0WX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | N16 | sing | 1.46Å | 1.45Å | |
| C24 | C25 | sing | 1.53Å | 1.51Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C25 | C26 | sing | 1.53Å | 1.51Å | |
| C23 | C22 | sing | 1.53Å | 1.55Å | |
| N16 | C12 | sing | 1.38Å | 1.35Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| C22 | C27 | sing | 1.53Å | 1.54Å | |
| C22 | C21 | sing | 1.53Å | 1.55Å | |
| C12 | N11 | sing | 1.37Å | 1.36Å | Aromatic |
| C12 | N13 | doub | 1.31Å | 1.32Å | Aromatic |
| N11 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| N20 | C21 | sing | 1.47Å | 1.45Å | |
| N20 | C19 | sing | 1.47Å | 1.46Å | |
| N13 | C8 | sing | 1.36Å | 1.36Å | Aromatic |
| C19 | C18 | sing | 1.53Å | 1.52Å | |
| C9 | C8 | doub | 1.41Å | 1.38Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | C10 | sing | 1.51Å | 1.51Å | |
| C8 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | C6 | doub | 1.39Å | 1.41Å | Aromatic |
| C7 | C1 | doub | 1.39Å | 1.42Å | Aromatic |
| C6 | C1 | sing | 1.42Å | 1.41Å | Aromatic |
| C6 | N5 | sing | 1.36Å | 1.42Å | |
| C1 | C2 | sing | 1.47Å | 1.47Å | |
| N5 | C4 | doub | 1.30Å | 1.29Å | |
| C2 | O14 | doub | 1.22Å | 1.22Å | |
| C2 | N3 | sing | 1.35Å | 1.38Å | |
| C4 | N3 | sing | 1.36Å | 1.38Å | |
| N3 | H1 | sing | 0.97Å | 1.00Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C18 | H3 | sing | 1.09Å | 1.10Å | |
| C18 | H4 | sing | 1.09Å | 1.10Å | |
| C19 | H5 | sing | 1.09Å | 1.10Å | |
| C21 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C22 | H8 | sing | 1.09Å | 1.10Å | |
| C27 | H9 | sing | 1.09Å | 1.10Å | |
| C27 | H10 | sing | 1.09Å | 1.10Å | |
| C26 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.09Å | 1.10Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| N11 | H19 | sing | 0.97Å | 1.00Å | |
| N16 | H20 | sing | 0.97Å | 1.00Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C7 | H25 | sing | 1.08Å | 1.08Å | |
| C17 | C3 | sing | 1.53Å | 30.07Å | |
| C3 | N1 | sing | 1.47Å | 0.00Å | |
| N1 | C11 | sing | 1.47Å | 0.00Å | |
| C11 | C13 | sing | 1.53Å | 0.00Å | |
| C13 | O1 | sing | 1.43Å | 0.00Å | |
| O1 | C15 | sing | 1.43Å | 0.00Å | |
| C15 | C16 | sing | 1.53Å | 0.00Å | |
| C16 | N1 | sing | 1.47Å | 0.00Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| N20 | H27 | sing | 1.01Å | 1.00Å | |
| C3 | H23 | sing | 1.09Å | 0.00Å | |
| C3 | H24 | sing | 1.09Å | 0.00Å | |
| C11 | H28 | sing | 1.09Å | 0.00Å | |
