2P5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C5 | N3 | doub | 1.30Å | 1.42Å | Aromatic |
| C5 | N4 | sing | 1.35Å | 1.34Å | Aromatic |
| N3 | C2 | sing | 1.35Å | 1.38Å | Aromatic |
| N4 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
| C3 | C2 | doub | 1.41Å | 1.41Å | Aromatic |
| C3 | C4 | sing | 1.40Å | 1.42Å | Aromatic |
| C2 | N2 | sing | 1.33Å | 1.37Å | Aromatic |
| N2 | C1 | doub | 1.32Å | 1.36Å | Aromatic |
| C34 | C31 | sing | 1.53Å | 1.53Å | |
| C4 | N5 | sing | 1.39Å | 1.36Å | |
| C4 | N1 | doub | 1.33Å | 1.36Å | Aromatic |
| N5 | C6 | sing | 1.39Å | 1.43Å | |
| C33 | C31 | sing | 1.53Å | 1.53Å | |
| C26 | C13 | sing | 1.51Å | 1.52Å | |
| C7 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.41Å | Aromatic |
| C1 | N1 | sing | 1.33Å | 1.40Å | Aromatic |
| C1 | C12 | sing | 1.48Å | 1.49Å | |
| C31 | C22 | sing | 1.51Å | 1.55Å | |
| C31 | C32 | sing | 1.53Å | 1.53Å | |
| C6 | C11 | sing | 1.39Å | 1.43Å | Aromatic |
| C23 | C22 | doub | 1.38Å | 1.41Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.40Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C24 | C19 | doub | 1.40Å | 1.39Å | Aromatic |
| C8 | C9 | doub | 1.40Å | 1.39Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C12 | doub | 1.39Å | 1.43Å | Aromatic |
| C13 | C14 | sing | 1.39Å | 1.42Å | Aromatic |
| C12 | C17 | sing | 1.39Å | 1.43Å | Aromatic |
| C29 | C30 | sing | 1.53Å | 1.51Å | |
| C29 | O3 | sing | 1.43Å | 1.43Å | |
| C19 | C20 | sing | 1.40Å | 1.40Å | Aromatic |
| C19 | C18 | sing | 1.48Å | 1.51Å | |
| C11 | C10 | doub | 1.38Å | 1.41Å | Aromatic |
| O1 | C18 | doub | 1.22Å | 1.23Å | |
| C18 | N6 | sing | 1.35Å | 1.38Å | |
| C30 | N7 | sing | 1.47Å | 1.48Å | |
| N6 | C14 | sing | 1.40Å | 1.43Å | |
| C9 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C9 | C25 | sing | 1.48Å | 1.51Å | |
| C14 | C15 | doub | 1.39Å | 1.41Å | Aromatic |
| O3 | C28 | sing | 1.43Å | 1.43Å | |
| C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| N7 | C25 | sing | 1.35Å | 1.44Å | |
| N7 | C27 | sing | 1.47Å | 1.48Å | |
| C25 | O2 | doub | 1.22Å | 1.23Å | |
| C28 | C27 | sing | 1.53Å | 1.51Å | |
| C15 | C16 | sing | 1.38Å | 1.43Å | Aromatic |
| C16 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.08Å | 1.08Å | |
| C20 | H3 | sing | 1.08Å | 1.08Å | |
| C24 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å | |
| C10 | H6 | sing | 1.08Å | 1.08Å | |
| C21 | H7 | sing | 1.08Å | 1.08Å | |
| C23 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C7 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C5 | H12 | sing | 1.08Å | 1.08Å | |
| C27 | H13 | sing | 1.09Å | 1.10Å | |
| C27 | H14 | sing | 1.09Å | 1.10Å | |
| C30 | H15 | sing | 1.09Å | 1.10Å | |
