996
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C32 | C29 | sing | 1.53Å | 1.52Å | |
| C25 | C24 | doub | 1.38Å | 1.41Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.43Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.41Å | Aromatic |
| C29 | C30 | sing | 1.53Å | 1.55Å | |
| C29 | C28 | sing | 1.53Å | 1.53Å | |
| C29 | C31 | sing | 1.53Å | 1.56Å | |
| C23 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C28 | N19 | sing | 1.46Å | 1.45Å | |
| C27 | C22 | sing | 1.38Å | 1.41Å | Aromatic |
| C22 | C13 | sing | 1.51Å | 1.55Å | |
| C13 | C8 | sing | 1.53Å | 1.53Å | |
| O1 | C9 | sing | 1.43Å | 1.46Å | |
| N19 | C18 | sing | 1.35Å | 1.38Å | Aromatic |
| N19 | N20 | sing | 1.40Å | 1.41Å | Aromatic |
| C8 | C9 | sing | 1.53Å | 1.55Å | |
| C8 | N7 | sing | 1.46Å | 1.49Å | |
| C18 | C17 | doub | 1.35Å | 1.41Å | Aromatic |
| N20 | C16 | doub | 1.30Å | 1.37Å | Aromatic |
| C9 | C10 | sing | 1.53Å | 1.55Å | |
| N7 | C6 | sing | 1.35Å | 1.32Å | |
| O21 | C6 | doub | 1.21Å | 1.26Å | |
| C17 | C16 | sing | 1.40Å | 1.45Å | Aromatic |
| C17 | C12 | sing | 1.51Å | 1.50Å | |
| C6 | C5 | sing | 1.51Å | 1.55Å | |
| C10 | N11 | sing | 1.47Å | 1.45Å | |
| C16 | C14 | sing | 1.51Å | 1.52Å | |
| N11 | C12 | sing | 1.47Å | 1.46Å | |
| C12 | C15 | sing | 1.53Å | 1.58Å | |
| C14 | C2 | sing | 1.53Å | 1.55Å | |
| C15 | C2 | sing | 1.53Å | 1.55Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | C4 | sing | 1.53Å | 1.54Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| N7 | H4 | sing | 0.97Å | 1.00Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C23 | H8 | sing | 1.08Å | 1.08Å | |
| C24 | H9 | sing | 1.08Å | 1.08Å | |
| C25 | H10 | sing | 1.08Å | 1.08Å | |
| C26 | H11 | sing | 1.08Å | 1.08Å | |
| C27 | H12 | sing | 1.08Å | 1.08Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| O1 | H14 | sing | 0.97Å | 0.95Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| N11 | H17 | sing | 1.01Å | 1.00Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.09Å | 1.10Å | |
| C3 | H24 | sing | 1.09Å | 1.10Å | |
| C4 | H25 | sing | 1.09Å | 1.10Å | |
| C4 | H26 | sing | 1.09Å | 1.10Å | |
| C4 | H27 | sing | 1.09Å | 1.10Å | |
| C15 | H28 | sing | 1.09Å | 1.10Å | |
| C15 | H29 | sing | 1.09Å | 1.10Å | |
| C18 | H30 | sing | 1.08Å | 1.08Å | |
| C28 | H31 | sing | 1.09Å | 1.10Å | |
| C28 | H32 | sing | 1.09Å | 1.10Å | |
| C30 | H33 | sing | 1.09Å | 1.10Å | |
| C30 | H34 | sing | 1.09Å | 1.10Å | |
| C30 | H35 | sing | 1.09Å | 1.10Å | |