| C11 | H29 | sing | 1.09Å | 0.00Å | |
| C13 | H30 | sing | 1.09Å | 0.00Å | |
| C13 | H31 | sing | 1.09Å | 0.00Å | |
| C15 | H32 | sing | 1.09Å | 0.00Å | |
| C15 | H33 | sing | 1.09Å | 0.00Å | |
| C16 | H34 | sing | 1.09Å | 0.00Å | |
| C16 | H35 | sing | 1.09Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | N16 | C12 | 122.1° | 120.0° |
| C17 | N16 | H20 | 106.2° | 120.0° |
| N16 | C17 | H21 | 102.5° | 109.5° |
| N16 | C17 | H22 | 102.5° | 109.4° |
| N16 | C17 | C3 | 135.8° | 109.4° |
| C25 | C24 | C23 | 112.3° | 109.5° |
| C24 | C25 | C26 | 114.1° | 109.4° |
| C24 | C25 | H13 | 108.3° | 109.5° |
| C24 | C25 | H14 | 108.3° | 109.5° |
| C25 | C24 | H15 | 108.8° | 109.5° |
| C25 | C24 | H16 | 108.7° | 109.4° |
| C24 | C23 | C22 | 110.7° | 109.4° |
| C23 | C24 | H15 | 108.8° | 109.5° |
| C23 | C24 | H16 | 108.8° | 109.4° |
| C24 | C23 | H17 | 109.2° | 109.4° |
| C24 | C23 | H18 | 109.2° | 109.5° |
| C25 | C26 | C27 | 113.5° | 109.5° |
| C25 | C26 | H11 | 108.5° | 109.5° |
| C25 | C26 | H12 | 108.5° | 109.5° |
| C26 | C25 | H13 | 108.3° | 109.5° |
| C26 | C25 | H14 | 108.3° | 109.5° |
| C23 | C22 | C27 | 109.9° | 109.5° |
| C23 | C22 | C21 | 109.0° | 109.4° |
| C23 | C22 | H8 | 110.3° | 109.5° |
| C22 | C23 | H17 | 109.2° | 109.5° |
| C22 | C23 | H18 | 109.2° | 109.5° |
| N16 | C12 | N11 | 124.6° | 125.0° |
| N16 | C12 | N13 | 122.8° | 125.0° |
| C12 | N16 | H20 | 106.2° | 120.0° |
| C26 | C27 | C22 | 113.1° | 109.5° |
| C26 | C27 | H9 | 108.5° | 109.5° |
| C26 | C27 | H10 | 108.6° | 109.5° |
| C27 | C26 | H11 | 108.5° | 109.5° |
| C27 | C26 | H12 | 108.4° | 109.5° |
| C27 | C22 | C21 | 106.9° | 109.5° |
| C27 | C22 | H8 | 110.5° | 109.5° |
| C22 | C27 | H9 | 108.6° | 109.5° |
| C22 | C27 | H10 | 108.5° | 109.5° |
| C22 | C21 | N20 | 110.9° | 109.4° |
| C22 | C21 | H6 | 109.1° | 109.5° |
| C22 | C21 | H7 | 109.1° | 109.5° |
| C21 | C22 | H8 | 110.2° | 109.5° |
| N11 | C12 | N13 | 112.6° | 110.0° |
| C12 | N11 | C9 | 105.5° | 107.3° |
| C12 | N11 | H19 | 127.3° | 126.4° |
| C12 | N13 | C8 | 105.7° | 109.6° |
| N11 | C9 | C8 | 106.3° | 106.1° |
| N11 | C9 | C10 | 130.3° | 133.3° |
| C9 | N11 | H19 | 127.3° | 126.4° |
| C21 | N20 | C19 | 116.7° | 111.0° |
| N20 | C21 | H6 | 109.1° | 109.4° |
| N20 | C21 | H7 | 109.1° | 109.5° |
| C21 | N20 | H27 | 107.6° | 111.0° |
| N20 | C19 | C18 | 115.8° | 109.5° |
| N20 | C19 | H5 | 107.8° | 109.4° |
