| H21 | C12 | H22 | 109.5° | 109.5° |
| H24 | C19 | H25 | 109.5° | 109.5° |
| H26 | C23 | H27 | 109.5° | 109.6° |
| H28 | C25 | H29 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N20 | C19 | C18 | H24 | 120.0° | 120.0° |
| N20 | C19 | C18 | H25 | 120.0° | 120.1° |
| C19 | N20 | C25 | C21 | 124.5° | 124.1° |
| C19 | N20 | C25 | C24 | 160.2° | 174.1° |
| N20 | C19 | C18 | C26 | 143.2° | 90.0° |
| C19 | N20 | C21 | C22 | 154.8° | 174.2° |
| N20 | C19 | C18 | C17 | 36.8° | 90.7° |
| C19 | N20 | C21 | H4 | 35.2° | 65.8° |
| C19 | N20 | C21 | H5 | 85.5° | 54.1° |
| N20 | C19 | H24 | H25 | 120.1° | 120.0° |
| C19 | N20 | C25 | H28 | 79.8° | 54.0° |
| C19 | N20 | C25 | H29 | 40.3° | 65.8° |
| C18 | C19 | N20 | C25 | 140.6° | 170.0° |
| C19 | C18 | C26 | C17 | 180.0° | 179.2° |
| C19 | C18 | C26 | C27 | 180.0° | 180.0° |
| C18 | C19 | N20 | C21 | 97.9° | 65.7° |
| C19 | C18 | C17 | C16 | 180.0° | 179.8° |
| C19 | C18 | C17 | H3 | 0.1° | 0.2° |
| C19 | C18 | C26 | H10 | 0.0° | 0.8° |
| C18 | C19 | H24 | H25 | 120.1° | 120.0° |
| N20 | C25 | C24 | H28 | 120.0° | 120.1° |
| N20 | C25 | C24 | H29 | 120.0° | 120.0° |
| C25 | N20 | C21 | C22 | 80.9° | 61.7° |
| N20 | C25 | C24 | C23 | 52.2° | 59.2° |
| C25 | N20 | C21 | H4 | 159.4° | 58.3° |
| C25 | N20 | C21 | H5 | 38.8° | 178.2° |
| N20 | C25 | C24 | H8 | 172.5° | 60.8° |
| N20 | C25 | C24 | H9 | 68.1° | 179.1° |
| C25 | N20 | C19 | H24 | 20.6° | 70.0° |
| C25 | N20 | C19 | H25 | 99.5° | 50.0° |
| N20 | C25 | H28 | H29 | 120.1° | 119.9° |
| C24 | C25 | N20 | C21 | 75.2° | 61.8° |
| C25 | C24 | C23 | H8 | 120.4° | 119.9° |
| C25 | C24 | C23 | H9 | 120.3° | 120.0° |
| C25 | C24 | C23 | C22 | 36.6° | 57.7° |
| C25 | C24 | H8 | H9 | 118.9° | 120.2° |
| C25 | C24 | C23 | H26 | 83.6° | 177.5° |
| C25 | C24 | C23 | H27 | 156.8° | 62.2° |
| C24 | C25 | H28 | H29 | 120.1° | 120.0° |
| C18 | C26 | C27 | H10 | 180.0° | 179.2° |
| C18 | C26 | C27 | C15 | 0.2° | 0.5° |
| C26 | C18 | C17 | C16 | 0.1° | 0.5° |
| C26 | C18 | C17 | H3 | 179.9° | 179.5° |
| C26 | C18 | C19 | H24 | 23.3° | 150.0° |
| C26 | C18 | C19 | H25 | 96.8° | 30.0° |
| C18 | C26 | C27 | H30 | 179.8° | 179.5° |
| C27 | C26 | C18 | C17 | 0.0° | 0.8° |
| C26 | C27 | C15 | H30 | 180.0° | 180.0° |