| C31 | H36 | sing | 1.09Å | 1.10Å | |
| C31 | H37 | sing | 1.09Å | 1.10Å | |
| C31 | H38 | sing | 1.09Å | 1.10Å | |
| C32 | H39 | sing | 1.09Å | 1.10Å | |
| C32 | H40 | sing | 1.09Å | 1.10Å | |
| C32 | H41 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C32 | C29 | C30 | 108.2° | 109.5° |
| C32 | C29 | C28 | 106.7° | 109.5° |
| C32 | C29 | C31 | 110.6° | 109.4° |
| C29 | C32 | H39 | 109.5° | 109.5° |
| C29 | C32 | H40 | 109.5° | 109.5° |
| C29 | C32 | H41 | 109.4° | 109.5° |
| C24 | C25 | C26 | 119.7° | 120.0° |
| C25 | C24 | C23 | 120.2° | 120.0° |
| C25 | C24 | H9 | 119.9° | 119.9° |
| C24 | C25 | H10 | 120.2° | 120.0° |
| C25 | C26 | C27 | 121.3° | 120.0° |
| C26 | C25 | H10 | 120.2° | 120.0° |
| C25 | C26 | H11 | 119.3° | 120.0° |
| C24 | C23 | C22 | 118.7° | 120.0° |
| C24 | C23 | H8 | 120.7° | 120.0° |
| C23 | C24 | H9 | 119.9° | 120.0° |
| C26 | C27 | C22 | 118.9° | 120.0° |
| C27 | C26 | H11 | 119.4° | 120.0° |
| C26 | C27 | H12 | 120.5° | 120.0° |
| C30 | C29 | C28 | 112.1° | 109.5° |
| C30 | C29 | C31 | 109.5° | 109.5° |
| C29 | C30 | H33 | 109.5° | 109.5° |
| C29 | C30 | H34 | 109.5° | 109.5° |
| C29 | C30 | H35 | 109.5° | 109.5° |
| C28 | C29 | C31 | 109.7° | 109.5° |
| C29 | C28 | N19 | 114.6° | 109.5° |
| C29 | C28 | H31 | 108.2° | 109.4° |
| C29 | C28 | H32 | 108.2° | 109.4° |
| C29 | C31 | H36 | 109.5° | 109.4° |
| C29 | C31 | H37 | 109.4° | 109.5° |
| C29 | C31 | H38 | 109.5° | 109.5° |
| C23 | C22 | C27 | 121.1° | 120.0° |
| C23 | C22 | C13 | 123.1° | 120.0° |
| C22 | C23 | H8 | 120.6° | 120.0° |
| C28 | N19 | C18 | 131.9° | 126.0° |
| C28 | N19 | N20 | 113.2° | 126.0° |
| N19 | C28 | H31 | 108.2° | 109.5° |
| N19 | C28 | H32 | 108.2° | 109.5° |
| C27 | C22 | C13 | 115.8° | 120.0° |
| C22 | C27 | H12 | 120.5° | 120.0° |
| C22 | C13 | C8 | 112.8° | 109.5° |
| C22 | C13 | H6 | 108.6° | 109.5° |
| C22 | C13 | H7 | 108.6° | 109.4° |
| C13 | C8 | C9 | 112.6° | 109.4° |
| C13 | C8 | N7 | 108.3° | 109.5° |
| C13 | C8 | H5 | 109.2° | 109.5° |
| C8 | C13 | H6 | 108.6° | 109.5° |
| C8 | C13 | H7 | 108.6° | 109.5° |
| O1 | C9 | C8 | 111.3° | 109.5° |
| O1 | C9 | C10 | 107.3° | 109.5° |
| O1 | C9 | H13 | 110.7° | 109.5° |
| C9 | O1 | H14 | 109.5° | 114.0° |
| C18 | N19 | N20 | 114.8° | 108.0° |
| N19 | C18 | C17 | 102.6° | 107.6° |
| N19 | C18 | H30 | 128.7° | 126.2° |
| N19 | N20 | C16 | 104.9° | 108.1° |
| C9 | C8 | N7 | 108.2° | 109.5° |
| C8 | C9 | C10 | 108.7° | 109.4° |