| N20 | C19 | H26 | 107.9° | 109.4° |
| C19 | N20 | H27 | 107.7° | 111.0° |
| N13 | C8 | C9 | 109.9° | 107.0° |
| N13 | C8 | C7 | 130.1° | 133.0° |
| C19 | C18 | C10 | 111.9° | 109.5° |
| C19 | C18 | H3 | 108.8° | 109.5° |
| C19 | C18 | H4 | 108.9° | 109.4° |
| C18 | C19 | H5 | 107.9° | 109.5° |
| C18 | C19 | H26 | 107.9° | 109.5° |
| C8 | C9 | C10 | 123.2° | 120.6° |
| C9 | C8 | C7 | 120.0° | 120.0° |
| C9 | C10 | C18 | 120.9° | 120.1° |
| C9 | C10 | C6 | 117.8° | 119.7° |
| C18 | C10 | C6 | 121.2° | 120.2° |
| C10 | C18 | H3 | 108.9° | 109.5° |
| C10 | C18 | H4 | 108.8° | 109.4° |
| C8 | C7 | C1 | 118.0° | 119.4° |
| C8 | C7 | H25 | 121.0° | 120.3° |
| C10 | C6 | C1 | 119.3° | 119.8° |
| C10 | C6 | N5 | 118.6° | 121.3° |
| C7 | C1 | C6 | 121.6° | 120.4° |
| C7 | C1 | C2 | 119.2° | 121.6° |
| C1 | C7 | H25 | 121.0° | 120.3° |
| C1 | C6 | N5 | 122.0° | 118.9° |
| C6 | C1 | C2 | 119.2° | 118.0° |
| C6 | N5 | C4 | 114.4° | 121.6° |
| C1 | C2 | O14 | 124.7° | 121.3° |
| C1 | C2 | N3 | 115.7° | 117.4° |
| N5 | C4 | N3 | 129.0° | 123.4° |
| N5 | C4 | H2 | 115.5° | 118.3° |
| O14 | C2 | N3 | 119.6° | 121.3° |
| C2 | N3 | C4 | 119.5° | 120.7° |
| C2 | N3 | H1 | 120.2° | 119.7° |
| C4 | N3 | H1 | 120.3° | 119.7° |
| N3 | C4 | H2 | 115.5° | 118.3° |
| H3 | C18 | H4 | 109.5° | 109.5° |
| H5 | C19 | H26 | 109.5° | 109.5° |
| H6 | C21 | H7 | 109.5° | 109.5° |
| H9 | C27 | H10 | 109.5° | 109.5° |
| H11 | C26 | H12 | 109.5° | 109.5° |
| H13 | C25 | H14 | 109.5° | 109.5° |
| H15 | C24 | H16 | 109.5° | 109.5° |
| H17 | C23 | H18 | 109.5° | 109.5° |
| H21 | C17 | H22 | 109.5° | 109.5° |
| H21 | C17 | C3 | 102.5° | 109.5° |
| H22 | C17 | C3 | 102.6° | 109.5° |
| C17 | C3 | N1 | 90.0° | 109.5° |
| C17 | C3 | H23 | 90.0° | 109.5° |
| C17 | C3 | H24 | 90.0° | 109.5° |
| C3 | N1 | C11 | 90.0° | 111.0° |
| C3 | N1 | C16 | 90.0° | 111.0° |
| N1 | C3 | H23 | 90.0° | 109.4° |
| N1 | C3 | H24 | 90.0° | 109.5° |
| N1 | C11 | C13 | 90.0° | 109.2° |
| C11 | N1 | C16 | 90.0° | 110.8° |
| N1 | C11 | H28 | 90.0° | 109.5° |
| N1 | C11 | H29 | 90.0° | 109.5° |
| C11 | C13 | O1 | 90.0° | 109.3° |
| C13 | C11 | H28 | 90.0° | 109.4° |
| C13 | C11 | H29 | 90.0° | 109.5° |
| C11 | C13 | H30 | 90.0° | 109.5° |
| C11 | C13 | H31 | 90.0° | 109.5° |
| C13 | O1 | C15 | 90.0° | 113.8° |
| O1 | C13 | H30 | 90.0° | 109.5° |
| O1 | C13 | H31 | 90.0° | 109.5° |
| O1 | C15 | C16 | 90.0° | 109.3° |
| O1 | C15 | H32 | 90.0° | 109.5° |