| C26 | C27 | C15 | C16 | 0.5° | 0.0° |
| C26 | C27 | C15 | C14 | 179.8° | 179.7° |
| N20 | C21 | C22 | H4 | 119.7° | 120.0° |
| N20 | C21 | C22 | H5 | 119.7° | 120.0° |
| N20 | C21 | C22 | C23 | 60.9° | 59.2° |
| N20 | C21 | H4 | H5 | 120.9° | 120.0° |
| N20 | C21 | C22 | H6 | 58.8° | 60.8° |
| N20 | C21 | C22 | H7 | 179.3° | 179.1° |
| C21 | N20 | C19 | H24 | 142.2° | 54.2° |
| C21 | N20 | C19 | H25 | 22.1° | 174.2° |
| C21 | N20 | C25 | H28 | 44.7° | 178.2° |
| C21 | N20 | C25 | H29 | 164.8° | 58.3° |
| C21 | C22 | C23 | C24 | 40.1° | 57.7° |
| C21 | C22 | C23 | H6 | 119.7° | 119.9° |
| C21 | C22 | C23 | H7 | 119.8° | 120.0° |
| C22 | C21 | H4 | H5 | 120.9° | 120.0° |
| C21 | C22 | H6 | H7 | 120.8° | 120.1° |
| C21 | C22 | C23 | H26 | 80.1° | 177.6° |
| C21 | C22 | C23 | H27 | 160.3° | 62.2° |
| C18 | C17 | C16 | H3 | 180.0° | 180.0° |
| C18 | C17 | C16 | C15 | 0.3° | 0.0° |
| C17 | C18 | C26 | H10 | 180.0° | 180.0° |
| C18 | C17 | C16 | H23 | 179.7° | 180.0° |
| C17 | C18 | C19 | H24 | 156.8° | 29.3° |
| C17 | C18 | C19 | H25 | 83.2° | 149.2° |
| C24 | C23 | C22 | H26 | 120.2° | 119.9° |
| C24 | C23 | C22 | H27 | 120.2° | 119.9° |
| C24 | C23 | C22 | H6 | 79.6° | 62.3° |
| C24 | C23 | C22 | H7 | 159.9° | 177.6° |
| C23 | C24 | H8 | H9 | 119.0° | 120.0° |
| C24 | C23 | H26 | H27 | 119.4° | 120.2° |
| C23 | C24 | C25 | H28 | 67.8° | 179.2° |
| C23 | C24 | C25 | H29 | 172.1° | 60.8° |
| C27 | C15 | C16 | C17 | 0.5° | 0.3° |
| C27 | C15 | C16 | C14 | 179.4° | 179.7° |
| C27 | C15 | C14 | O28 | 128.5° | 179.7° |
| C27 | C15 | C14 | N13 | 54.6° | 0.4° |
| C15 | C27 | C26 | H10 | 179.8° | 179.7° |
| C27 | C15 | C16 | H23 | 179.5° | 179.7° |
| C01 | N02 | C03 | H32 | 121.4° | 179.9° |
| C01 | N02 | C03 | C04 | 32.4° | 0.2° |
| C01 | N02 | C03 | N32 | 147.7° | 180.0° |
| N02 | C01 | H11 | H12 | 120.0° | 120.0° |
| N02 | C01 | H11 | H13 | 120.0° | 120.0° |
| N02 | C01 | H12 | H13 | 120.0° | 120.0° |
| C23 | C22 | C21 | H4 | 179.4° | 60.8° |
| C23 | C22 | C21 | H5 | 58.8° | 179.2° |
| C23 | C22 | H6 | H7 | 120.7° | 120.1° |
| C22 | C23 | C24 | H8 | 156.9° | 62.3° |
| C22 | C23 | C24 | H9 | 83.7° | 177.6° |
| C22 | C23 | H26 | H27 | 119.4° | 120.1° |