| C9 | C8 | H5 | 108.8° | 109.4° |
| C8 | C9 | H13 | 109.3° | 109.4° |
| C8 | N7 | C6 | 124.2° | 120.0° |
| C8 | N7 | H4 | 117.8° | 120.0° |
| N7 | C8 | H5 | 109.6° | 109.5° |
| C18 | C17 | C16 | 109.4° | 108.0° |
| C18 | C17 | C12 | 125.5° | 128.3° |
| C17 | C18 | H30 | 128.7° | 126.2° |
| N20 | C16 | C17 | 108.3° | 108.2° |
| N20 | C16 | C14 | 130.4° | 128.3° |
| C9 | C10 | N11 | 108.6° | 109.5° |
| C10 | C9 | H13 | 109.5° | 109.5° |
| C9 | C10 | H15 | 109.7° | 109.5° |
| C9 | C10 | H16 | 109.7° | 109.5° |
| N7 | C6 | O21 | 122.4° | 120.0° |
| N7 | C6 | C5 | 114.2° | 120.0° |
| C6 | N7 | H4 | 117.9° | 120.0° |
| O21 | C6 | C5 | 123.4° | 120.0° |
| C16 | C17 | C12 | 125.1° | 123.7° |
| C17 | C16 | C14 | 121.4° | 123.5° |
| C17 | C12 | N11 | 113.0° | 109.7° |
| C17 | C12 | C15 | 106.0° | 108.1° |
| C17 | C12 | H19 | 110.0° | 109.7° |
| C6 | C5 | H1 | 109.5° | 109.5° |
| C6 | C5 | H2 | 109.4° | 109.4° |
| C6 | C5 | H3 | 109.5° | 109.5° |
| C10 | N11 | C12 | 116.6° | 111.0° |
| N11 | C10 | H15 | 109.7° | 109.5° |
| N11 | C10 | H16 | 109.7° | 109.5° |
| C10 | N11 | H17 | 107.6° | 111.0° |
| C16 | C14 | C2 | 108.7° | 108.2° |
| C16 | C14 | H20 | 109.6° | 109.7° |
| C16 | C14 | H21 | 109.7° | 109.8° |
| N11 | C12 | C15 | 108.0° | 109.8° |
| C12 | N11 | H17 | 107.6° | 111.0° |
| N11 | C12 | H19 | 110.7° | 109.7° |
| C12 | C15 | C2 | 109.8° | 109.8° |
| C15 | C12 | H19 | 108.9° | 109.7° |
| C12 | C15 | H28 | 109.4° | 109.4° |
| C12 | C15 | H29 | 109.4° | 109.4° |
| C14 | C2 | C15 | 105.3° | 109.8° |
| C14 | C2 | C3 | 111.5° | 109.4° |
| C14 | C2 | C4 | 104.9° | 109.5° |
| C2 | C14 | H20 | 109.7° | 109.7° |
| C2 | C14 | H21 | 109.7° | 109.7° |
| C15 | C2 | C3 | 118.5° | 109.4° |
| C15 | C2 | C4 | 108.4° | 109.4° |
| C2 | C15 | H28 | 109.4° | 109.5° |
| C2 | C15 | H29 | 109.4° | 109.4° |
| C3 | C2 | C4 | 107.5° | 109.4° |
| C2 | C3 | H22 | 109.5° | 109.5° |
| C2 | C3 | H23 | 109.5° | 109.5° |
| C2 | C3 | H24 | 109.5° | 109.5° |
| C2 | C4 | H25 | 109.5° | 109.5° |
| C2 | C4 | H26 | 109.4° | 109.5° |
| C2 | C4 | H27 | 109.5° | 109.5° |
| H1 | C5 | H2 | 109.5° | 109.5° |
| H1 | C5 | H3 | 109.5° | 109.5° |
| H2 | C5 | H3 | 109.5° | 109.4° |
| H6 | C13 | H7 | 109.5° | 109.5° |
| H15 | C10 | H16 | 109.5° | 109.4° |
| H20 | C14 | H21 | 109.5° | 109.8° |
| H22 | C3 | H23 | 109.4° | 109.5° |
| H22 | C3 | H24 | 109.5° | 109.4° |
| H23 | C3 | H24 | 109.5° | 109.4° |
| H25 | C4 | H26 | 109.5° | 109.5° |