| O1 | C15 | H33 | 90.0° | 109.5° |
| C15 | C16 | N1 | 90.0° | 109.2° |
| C16 | C15 | H32 | 90.0° | 109.5° |
| C16 | C15 | H33 | 90.0° | 109.5° |
| C15 | C16 | H34 | 90.0° | 109.5° |
| C15 | C16 | H35 | 90.0° | 109.5° |
| N1 | C16 | H34 | 90.0° | 109.5° |
| N1 | C16 | H35 | 90.0° | 109.5° |
| H23 | C3 | H24 | 90.0° | 109.5° |
| H28 | C11 | H29 | 90.0° | 109.5° |
| H30 | C13 | H31 | 90.0° | 109.5° |
| H32 | C15 | H33 | 90.0° | 109.5° |
| H34 | C16 | H35 | 90.0° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | N16 | C12 | H20 | 121.7° | 180.0° |
| C17 | N16 | C12 | N11 | 14.0° | 0.0° |
| C17 | N16 | C12 | N13 | 166.1° | 180.0° |
| N16 | C17 | H21 | H22 | 108.3° | 120.0° |
| N16 | C17 | H21 | C3 | 143.3° | 120.0° |
| N16 | C17 | H22 | C3 | 143.3° | 119.9° |
| N16 | C17 | C3 | N1 | 90.0° | 180.0° |
| N16 | C17 | C3 | H23 | 90.0° | 60.0° |
| N16 | C17 | C3 | H24 | 90.0° | 60.0° |
| C25 | C24 | C23 | H15 | 120.4° | 120.1° |
| C25 | C24 | C23 | H16 | 120.4° | 119.9° |
| C24 | C25 | C26 | H13 | 120.7° | 120.0° |
| C24 | C25 | C26 | H14 | 120.7° | 120.0° |
| C25 | C24 | C23 | C22 | 55.6° | 60.0° |
| C24 | C25 | C26 | C27 | 46.8° | 60.0° |
| C24 | C25 | C26 | H11 | 167.4° | 60.0° |
| C24 | C25 | C26 | H12 | 73.8° | 180.0° |
| C24 | C25 | H13 | H14 | 117.9° | 120.0° |
| C25 | C24 | H15 | H16 | 118.7° | 120.0° |
| C25 | C24 | C23 | H17 | 175.7° | 59.9° |
| C25 | C24 | C23 | H18 | 64.6° | 180.0° |
| C23 | C24 | C25 | C26 | 50.3° | 60.0° |
| C24 | C23 | C22 | H17 | 120.2° | 119.9° |
| C24 | C23 | C22 | H18 | 120.2° | 120.0° |
| C24 | C23 | C22 | C27 | 57.1° | 60.0° |
| C24 | C23 | C22 | C21 | 173.9° | 180.0° |
| C24 | C23 | C22 | H8 | 65.0° | 60.0° |
| C23 | C24 | C25 | H13 | 70.4° | 180.0° |
| C23 | C24 | C25 | H14 | 171.0° | 60.0° |
| C23 | C24 | H15 | H16 | 118.7° | 120.0° |
| C24 | C23 | H17 | H18 | 119.5° | 120.0° |
| C25 | C26 | C27 | H11 | 120.6° | 120.0° |
| C25 | C26 | C27 | H12 | 120.6° | 120.0° |
| C25 | C26 | C27 | C22 | 49.1° | 60.0° |
| C25 | C26 | C27 | H9 | 71.5° | 180.0° |
| C25 | C26 | C27 | H10 | 169.6° | 60.0° |
| C25 | C26 | H11 | H12 | 118.2° | 120.0° |
| C26 | C25 | H13 | H14 | 117.9° | 120.0° |
| C26 | C25 | C24 | H15 | 70.1° | 60.0° |
| C26 | C25 | C24 | H16 | 170.7° | 180.0° |
| C23 | C22 | C27 | C26 | 54.2° | 60.0° |
| C23 | C22 | C27 | C21 | 118.1° | 120.0° |
| C23 | C22 | C27 | H8 | 122.0° | 120.0° |
| C23 | C22 | C21 | H8 | 121.2° | 120.0° |