| C17 | C16 | C15 | H23 | 180.0° | 180.0° |
| C17 | C16 | C15 | C14 | 179.9° | 179.9° |
| N02 | C03 | C04 | N32 | 179.9° | 179.8° |
| N02 | C03 | C04 | C05 | 179.8° | 179.8° |
| N02 | C03 | N32 | C31 | 179.4° | 179.8° |
| C03 | N02 | C01 | H11 | 180.0° | 180.0° |
| C03 | N02 | C01 | H12 | 60.0° | 60.0° |
| C03 | N02 | C01 | H13 | 60.0° | 60.0° |
| N02 | C03 | C04 | H14 | 0.2° | 0.2° |
| C16 | C15 | C14 | O28 | 52.2° | 0.1° |
| C16 | C15 | C14 | N13 | 124.7° | 180.0° |
| C15 | C16 | C17 | H3 | 179.7° | 180.0° |
| C16 | C15 | C27 | H30 | 179.5° | 180.0° |
| C15 | C14 | O28 | N13 | 176.9° | 179.9° |
| C15 | C14 | N13 | C12 | 177.4° | 180.0° |
| C14 | C15 | C16 | H23 | 0.1° | 0.0° |
| C14 | C15 | C27 | H30 | 0.2° | 0.4° |
| C15 | C14 | N13 | H33 | 2.6° | 0.0° |
| C08 | C07 | N06 | H15 | 120.0° | 120.1° |
| C08 | C07 | N06 | H16 | 120.0° | 120.0° |
| C07 | C08 | C09 | H17 | 119.9° | 120.0° |
| C07 | C08 | C09 | H18 | 119.9° | 119.9° |
| C07 | C08 | C09 | C11 | 58.0° | 57.7° |
| C08 | C07 | N06 | C05 | 126.8° | 174.1° |
| C08 | C07 | N06 | C10 | 54.8° | 61.8° |
| C08 | C07 | H15 | H16 | 119.9° | 120.0° |
| C07 | C08 | H17 | H18 | 120.2° | 120.1° |
| C07 | C08 | C09 | H19 | 178.3° | 177.6° |
| C07 | C08 | C09 | H20 | 62.3° | 62.2° |
| N06 | C07 | C08 | C09 | 58.2° | 59.2° |
| C07 | N06 | C05 | C04 | 16.4° | 56.1° |
| C07 | N06 | C05 | C10 | 178.4° | 124.2° |
| C07 | N06 | C05 | N30 | 163.4° | 123.9° |
| C07 | N06 | C10 | C11 | 45.0° | 61.7° |
| C07 | N06 | C10 | H1 | 75.4° | 178.2° |
| C07 | N06 | C10 | H2 | 165.4° | 58.3° |
| N06 | C07 | H15 | H16 | 120.0° | 120.0° |
| N06 | C07 | C08 | H17 | 61.8° | 60.7° |
| N06 | C07 | C08 | H18 | 178.1° | 179.1° |
| C08 | C09 | C11 | H19 | 120.3° | 119.9° |
| C08 | C09 | C11 | H20 | 120.3° | 120.0° |
| C08 | C09 | C11 | C10 | 49.4° | 57.7° |
| C08 | C09 | C11 | C12 | 168.1° | 177.6° |
| C08 | C09 | C11 | O29 | 74.6° | 62.2° |
| C09 | C08 | C07 | H15 | 61.9° | 60.8° |
| C09 | C08 | C07 | H16 | 178.2° | 179.2° |
| C09 | C08 | H17 | H18 | 120.3° | 120.1° |
| C08 | C09 | H19 | H20 | 119.0° | 120.2° |
| C03 | C04 | C05 | H14 | 180.0° | 180.0° |
| C03 | C04 | C05 | N06 | 179.8° | 180.0° |
| C03 | C04 | C05 | N30 | 0.4° | 0.0° |
| C04 | C03 | N32 | C31 | 0.7° | 0.0° |