| H25 | C4 | H27 | 109.5° | 109.4° |
| H26 | C4 | H27 | 109.5° | 109.5° |
| H28 | C15 | H29 | 109.5° | 109.4° |
| H31 | C28 | H32 | 109.4° | 109.5° |
| H33 | C30 | H34 | 109.4° | 109.5° |
| H33 | C30 | H35 | 109.5° | 109.5° |
| H34 | C30 | H35 | 109.4° | 109.5° |
| H36 | C31 | H37 | 109.5° | 109.5° |
| H36 | C31 | H38 | 109.5° | 109.5° |
| H37 | C31 | H38 | 109.5° | 109.5° |
| H39 | C32 | H40 | 109.5° | 109.5° |
| H39 | C32 | H41 | 109.5° | 109.4° |
| H40 | C32 | H41 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C32 | C29 | C30 | C28 | 117.4° | 120.0° |
| C32 | C29 | C30 | C31 | 120.6° | 120.0° |
| C32 | C29 | C28 | C31 | 119.8° | 119.9° |
| C32 | C29 | C28 | N19 | 170.6° | 60.0° |
| C32 | C29 | C28 | H31 | 49.9° | 179.9° |
| C32 | C29 | C28 | H32 | 68.6° | 60.0° |
| C32 | C29 | C30 | H33 | 180.0° | 180.0° |
| C32 | C29 | C30 | H34 | 60.0° | 60.0° |
| C32 | C29 | C30 | H35 | 60.0° | 60.0° |
| C32 | C29 | C31 | H36 | 180.0° | 180.0° |
| C32 | C29 | C31 | H37 | 60.0° | 60.0° |
| C32 | C29 | C31 | H38 | 60.0° | 60.0° |
| C29 | C32 | H39 | H40 | 120.0° | 120.1° |
| C29 | C32 | H39 | H41 | 120.0° | 120.0° |
| C29 | C32 | H40 | H41 | 120.0° | 120.0° |
| C24 | C25 | C26 | H10 | 180.0° | 179.9° |
| C25 | C24 | C23 | H9 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 4.1° | 0.3° |
| C25 | C24 | C23 | C22 | 2.9° | 0.1° |
| C25 | C24 | C23 | H8 | 177.1° | 179.9° |
| C24 | C25 | C26 | H11 | 175.9° | 179.9° |
| C26 | C25 | C24 | C23 | 4.0° | 0.0° |
| C25 | C26 | C27 | H11 | 180.0° | 179.8° |
| C25 | C26 | C27 | C22 | 3.0° | 0.6° |
| C26 | C25 | C24 | H9 | 176.0° | 180.0° |
| C25 | C26 | C27 | H12 | 177.0° | 180.0° |
| C24 | C23 | C22 | H8 | 180.0° | 179.9° |
| C24 | C23 | C22 | C27 | 1.8° | 0.3° |
| C24 | C23 | C22 | C13 | 177.1° | 179.9° |
| C23 | C24 | C25 | H10 | 176.0° | 180.0° |
| C26 | C27 | C22 | C23 | 1.9° | 0.6° |
| C26 | C27 | C22 | H12 | 180.0° | 179.4° |
| C26 | C27 | C22 | C13 | 177.1° | 179.7° |
| C27 | C26 | C25 | H10 | 175.9° | 179.8° |
| C30 | C29 | C28 | C31 | 121.9° | 120.0° |
| C30 | C29 | C28 | N19 | 52.3° | 60.0° |
| C30 | C29 | C28 | H31 | 68.4° | 60.0° |
| C30 | C29 | C28 | H32 | 173.1° | 180.0° |
| C29 | C30 | H33 | H34 | 120.0° | 120.0° |
| C29 | C30 | H33 | H35 | 120.0° | 120.0° |
| C29 | C30 | H34 | H35 | 120.0° | 120.0° |
| C30 | C29 | C31 | H36 | 60.8° | 60.0° |
| C30 | C29 | C31 | H37 | 179.2° | 179.9° |
| C30 | C29 | C31 | H38 | 59.2° | 60.0° |
| C30 | C29 | C32 | H39 | 180.0° | 60.0° |