| C30 | H16 | sing | 1.09Å | 1.10Å | |
| C28 | H17 | sing | 1.09Å | 1.10Å | |
| C28 | H18 | sing | 1.09Å | 1.10Å | |
| C29 | H19 | sing | 1.09Å | 1.10Å | |
| C29 | H20 | sing | 1.09Å | 1.10Å | |
| C26 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C32 | H24 | sing | 1.09Å | 1.10Å | |
| C32 | H25 | sing | 1.09Å | 1.10Å | |
| C32 | H26 | sing | 1.09Å | 1.10Å | |
| C33 | H27 | sing | 1.09Å | 1.10Å | |
| C33 | H28 | sing | 1.09Å | 1.10Å | |
| C33 | H29 | sing | 1.09Å | 1.10Å | |
| C34 | H30 | sing | 1.09Å | 1.10Å | |
| C34 | H31 | sing | 1.09Å | 1.10Å | |
| C34 | H32 | sing | 1.09Å | 1.10Å | |
| N4 | H33 | sing | 0.97Å | 1.00Å | |
| N5 | H35 | sing | 0.97Å | 1.00Å | |
| N6 | H36 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N3 | C5 | N4 | 111.7° | 110.1° |
| C5 | N3 | C2 | 106.2° | 109.8° |
| N3 | C5 | H12 | 124.2° | 124.9° |
| C5 | N4 | C3 | 105.3° | 107.2° |
| N4 | C5 | H12 | 124.1° | 125.0° |
| C5 | N4 | H33 | 127.3° | 126.4° |
| N3 | C2 | C3 | 106.2° | 106.8° |
| N3 | C2 | N2 | 128.7° | 134.5° |
| N4 | C3 | C2 | 110.6° | 106.1° |
| N4 | C3 | C4 | 132.5° | 135.2° |
| C3 | N4 | H33 | 127.4° | 126.4° |
| C2 | C3 | C4 | 117.0° | 118.7° |
| C3 | C2 | N2 | 125.1° | 118.7° |
| C3 | C4 | N5 | 116.6° | 120.7° |
| C3 | C4 | N1 | 120.5° | 118.6° |
| C2 | N2 | C1 | 112.8° | 120.5° |
| N2 | C1 | N1 | 128.0° | 122.3° |
| N2 | C1 | C12 | 116.5° | 118.9° |
| C34 | C31 | C33 | 104.6° | 109.4° |
| C34 | C31 | C22 | 113.2° | 109.5° |
| C34 | C31 | C32 | 107.8° | 109.5° |
| C31 | C34 | H30 | 109.5° | 109.4° |
| C31 | C34 | H31 | 109.4° | 109.5° |
| C31 | C34 | H32 | 109.5° | 109.5° |
| N5 | C4 | N1 | 122.8° | 120.7° |
| C4 | N5 | C6 | 130.2° | 120.0° |
| C4 | N5 | H35 | 114.9° | 120.0° |
| C4 | N1 | C1 | 116.7° | 121.1° |
| N5 | C6 | C7 | 118.8° | 119.9° |
| N5 | C6 | C11 | 121.2° | 120.0° |
| C6 | N5 | H35 | 114.9° | 120.0° |
| C33 | C31 | C22 | 113.0° | 109.5° |
| C33 | C31 | C32 | 108.3° | 109.5° |
| C31 | C33 | H27 | 109.5° | 109.5° |
| C31 | C33 | H28 | 109.4° | 109.5° |
| C31 | C33 | H29 | 109.5° | 109.5° |
| C26 | C13 | C12 | 122.3° | 120.1° |
| C26 | C13 | C14 | 119.9° | 120.2° |
| C13 | C26 | H21 | 109.5° | 109.5° |
| C13 | C26 | H22 | 109.5° | 109.5° |
| C13 | C26 | H23 | 109.5° | 109.5° |
| C6 | C7 | C8 | 120.0° | 120.1° |
| C7 | C6 | C11 | 120.0° | 120.1° |
| C6 | C7 | H10 | 120.0° | 119.9° |
| C7 | C8 | C9 | 120.2° | 119.9° |
| C7 | C8 | H5 | 119.9° | 120.0° |
| C8 | C7 | H10 | 120.0° | 120.0° |
| N1 | C1 | C12 | 115.5° | 118.9° |
| C1 | C12 | C13 | 122.3° | 120.1° |
| C1 | C12 | C17 | 117.1° | 120.1° |
| C22 | C31 | C32 | 109.6° | 109.5° |
| C31 | C22 | C23 | 122.9° | 119.9° |
| C31 | C22 | C21 | 120.3° | 119.8° |