| C23 | C22 | C21 | N20 | 108.0° | 65.0° |
| C23 | C22 | C21 | H6 | 12.2° | 175.0° |
| C23 | C22 | C21 | H7 | 131.8° | 55.0° |
| C23 | C22 | C27 | H9 | 66.3° | 180.0° |
| C23 | C22 | C27 | H10 | 174.7° | 60.0° |
| C22 | C23 | C24 | H15 | 64.9° | 60.0° |
| C22 | C23 | C24 | H16 | 175.9° | 179.9° |
| C22 | C23 | H17 | H18 | 119.4° | 120.1° |
| N16 | C12 | N11 | N13 | 179.8° | 180.0° |
| N16 | C12 | N11 | C9 | 179.4° | 180.0° |
| N16 | C12 | N13 | C8 | 179.0° | 180.0° |
| N16 | C12 | N11 | H19 | 0.6° | 0.0° |
| C12 | N16 | C17 | H21 | 56.8° | 60.0° |
| C12 | N16 | C17 | H22 | 170.4° | 60.0° |
| C12 | N16 | C17 | C3 | 66.4° | 180.0° |
| C26 | C27 | C22 | H9 | 120.5° | 120.0° |
| C26 | C27 | C22 | H10 | 120.5° | 120.0° |
| C26 | C27 | C22 | C21 | 172.3° | 180.0° |
| C26 | C27 | C22 | H8 | 67.8° | 60.0° |
| C26 | C27 | H9 | H10 | 118.4° | 120.0° |
| C27 | C26 | H11 | H12 | 118.2° | 120.0° |
| C27 | C26 | C25 | H13 | 73.9° | 180.0° |
| C27 | C26 | C25 | H14 | 167.4° | 60.0° |
| C27 | C22 | C21 | H8 | 120.1° | 120.0° |
| C27 | C22 | C21 | N20 | 133.3° | 175.0° |
| C27 | C22 | C21 | H6 | 106.5° | 55.0° |
| C27 | C22 | C21 | H7 | 13.1° | 65.0° |
| C22 | C27 | H9 | H10 | 118.3° | 120.0° |
| C22 | C27 | C26 | H11 | 169.7° | 60.0° |
| C22 | C27 | C26 | H12 | 71.5° | 180.0° |
| C27 | C22 | C23 | H17 | 177.3° | 59.9° |
| C27 | C22 | C23 | H18 | 63.1° | 180.0° |
| C22 | C21 | N20 | H6 | 120.2° | 120.0° |
| C22 | C21 | N20 | H7 | 120.2° | 120.0° |
| C22 | C21 | N20 | C19 | 169.4° | 180.0° |
| C22 | C21 | H6 | H7 | 119.4° | 120.0° |
| C21 | C22 | C27 | H9 | 51.8° | 60.0° |
| C21 | C22 | C27 | H10 | 67.2° | 60.0° |
| C21 | C22 | C23 | H17 | 65.9° | 60.1° |
| C21 | C22 | C23 | H18 | 53.7° | 60.0° |
| C22 | C21 | N20 | H27 | 69.6° | 56.0° |
| C12 | N11 | C9 | H19 | 180.0° | 180.0° |
| N11 | C12 | N13 | C8 | 1.1° | 0.0° |
| C12 | N11 | C9 | C8 | 1.8° | 0.0° |
| C12 | N11 | C9 | C10 | 177.1° | 179.9° |
| N11 | C12 | N16 | H20 | 107.7° | 180.0° |
| N13 | C12 | N11 | C9 | 0.4° | 0.0° |
| C12 | N13 | C8 | C9 | 2.3° | 0.0° |
| C12 | N13 | C8 | C7 | 178.0° | 180.0° |
| N13 | C12 | N11 | H19 | 179.6° | 180.0° |
| N13 | C12 | N16 | H20 | 72.1° | 0.0° |
| N11 | C9 | C8 | N13 | 2.5° | 0.0° |
| N11 | C9 | C8 | C10 | 175.8° | 179.9° |
| N11 | C9 | C10 | C18 | 7.7° | 0.1° |
| N11 | C9 | C8 | C7 | 177.7° | 180.0° |
| N11 | C9 | C10 | C6 | 176.6° | 180.0° |
| C21 | N20 | C19 | H27 | 121.0° | 124.0° |