| C30 | C29 | C32 | H40 | 60.0° | 180.0° |
| C30 | C29 | C32 | H41 | 60.0° | 60.0° |
| C29 | C28 | N19 | H31 | 120.8° | 120.0° |
| C29 | C28 | N19 | H32 | 120.8° | 120.0° |
| C29 | C28 | N19 | C18 | 84.1° | 125.0° |
| C29 | C28 | N19 | N20 | 95.7° | 55.0° |
| C29 | C28 | H31 | H32 | 117.6° | 119.9° |
| C28 | C29 | C30 | H33 | 62.6° | 60.0° |
| C28 | C29 | C30 | H34 | 177.4° | 180.0° |
| C28 | C29 | C30 | H35 | 57.4° | 60.0° |
| C28 | C29 | C31 | H36 | 62.6° | 60.0° |
| C28 | C29 | C31 | H37 | 57.4° | 60.0° |
| C28 | C29 | C31 | H38 | 177.4° | 180.0° |
| C28 | C29 | C32 | H39 | 59.2° | 180.0° |
| C28 | C29 | C32 | H40 | 60.8° | 60.0° |
| C28 | C29 | C32 | H41 | 179.2° | 60.0° |
| C31 | C29 | C28 | N19 | 69.6° | 180.0° |
| C31 | C29 | C28 | H31 | 169.7° | 60.0° |
| C31 | C29 | C28 | H32 | 51.2° | 60.0° |
| C31 | C29 | C30 | H33 | 59.4° | 60.0° |
| C31 | C29 | C30 | H34 | 60.6° | 60.0° |
| C31 | C29 | C30 | H35 | 179.4° | 180.0° |
| C29 | C31 | H36 | H37 | 120.0° | 120.0° |
| C29 | C31 | H36 | H38 | 120.0° | 120.0° |
| C29 | C31 | H37 | H38 | 120.0° | 120.0° |
| C31 | C29 | C32 | H39 | 60.0° | 60.0° |
| C31 | C29 | C32 | H40 | 180.0° | 60.0° |
| C31 | C29 | C32 | H41 | 60.0° | 180.0° |
| C23 | C22 | C27 | C13 | 179.0° | 179.7° |
| C23 | C22 | C13 | C8 | 38.6° | 90.0° |
| C23 | C22 | C13 | H6 | 81.9° | 30.0° |
| C23 | C22 | C13 | H7 | 159.1° | 150.0° |
| C22 | C23 | C24 | H9 | 177.1° | 180.0° |
| C23 | C22 | C27 | H12 | 178.1° | 180.0° |
| C28 | N19 | C18 | N20 | 179.8° | 180.0° |
| C28 | N19 | C18 | C17 | 179.8° | 180.0° |
| C28 | N19 | N20 | C16 | 179.7° | 180.0° |
| C28 | N19 | C18 | H30 | 0.2° | 0.0° |
| N19 | C28 | H31 | H32 | 117.7° | 120.1° |
| C27 | C22 | C13 | C8 | 140.3° | 90.3° |
| C27 | C22 | C13 | H6 | 99.2° | 149.7° |
| C27 | C22 | C13 | H7 | 19.9° | 29.8° |
| C27 | C22 | C23 | H8 | 178.2° | 179.8° |
| C22 | C27 | C26 | H11 | 177.0° | 179.6° |
| C22 | C13 | C8 | H6 | 120.5° | 120.0° |
| C22 | C13 | C8 | H7 | 120.5° | 120.0° |
| C22 | C13 | C8 | C9 | 175.9° | 175.0° |
| C22 | C13 | C8 | N7 | 56.3° | 65.0° |
| C22 | C13 | C8 | H5 | 63.0° | 55.0° |
| C22 | C13 | H6 | H7 | 118.5° | 119.9° |
| C13 | C22 | C23 | H8 | 2.9° | 0.0° |
| C13 | C22 | C27 | H12 | 2.9° | 0.3° |
| C13 | C8 | C9 | O1 | 63.0° | 60.0° |
| C13 | C8 | C9 | N7 | 119.7° | 120.0° |
| C13 | C8 | C9 | H5 | 121.3° | 120.0° |
| C13 | C8 | N7 | H5 | 119.1° | 120.1° |
| C13 | C8 | C9 | C10 | 179.1° | 180.0° |
| C13 | C8 | N7 | C6 | 125.3° | 60.0° |