| C31 | C32 | H24 | 109.5° | 109.5° |
| C31 | C32 | H25 | 109.5° | 109.5° |
| C31 | C32 | H26 | 109.5° | 109.4° |
| C6 | C11 | C10 | 119.1° | 120.0° |
| C6 | C11 | H11 | 120.4° | 120.0° |
| C22 | C23 | C24 | 122.4° | 120.1° |
| C23 | C22 | C21 | 116.9° | 120.3° |
| C22 | C23 | H8 | 118.8° | 120.0° |
| C23 | C24 | C19 | 119.4° | 119.9° |
| C23 | C24 | H4 | 120.3° | 120.1° |
| C24 | C23 | H8 | 118.8° | 119.9° |
| C22 | C21 | C20 | 121.3° | 120.1° |
| C22 | C21 | H7 | 119.3° | 119.9° |
| C24 | C19 | C20 | 119.5° | 119.7° |
| C24 | C19 | C18 | 121.3° | 120.1° |
| C19 | C24 | H4 | 120.4° | 120.1° |
| C8 | C9 | C10 | 120.7° | 119.9° |
| C8 | C9 | C25 | 119.8° | 120.0° |
| C9 | C8 | H5 | 119.9° | 120.1° |
| C21 | C20 | C19 | 120.6° | 119.8° |
| C21 | C20 | H3 | 119.7° | 120.0° |
| C20 | C21 | H7 | 119.4° | 120.0° |
| C12 | C13 | C14 | 117.7° | 119.7° |
| C13 | C12 | C17 | 120.7° | 119.9° |
| C13 | C14 | N6 | 115.4° | 120.0° |
| C13 | C14 | C15 | 121.7° | 120.0° |
| C12 | C17 | C16 | 120.3° | 120.0° |
| C12 | C17 | H2 | 119.9° | 120.0° |
| C30 | C29 | O3 | 111.7° | 109.2° |
| C29 | C30 | N7 | 109.9° | 108.4° |
| C29 | C30 | H15 | 109.4° | 109.7° |
| C29 | C30 | H16 | 109.4° | 109.7° |
| C30 | C29 | H19 | 108.9° | 109.6° |
| C30 | C29 | H20 | 108.9° | 109.5° |
| C29 | O3 | C28 | 110.2° | 114.2° |
| O3 | C29 | H19 | 108.9° | 109.5° |
| O3 | C29 | H20 | 108.9° | 109.5° |
| C20 | C19 | C18 | 119.0° | 120.1° |
| C19 | C20 | H3 | 119.7° | 120.1° |
| C19 | C18 | O1 | 122.9° | 120.0° |
| C19 | C18 | N6 | 115.6° | 120.0° |
| C11 | C10 | C9 | 119.9° | 120.0° |
| C11 | C10 | H6 | 120.0° | 120.0° |
| C10 | C11 | H11 | 120.5° | 120.0° |
| O1 | C18 | N6 | 121.6° | 120.0° |
| C18 | N6 | C14 | 124.2° | 120.1° |
| C18 | N6 | H36 | 117.9° | 120.0° |
| C30 | N7 | C25 | 124.2° | 120.9° |
| C30 | N7 | C27 | 114.3° | 118.1° |
| N7 | C30 | H15 | 109.4° | 109.7° |
| N7 | C30 | H16 | 109.4° | 109.6° |
| N6 | C14 | C15 | 122.9° | 120.0° |
| C14 | N6 | H36 | 117.9° | 120.0° |
| C10 | C9 | C25 | 119.5° | 120.1° |
| C9 | C10 | H6 | 120.0° | 120.0° |
| C9 | C25 | N7 | 122.3° | 120.0° |
| C9 | C25 | O2 | 117.3° | 120.0° |
| C14 | C15 | C16 | 119.5° | 120.2° |
| C14 | C15 | H9 | 120.3° | 119.9° |
| O3 | C28 | C27 | 111.5° | 109.2° |
| O3 | C28 | H17 | 109.0° | 109.5° |
| O3 | C28 | H18 | 109.0° | 109.5° |
| C17 | C16 | C15 | 120.1° | 120.2° |
| C17 | C16 | H1 | 120.0° | 119.9° |
| C16 | C17 | H2 | 119.9° | 120.0° |
| C25 | N7 | C27 | 121.3° | 121.0° |
| N7 | C25 | O2 | 120.4° | 120.0° |
| N7 | C27 | C28 | 109.9° | 108.5° |
| N7 | C27 | H13 | 109.3° | 109.6° |
| N7 | C27 | H14 | 109.4° | 109.7° |
| C28 | C27 | H13 | 109.4° | 109.7° |