| C21 | N20 | C19 | C18 | 14.6° | 180.0° |
| C21 | N20 | C19 | H5 | 106.4° | 60.0° |
| N20 | C21 | H6 | H7 | 119.3° | 120.0° |
| N20 | C21 | C22 | H8 | 13.2° | 55.0° |
| C21 | N20 | C19 | H26 | 135.5° | 60.0° |
| N20 | C19 | C18 | H5 | 120.9° | 120.0° |
| N20 | C19 | C18 | H26 | 121.0° | 120.0° |
| N20 | C19 | C18 | C10 | 166.9° | 180.0° |
| N20 | C19 | C18 | H3 | 46.5° | 60.0° |
| N20 | C19 | C18 | H4 | 72.7° | 60.0° |
| N20 | C19 | H5 | H26 | 117.1° | 119.9° |
| C19 | N20 | C21 | H6 | 49.2° | 60.0° |
| C19 | N20 | C21 | H7 | 70.4° | 60.0° |
| N13 | C8 | C9 | C7 | 179.8° | 180.0° |
| N13 | C8 | C9 | C10 | 178.3° | 180.0° |
| N13 | C8 | C7 | C1 | 179.1° | 180.0° |
| N13 | C8 | C7 | H25 | 0.9° | 0.0° |
| C19 | C18 | C10 | C9 | 63.7° | 90.1° |
| C19 | C18 | C10 | H3 | 120.4° | 120.0° |
| C19 | C18 | C10 | H4 | 120.4° | 119.9° |
| C19 | C18 | C10 | C6 | 111.9° | 90.0° |
| C19 | C18 | H3 | H4 | 118.9° | 120.0° |
| C18 | C19 | H5 | H26 | 117.1° | 120.0° |
| C18 | C19 | N20 | H27 | 135.6° | 56.1° |
| C8 | C9 | C10 | C18 | 177.7° | 180.0° |
| C8 | C9 | C10 | C6 | 2.0° | 0.1° |
| C9 | C8 | C7 | C1 | 1.2° | 0.0° |
| C8 | C9 | N11 | H19 | 178.2° | 180.0° |
| C9 | C8 | C7 | H25 | 178.8° | 180.0° |
| C9 | C10 | C18 | C6 | 175.6° | 180.0° |
| C10 | C9 | C8 | C7 | 1.9° | 0.0° |
| C9 | C10 | C6 | C1 | 1.3° | 0.0° |
| C9 | C10 | C6 | N5 | 178.2° | 179.4° |
| C9 | C10 | C18 | H3 | 56.7° | 30.0° |
| C9 | C10 | C18 | H4 | 175.9° | 150.0° |
| C10 | C9 | N11 | H19 | 2.9° | 0.1° |
| C18 | C10 | C6 | C1 | 177.0° | 180.0° |
| C18 | C10 | C6 | N5 | 2.5° | 0.6° |
| C10 | C18 | H3 | H4 | 118.9° | 120.0° |
| C10 | C18 | C19 | H5 | 72.1° | 60.0° |
| C10 | C18 | C19 | H26 | 46.0° | 60.1° |
| C8 | C7 | C1 | H25 | 180.0° | 180.0° |
| C8 | C7 | C1 | C6 | 0.6° | 0.0° |
| C8 | C7 | C1 | C2 | 179.9° | 180.0° |
| C10 | C6 | C1 | C7 | 0.7° | 0.0° |
| C10 | C6 | C1 | N5 | 179.5° | 179.4° |
| C10 | C6 | C1 | C2 | 179.8° | 180.0° |
| C10 | C6 | N5 | C4 | 179.7° | 179.7° |
| C6 | C10 | C18 | H3 | 127.7° | 150.0° |
| C6 | C10 | C18 | H4 | 8.5° | 30.0° |
| C7 | C1 | C6 | C2 | 179.5° | 180.0° |
| C7 | C1 | C6 | N5 | 178.8° | 179.5° |
| C7 | C1 | C2 | O14 | 1.6° | 0.2° |
| C7 | C1 | C2 | N3 | 179.5° | 179.5° |
| C1 | C6 | N5 | C4 | 0.8° | 0.3° |
| C6 | C1 | C2 | O14 | 178.9° | 179.7° |
| C6 | C1 | C2 | N3 | 1.0° | 0.6° |
| C6 | C1 | C7 | H25 | 179.4° | 180.0° |
| N5 | C6 | C1 | C2 | 0.7° | 0.6° |