| C13 | C8 | N7 | H4 | 54.7° | 120.0° |
| C8 | C13 | H6 | H7 | 118.4° | 120.1° |
| C13 | C8 | C9 | H13 | 59.6° | 60.0° |
| O1 | C9 | C8 | C10 | 118.0° | 120.0° |
| O1 | C9 | C8 | H13 | 122.6° | 120.0° |
| O1 | C9 | C8 | N7 | 177.4° | 180.0° |
| O1 | C9 | C10 | H13 | 120.1° | 120.1° |
| O1 | C9 | C10 | N11 | 55.6° | 65.0° |
| O1 | C9 | C8 | H5 | 58.3° | 60.0° |
| O1 | C9 | C10 | H15 | 175.5° | 175.0° |
| O1 | C9 | C10 | H16 | 64.2° | 55.0° |
| N19 | C18 | C17 | H30 | 180.0° | 180.0° |
| C18 | N19 | N20 | C16 | 0.2° | 0.0° |
| N19 | C18 | C17 | C16 | 0.8° | 0.1° |
| N19 | C18 | C17 | C12 | 180.0° | 179.9° |
| C18 | N19 | C28 | H31 | 36.7° | 115.0° |
| C18 | N19 | C28 | H32 | 155.2° | 5.1° |
| N20 | N19 | C18 | C17 | 0.4° | 0.0° |
| N19 | N20 | C16 | C17 | 0.7° | 0.1° |
| N19 | N20 | C16 | C14 | 179.7° | 179.8° |
| N20 | N19 | C18 | H30 | 179.6° | 180.0° |
| N20 | N19 | C28 | H31 | 143.5° | 65.0° |
| N20 | N19 | C28 | H32 | 25.0° | 174.9° |
| C9 | C8 | N7 | H5 | 118.6° | 120.0° |
| C8 | C9 | C10 | H13 | 119.4° | 120.0° |
| C9 | C8 | N7 | C6 | 112.4° | 60.0° |
| C8 | C9 | C10 | N11 | 176.1° | 175.0° |
| C9 | C8 | N7 | H4 | 67.6° | 120.0° |
| C9 | C8 | C13 | H6 | 63.6° | 65.0° |
| C9 | C8 | C13 | H7 | 55.4° | 55.0° |
| C8 | C9 | O1 | H14 | 180.0° | 60.0° |
| C8 | C9 | C10 | H15 | 64.0° | 55.0° |
| C8 | C9 | C10 | H16 | 56.3° | 65.0° |
| N7 | C8 | C9 | C10 | 59.4° | 60.0° |
| C8 | N7 | C6 | H4 | 180.0° | 180.0° |
| C8 | N7 | C6 | O21 | 4.0° | 0.0° |
| C8 | N7 | C6 | C5 | 177.4° | 179.7° |
| N7 | C8 | C13 | H6 | 176.8° | 54.9° |
| N7 | C8 | C13 | H7 | 64.2° | 175.0° |
| N7 | C8 | C9 | H13 | 60.1° | 60.0° |
| C18 | C17 | C16 | N20 | 1.0° | 0.1° |
| C18 | C17 | C16 | C12 | 179.2° | 180.0° |
| C18 | C17 | C16 | C14 | 179.9° | 179.8° |
| C18 | C17 | C12 | N11 | 47.4° | 43.7° |
| C18 | C17 | C12 | C15 | 165.5° | 163.4° |
| C18 | C17 | C12 | H19 | 76.9° | 77.0° |
| N20 | C16 | C17 | C14 | 179.1° | 179.9° |
| N20 | C16 | C17 | C12 | 179.9° | 179.9° |
| N20 | C16 | C14 | C2 | 159.4° | 163.3° |
| N20 | C16 | C14 | H20 | 80.7° | 77.1° |
| N20 | C16 | C14 | H21 | 39.5° | 43.6° |
| C9 | C10 | N11 | H15 | 119.9° | 120.0° |
| C9 | C10 | N11 | H16 | 119.9° | 120.0° |
| C9 | C10 | N11 | C12 | 151.1° | 180.0° |
| C10 | C9 | C8 | H5 | 59.7° | 60.0° |
| C10 | C9 | O1 | H14 | 61.2° | 60.0° |
| C9 | C10 | H15 | H16 | 120.4° | 120.0° |
| C9 | C10 | N11 | H17 | 30.1° | 56.0° |
| N7 | C6 | O21 | C5 | 178.4° | 179.8° |