| C04 | C03 | N02 | H32 | 89.1° | 179.7° |
| C05 | C04 | C03 | N32 | 0.3° | 0.0° |
| C04 | C05 | N06 | N30 | 179.8° | 180.0° |
| C04 | C05 | N06 | C10 | 162.0° | 179.7° |
| C04 | C05 | N30 | C31 | 0.5° | 0.0° |
| C03 | N32 | C31 | N30 | 0.5° | 0.0° |
| N32 | C03 | C04 | H14 | 179.7° | 180.0° |
| C03 | N32 | C31 | H31 | 179.4° | 180.0° |
| N32 | C03 | N02 | H32 | 90.8° | 0.1° |
| O28 | C14 | N13 | C12 | 0.6° | 0.0° |
| O28 | C14 | N13 | H33 | 179.4° | 179.9° |
| C14 | N13 | C12 | H33 | 180.0° | 180.0° |
| C14 | N13 | C12 | C11 | 110.0° | 180.0° |
| C14 | N13 | C12 | H21 | 10.3° | 60.0° |
| C14 | N13 | C12 | H22 | 129.6° | 60.0° |
| C09 | C11 | C10 | N06 | 40.9° | 59.1° |
| C09 | C11 | C12 | N13 | 63.5° | 55.2° |
| C09 | C11 | C10 | C12 | 120.3° | 120.0° |
| C09 | C11 | C10 | O29 | 123.3° | 119.9° |
| C09 | C11 | C12 | O29 | 118.5° | 120.1° |
| C09 | C11 | C10 | H1 | 79.5° | 179.2° |
| C09 | C11 | C10 | H2 | 161.3° | 60.8° |
| C11 | C09 | C08 | H17 | 61.9° | 62.3° |
| C11 | C09 | C08 | H18 | 177.9° | 177.6° |
| C11 | C09 | H19 | H20 | 119.0° | 120.1° |
| C09 | C11 | C12 | H21 | 56.8° | 64.8° |
| C09 | C11 | C12 | H22 | 176.2° | 175.2° |
| C09 | C11 | O29 | H35 | 180.0° | 60.3° |
| C05 | N06 | C10 | C11 | 136.6° | 174.2° |
| N06 | C05 | N30 | C31 | 179.6° | 180.0° |
| C05 | N06 | C10 | H1 | 103.1° | 54.1° |
| C05 | N06 | C10 | H2 | 16.2° | 65.8° |
| N06 | C05 | C04 | H14 | 0.2° | 0.0° |
| C05 | N06 | C07 | H15 | 113.2° | 65.8° |
| C05 | N06 | C07 | H16 | 6.8° | 54.2° |
| C10 | N06 | C05 | N30 | 18.1° | 0.3° |
| N06 | C10 | C11 | H1 | 120.4° | 120.0° |
| N06 | C10 | C11 | H2 | 120.4° | 120.0° |
| N06 | C10 | C11 | C12 | 161.2° | 179.1° |
| N06 | C10 | C11 | O29 | 82.4° | 60.8° |
| N06 | C10 | H1 | H2 | 118.9° | 119.9° |
| C10 | N06 | C07 | H15 | 65.2° | 58.3° |
| C10 | N06 | C07 | H16 | 174.8° | 178.3° |
| C05 | N30 | C31 | N32 | 0.1° | 0.0° |
| N30 | C05 | C04 | H14 | 179.6° | 180.0° |
| C05 | N30 | C31 | H31 | 179.9° | 180.0° |
| N13 | C12 | C11 | C10 | 59.5° | 175.0° |
| N13 | C12 | C11 | H21 | 120.3° | 120.0° |
| N13 | C12 | C11 | H22 | 120.3° | 120.0° |
| N13 | C12 | C11 | O29 | 178.0° | 64.9° |
| N13 | C12 | H21 | H22 | 119.0° | 120.0° |