| C6 | N5 | C4 | N3 | 0.9° | 0.0° |
| C6 | N5 | C4 | H2 | 179.0° | 180.0° |
| C1 | C2 | O14 | N3 | 177.8° | 179.7° |
| C1 | C2 | N3 | C4 | 2.5° | 0.3° |
| C1 | C2 | N3 | H1 | 177.5° | 179.7° |
| C2 | C1 | C7 | H25 | 0.0° | 0.0° |
| N5 | C4 | N3 | C2 | 2.7° | 0.0° |
| N5 | C4 | N3 | H2 | 180.0° | 179.9° |
| N5 | C4 | N3 | H1 | 177.3° | 180.0° |
| O14 | C2 | N3 | C4 | 179.5° | 180.0° |
| O14 | C2 | N3 | H1 | 0.5° | 0.0° |
| C2 | N3 | C4 | H1 | 180.0° | 180.0° |
| C2 | N3 | C4 | H2 | 177.3° | 180.0° |
| H1 | N3 | C4 | H2 | 2.7° | 0.1° |
| H3 | C18 | C19 | H5 | 167.5° | 180.0° |
| H3 | C18 | C19 | H26 | 74.4° | 60.0° |
| H4 | C18 | C19 | H5 | 48.2° | 60.0° |
| H4 | C18 | C19 | H26 | 166.4° | 180.0° |
| H5 | C19 | N20 | H27 | 14.7° | 63.9° |
| H6 | C21 | C22 | H8 | 133.4° | 65.0° |
| H6 | C21 | N20 | H27 | 170.2° | 63.9° |
| H7 | C21 | C22 | H8 | 107.0° | 175.0° |
| H7 | C21 | N20 | H27 | 50.7° | 176.1° |
| H8 | C22 | C27 | H9 | 171.7° | 60.0° |
| H8 | C22 | C27 | H10 | 52.7° | 180.0° |
| H8 | C22 | C23 | H17 | 55.2° | 179.9° |
| H8 | C22 | C23 | H18 | 174.8° | 60.0° |
| H9 | C27 | C26 | H11 | 49.2° | 60.0° |
| H9 | C27 | C26 | H12 | 168.0° | 60.0° |
| H10 | C27 | C26 | H11 | 69.8° | 180.0° |
| H10 | C27 | C26 | H12 | 49.0° | 60.0° |
| H11 | C26 | C25 | H13 | 46.7° | 60.0° |
| H11 | C26 | C25 | H14 | 72.0° | 180.0° |
| H12 | C26 | C25 | H13 | 165.5° | 60.0° |
| H12 | C26 | C25 | H14 | 46.9° | 60.0° |
| H13 | C25 | C24 | H15 | 169.2° | 60.0° |
| H13 | C25 | C24 | H16 | 50.0° | 60.0° |
| H14 | C25 | C24 | H15 | 50.6° | 180.0° |
| H14 | C25 | C24 | H16 | 68.6° | 60.0° |
| H15 | C24 | C23 | H17 | 55.3° | 180.0° |
| H15 | C24 | C23 | H18 | 174.9° | 60.0° |
| H16 | C24 | C23 | H17 | 63.9° | 60.0° |
| H16 | C24 | C23 | H18 | 55.8° | 60.0° |
| H20 | N16 | C17 | H21 | 178.6° | 120.0° |
| H20 | N16 | C17 | H22 | 67.9° | 120.0° |
| H20 | N16 | C17 | C3 | 55.4° | 0.0° |
| H21 | C17 | H22 | C3 | 108.4° | 120.0° |
| H21 | C17 | C3 | N1 | 90.0° | 60.0° |
| H21 | C17 | C3 | H23 | 90.0° | 180.0° |
| H21 | C17 | C3 | H24 | 90.0° | 60.0° |
| H22 | C17 | C3 | N1 | 90.0° | 60.0° |
| H22 | C17 | C3 | H23 | 90.0° | 59.9° |
| H22 | C17 | C3 | H24 | 90.0° | 180.0° |
| C17 | C3 | N1 | H23 | 90.0° | 120.0° |
| C17 | C3 | N1 | H24 | 90.0° | 120.0° |
| C17 | C3 | N1 | C11 | 90.0° | 170.0° |
| C17 | C3 | N1 | C16 | 90.0° | 46.3° |
| C17 | C3 | H23 | H24 | 90.0° | 120.0° |
| C3 | N1 | C11 | C16 | 90.0° | 123.8° |