| N7 | C6 | C5 | H1 | 178.6° | 179.7° |
| N7 | C6 | C5 | H2 | 58.6° | 59.7° |
| N7 | C6 | C5 | H3 | 61.4° | 60.2° |
| C6 | N7 | C8 | H5 | 6.2° | 180.0° |
| O21 | C6 | C5 | H1 | 0.0° | 0.1° |
| O21 | C6 | C5 | H2 | 120.0° | 120.1° |
| O21 | C6 | C5 | H3 | 120.0° | 120.0° |
| O21 | C6 | N7 | H4 | 176.0° | 180.0° |
| C16 | C17 | C12 | N11 | 133.5° | 136.3° |
| C16 | C17 | C12 | C15 | 15.4° | 16.6° |
| C17 | C16 | C14 | C2 | 21.7° | 16.7° |
| C16 | C17 | C12 | H19 | 102.2° | 103.0° |
| C17 | C16 | C14 | H20 | 98.2° | 103.0° |
| C17 | C16 | C14 | H21 | 141.6° | 136.3° |
| C16 | C17 | C18 | H30 | 179.2° | 179.9° |
| C17 | C12 | N11 | C10 | 55.8° | 86.3° |
| C12 | C17 | C16 | C14 | 0.7° | 0.2° |
| C17 | C12 | N11 | C15 | 116.9° | 118.7° |
| C17 | C12 | N11 | H19 | 123.9° | 120.7° |
| C17 | C12 | C15 | H19 | 118.4° | 119.7° |
| C17 | C12 | C15 | C2 | 52.6° | 50.5° |
| C17 | C12 | N11 | H17 | 65.2° | 149.7° |
| C17 | C12 | C15 | H28 | 172.7° | 170.7° |
| C17 | C12 | C15 | H29 | 67.5° | 69.5° |
| C12 | C17 | C18 | H30 | 0.0° | 0.1° |
| C6 | C5 | H1 | H2 | 120.0° | 120.0° |
| C6 | C5 | H1 | H3 | 120.0° | 120.0° |
| C6 | C5 | H2 | H3 | 120.0° | 120.0° |
| C5 | C6 | N7 | H4 | 2.6° | 0.2° |
| C10 | N11 | C12 | H17 | 121.0° | 124.0° |
| C10 | N11 | C12 | C15 | 61.1° | 155.0° |
| N11 | C10 | C9 | H13 | 64.5° | 55.1° |
| N11 | C10 | H15 | H16 | 120.4° | 120.0° |
| C10 | N11 | C12 | H19 | 179.8° | 34.4° |
| C16 | C14 | C2 | H20 | 119.9° | 119.7° |
| C16 | C14 | C2 | H21 | 119.9° | 119.7° |
| C16 | C14 | C2 | C15 | 56.4° | 50.6° |
| C16 | C14 | C2 | C3 | 73.3° | 69.4° |
| C16 | C14 | C2 | C4 | 170.7° | 170.7° |
| C16 | C14 | H20 | H21 | 120.3° | 120.7° |
| N11 | C12 | C15 | H19 | 120.2° | 120.7° |
| N11 | C12 | C15 | C2 | 174.0° | 170.2° |
| C12 | N11 | C10 | H15 | 89.0° | 60.0° |
| C12 | N11 | C10 | H16 | 31.3° | 60.0° |
| N11 | C12 | C15 | H28 | 66.0° | 69.7° |
| N11 | C12 | C15 | H29 | 53.9° | 50.1° |
| C12 | C15 | C2 | C14 | 76.6° | 71.6° |
| C12 | C15 | C2 | H28 | 120.1° | 120.1° |
| C12 | C15 | C2 | H29 | 120.0° | 120.0° |
| C12 | C15 | C2 | C3 | 48.9° | 48.4° |
| C12 | C15 | C2 | C4 | 171.6° | 168.2° |
| C15 | C12 | N11 | H17 | 177.9° | 31.0° |
| C12 | C15 | H28 | H29 | 119.8° | 119.8° |
| C14 | C2 | C15 | C3 | 125.5° | 120.0° |
| C14 | C2 | C15 | C4 | 111.8° | 120.1° |
| C14 | C2 | C3 | C4 | 114.4° | 119.9° |
| C2 | C14 | H20 | H21 | 120.4° | 120.5° |
| C14 | C2 | C3 | H22 | 180.0° | 59.9° |
| C14 | C2 | C3 | H23 | 60.0° | 180.0° |