| C10 | C11 | C12 | O29 | 118.5° | 120.1° |
| C11 | C10 | H1 | H2 | 118.9° | 120.0° |
| C10 | C11 | C09 | H19 | 169.7° | 177.5° |
| C10 | C11 | C09 | H20 | 71.0° | 62.3° |
| C10 | C11 | C12 | H21 | 179.8° | 55.1° |
| C10 | C11 | C12 | H22 | 60.8° | 65.0° |
| C10 | C11 | O29 | H35 | 54.3° | 179.9° |
| N32 | C31 | N30 | H31 | 180.0° | 180.0° |
| C12 | C11 | C10 | H1 | 40.8° | 60.8° |
| C12 | C11 | C10 | H2 | 78.4° | 59.1° |
| C12 | C11 | C09 | H19 | 71.6° | 62.5° |
| C12 | C11 | C09 | H20 | 47.8° | 57.6° |
| C11 | C12 | H21 | H22 | 119.0° | 120.1° |
| C11 | C12 | N13 | H33 | 70.0° | 0.0° |
| C12 | C11 | O29 | H35 | 61.5° | 59.9° |
| O29 | C11 | C10 | H1 | 157.2° | 59.3° |
| O29 | C11 | C10 | H2 | 38.0° | 179.2° |
| O29 | C11 | C09 | H19 | 45.7° | 57.6° |
| O29 | C11 | C09 | H20 | 165.0° | 177.8° |
| O29 | C11 | C12 | H21 | 61.7° | 175.1° |
| O29 | C11 | C12 | H22 | 57.7° | 55.1° |
| H3 | C17 | C16 | H23 | 0.4° | 0.0° |
| H4 | C21 | C22 | H6 | 60.9° | 179.3° |
| H4 | C21 | C22 | H7 | 59.6° | 59.2° |
| H5 | C21 | C22 | H6 | 178.5° | 59.2° |
| H5 | C21 | C22 | H7 | 61.0° | 60.9° |
| H6 | C22 | C23 | H26 | 160.2° | 57.7° |
| H6 | C22 | C23 | H27 | 40.6° | 177.8° |
| H7 | C22 | C23 | H26 | 39.7° | 62.4° |
| H7 | C22 | C23 | H27 | 79.9° | 57.7° |
| H8 | C24 | C23 | H26 | 36.7° | 57.6° |
| H8 | C24 | C23 | H27 | 82.9° | 177.9° |
| H8 | C24 | C25 | H28 | 52.6° | 59.3° |
| H8 | C24 | C25 | H29 | 67.5° | 179.2° |
| H9 | C24 | C23 | H26 | 156.0° | 62.5° |
| H9 | C24 | C23 | H27 | 36.4° | 57.8° |
| H9 | C24 | C25 | H28 | 171.9° | 60.8° |
| H9 | C24 | C25 | H29 | 51.8° | 59.1° |
| H10 | C26 | C27 | H30 | 0.2° | 0.3° |
| H11 | C01 | H12 | H13 | 119.9° | 120.0° |
| H11 | C01 | N02 | H32 | 58.6° | 0.1° |
| H12 | C01 | N02 | H32 | 61.4° | 120.0° |
| H13 | C01 | N02 | H32 | 178.6° | 119.9° |
| H15 | C07 | C08 | H17 | 178.2° | 179.2° |
| H15 | C07 | C08 | H18 | 58.1° | 59.1° |
| H16 | C07 | C08 | H17 | 58.3° | 59.3° |
| H16 | C07 | C08 | H18 | 61.9° | 60.9° |
| H17 | C08 | C09 | H19 | 58.4° | 57.6° |
| H17 | C08 | C09 | H20 | 177.8° | 177.8° |
| H18 | C08 | C09 | H19 | 61.8° | 62.6° |
| H18 | C08 | C09 | H20 | 57.6° | 57.6° |
| H21 | C12 | N13 | H33 | 169.7° | 120.0° |
| H22 | C12 | N13 | H33 | 50.4° | 120.1° |