| C3 | N1 | C11 | C13 | 90.0° | 177.6° |
| C3 | N1 | C16 | C15 | 90.0° | 177.6° |
| N1 | C3 | H23 | H24 | 90.0° | 120.0° |
| C3 | N1 | C11 | H28 | 90.0° | 62.5° |
| C3 | N1 | C11 | H29 | 90.0° | 57.6° |
| C3 | N1 | C16 | H34 | 90.0° | 57.6° |
| C3 | N1 | C16 | H35 | 90.0° | 62.5° |
| N1 | C11 | C13 | H28 | 90.0° | 119.9° |
| N1 | C11 | C13 | H29 | 90.0° | 120.0° |
| N1 | C11 | C13 | O1 | 90.0° | 56.8° |
| C11 | N1 | C16 | C15 | 90.0° | 58.6° |
| C11 | N1 | C3 | H23 | 90.0° | 50.0° |
| C11 | N1 | C3 | H24 | 90.0° | 69.9° |
| N1 | C11 | H28 | H29 | 90.0° | 120.2° |
| N1 | C11 | C13 | H30 | 90.0° | 176.8° |
| N1 | C11 | C13 | H31 | 90.0° | 63.2° |
| C11 | N1 | C16 | H34 | 90.0° | 178.5° |
| C11 | N1 | C16 | H35 | 90.0° | 61.3° |
| C11 | C13 | O1 | H30 | 90.0° | 119.9° |
| C11 | C13 | O1 | H31 | 90.0° | 119.9° |
| C11 | C13 | O1 | C15 | 90.0° | 58.6° |
| C13 | C11 | N1 | C16 | 90.0° | 58.6° |
| C13 | C11 | H28 | H29 | 90.0° | 120.1° |
| C11 | C13 | H30 | H31 | 90.0° | 120.1° |
| C13 | O1 | C15 | C16 | 90.0° | 58.7° |
| O1 | C13 | C11 | H28 | 90.0° | 63.1° |
| O1 | C13 | C11 | H29 | 90.0° | 176.8° |
| O1 | C13 | H30 | H31 | 90.0° | 120.1° |
| C13 | O1 | C15 | H32 | 90.0° | 178.6° |
| C13 | O1 | C15 | H33 | 90.0° | 61.3° |
| O1 | C15 | C16 | H32 | 90.0° | 120.0° |
| O1 | C15 | C16 | H33 | 90.0° | 119.9° |
| O1 | C15 | C16 | N1 | 90.0° | 56.8° |
| C15 | O1 | C13 | H30 | 90.0° | 178.6° |
| C15 | O1 | C13 | H31 | 90.0° | 61.3° |
| O1 | C15 | H32 | H33 | 90.0° | 120.1° |
| O1 | C15 | C16 | H34 | 90.0° | 176.7° |
| O1 | C15 | C16 | H35 | 90.0° | 63.1° |
| C15 | C16 | N1 | H34 | 90.0° | 119.9° |
| C15 | C16 | N1 | H35 | 90.0° | 119.9° |
| C16 | C15 | H32 | H33 | 90.0° | 120.1° |
| C15 | C16 | H34 | H35 | 90.0° | 120.1° |
| C16 | N1 | C3 | H23 | 90.0° | 73.7° |
| C16 | N1 | C3 | H24 | 90.0° | 166.4° |
| C16 | N1 | C11 | H28 | 90.0° | 61.3° |
| C16 | N1 | C11 | H29 | 90.0° | 178.6° |
| N1 | C16 | C15 | H32 | 90.0° | 176.8° |
| N1 | C16 | C15 | H33 | 90.0° | 63.1° |
| N1 | C16 | H34 | H35 | 90.0° | 120.1° |
| H26 | C19 | N20 | H27 | 103.4° | 176.1° |
| H28 | C11 | C13 | H30 | 90.0° | 56.9° |
| H28 | C11 | C13 | H31 | 90.0° | 176.9° |
| H29 | C11 | C13 | H30 | 90.0° | 63.3° |
| H29 | C11 | C13 | H31 | 90.0° | 56.8° |
| H32 | C15 | C16 | H34 | 90.0° | 63.3° |
| H32 | C15 | C16 | H35 | 90.0° | 56.9° |
| H33 | C15 | C16 | H34 | 90.0° | 56.8° |
| H33 | C15 | C16 | H35 | 90.0° | 177.0° |