| C14 | C2 | C3 | H24 | 60.0° | 60.0° |
| C14 | C2 | C4 | H25 | 180.0° | 60.0° |
| C14 | C2 | C4 | H26 | 60.0° | 180.0° |
| C14 | C2 | C4 | H27 | 60.0° | 60.0° |
| C14 | C2 | C15 | H28 | 163.3° | 168.2° |
| C14 | C2 | C15 | H29 | 43.4° | 48.4° |
| C15 | C2 | C3 | C4 | 123.2° | 119.8° |
| C2 | C15 | C12 | H19 | 65.8° | 69.1° |
| C15 | C2 | C14 | H20 | 63.4° | 69.1° |
| C15 | C2 | C14 | H21 | 176.3° | 170.3° |
| C15 | C2 | C3 | H22 | 57.6° | 60.3° |
| C15 | C2 | C3 | H23 | 177.6° | 59.7° |
| C15 | C2 | C3 | H24 | 62.4° | 179.7° |
| C15 | C2 | C4 | H25 | 68.0° | 179.7° |
| C15 | C2 | C4 | H26 | 52.0° | 59.7° |
| C15 | C2 | C4 | H27 | 172.0° | 60.3° |
| C2 | C15 | H28 | H29 | 119.8° | 119.9° |
| C3 | C2 | C14 | H20 | 166.8° | 170.9° |
| C3 | C2 | C14 | H21 | 46.6° | 50.3° |
| C2 | C3 | H22 | H23 | 120.0° | 120.0° |
| C2 | C3 | H22 | H24 | 120.0° | 120.0° |
| C2 | C3 | H23 | H24 | 120.0° | 120.0° |
| C3 | C2 | C4 | H25 | 61.3° | 59.9° |
| C3 | C2 | C4 | H26 | 178.7° | 60.1° |
| C3 | C2 | C4 | H27 | 58.7° | 179.8° |
| C3 | C2 | C15 | H28 | 71.2° | 71.7° |
| C3 | C2 | C15 | H29 | 168.9° | 168.4° |
| C4 | C2 | C14 | H20 | 50.8° | 51.0° |
| C4 | C2 | C14 | H21 | 69.4° | 69.6° |
| C4 | C2 | C3 | H22 | 65.6° | 179.9° |
| C4 | C2 | C3 | H23 | 54.4° | 60.1° |
| C4 | C2 | C3 | H24 | 174.4° | 59.9° |
| C2 | C4 | H25 | H26 | 120.0° | 120.1° |
| C2 | C4 | H25 | H27 | 120.0° | 120.0° |
| C2 | C4 | H26 | H27 | 120.0° | 120.0° |
| C4 | C2 | C15 | H28 | 51.5° | 48.1° |
| C4 | C2 | C15 | H29 | 68.4° | 71.8° |
| H1 | C5 | H2 | H3 | 120.0° | 120.1° |
| H4 | N7 | C8 | H5 | 173.8° | 0.1° |
| H5 | C8 | C13 | H6 | 57.5° | 175.0° |
| H5 | C8 | C13 | H7 | 176.5° | 64.9° |
| H5 | C8 | C9 | H13 | 179.1° | 180.0° |
| H8 | C23 | C24 | H9 | 2.9° | 0.1° |
| H9 | C24 | C25 | H10 | 4.0° | 0.1° |
| H10 | C25 | C26 | H11 | 4.1° | 0.0° |
| H11 | C26 | C27 | H12 | 3.0° | 0.2° |
| H13 | C9 | O1 | H14 | 58.2° | 180.0° |
| H13 | C9 | C10 | H15 | 55.4° | 65.0° |
| H13 | C9 | C10 | H16 | 175.6° | 175.0° |
| H15 | C10 | N11 | H17 | 150.0° | 176.1° |
| H16 | C10 | N11 | H17 | 89.7° | 63.9° |
| H17 | N11 | C12 | H19 | 58.7° | 89.6° |
| H19 | C12 | C15 | H28 | 54.3° | 51.0° |
| H19 | C12 | C15 | H29 | 174.2° | 170.8° |
| H22 | C3 | H23 | H24 | 120.0° | 119.9° |
| H25 | C4 | H26 | H27 | 120.0° | 119.9° |
| H33 | C30 | H34 | H35 | 120.0° | 120.0° |
| H36 | C31 | H37 | H38 | 120.0° | 120.0° |
| H39 | C32 | H40 | H41 | 120.0° | 119.9° |