| C28 | C27 | H14 | 109.4° | 109.7° |
| C27 | C28 | H17 | 108.9° | 109.4° |
| C27 | C28 | H18 | 108.9° | 109.5° |
| C15 | C16 | H1 | 120.0° | 119.9° |
| C16 | C15 | H9 | 120.2° | 119.9° |
| H13 | C27 | H14 | 109.4° | 109.7° |
| H15 | C30 | H16 | 109.5° | 109.7° |
| H17 | C28 | H18 | 109.5° | 109.6° |
| H19 | C29 | H20 | 109.5° | 109.5° |
| H21 | C26 | H22 | 109.5° | 109.4° |
| H21 | C26 | H23 | 109.4° | 109.5° |
| H22 | C26 | H23 | 109.5° | 109.5° |
| H24 | C32 | H25 | 109.5° | 109.5° |
| H24 | C32 | H26 | 109.4° | 109.5° |
| H25 | C32 | H26 | 109.5° | 109.5° |
| H27 | C33 | H28 | 109.5° | 109.5° |
| H27 | C33 | H29 | 109.5° | 109.4° |
| H28 | C33 | H29 | 109.5° | 109.5° |
| H30 | C34 | H31 | 109.5° | 109.5° |
| H30 | C34 | H32 | 109.5° | 109.5° |
| H31 | C34 | H32 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N3 | C5 | N4 | H12 | 180.0° | 179.7° |
| N3 | C5 | N4 | C3 | 0.6° | 0.0° |
| C5 | N3 | C2 | C3 | 0.6° | 0.0° |
| C5 | N3 | C2 | N2 | 179.3° | 180.0° |
| N3 | C5 | N4 | H33 | 179.5° | 180.0° |
| N4 | C5 | N3 | C2 | 0.0° | 0.0° |
| C5 | N4 | C3 | H33 | 180.0° | 180.0° |
| C5 | N4 | C3 | C2 | 0.9° | 0.0° |
| C5 | N4 | C3 | C4 | 178.4° | 180.0° |
| N3 | C2 | C3 | N4 | 0.9° | 0.0° |
| N3 | C2 | C3 | N2 | 178.8° | 180.0° |
| N3 | C2 | C3 | C4 | 178.5° | 180.0° |
| N3 | C2 | N2 | C1 | 176.8° | 180.0° |
| C2 | N3 | C5 | H12 | 180.0° | 179.7° |
| N4 | C3 | C2 | C4 | 179.4° | 180.0° |
| N4 | C3 | C2 | N2 | 179.7° | 180.0° |
| N4 | C3 | C4 | N5 | 5.9° | 0.0° |
| N4 | C3 | C4 | N1 | 177.7° | 180.0° |
| C3 | N4 | C5 | H12 | 179.4° | 179.7° |
| C3 | C2 | N2 | C1 | 1.7° | 0.0° |
| C2 | C3 | C4 | N5 | 174.9° | 180.0° |
| C2 | C3 | C4 | N1 | 1.5° | 0.0° |
| C2 | C3 | N4 | H33 | 179.1° | 180.0° |
| C4 | C3 | C2 | N2 | 0.3° | 0.0° |
| C3 | C4 | N5 | N1 | 176.3° | 179.9° |
| C3 | C4 | N5 | C6 | 177.4° | 176.1° |
| C3 | C4 | N1 | C1 | 1.7° | 0.0° |
| C4 | C3 | N4 | H33 | 1.6° | 0.0° |
| C3 | C4 | N5 | H35 | 2.6° | 3.8° |
| C2 | N2 | C1 | N1 | 1.6° | 0.0° |
| C2 | N2 | C1 | C12 | 178.6° | 180.0° |
| N2 | C1 | N1 | C4 | 0.0° | 0.0° |
| N2 | C1 | N1 | C12 | 179.8° | 180.0° |
| N2 | C1 | C12 | C13 | 41.8° | 49.3° |
| N2 | C1 | C12 | C17 | 136.9° | 130.8° |
| C34 | C31 | C33 | C22 | 123.7° | 120.0° |
| C34 | C31 | C33 | C32 | 114.7° | 120.0° |
| C34 | C31 | C22 | C32 | 120.4° | 120.0° |
| C34 | C31 | C22 | C23 | 29.0° | 180.0° |
| C34 | C31 | C22 | C21 | 151.2° | 0.2° |
| C34 | C31 | C32 | H24 | 180.0° | 60.0° |
| C34 | C31 | C32 | H25 | 60.0° | 60.0° |
| C34 | C31 | C32 | H26 | 60.0° | 180.0° |
| C34 | C31 | C33 | H27 | 180.0° | 60.0° |
| C34 | C31 | C33 | H28 | 60.0° | 180.0° |
| C34 | C31 | C33 | H29 | 60.0° | 60.0° |
| C31 | C34 | H30 | H31 | 120.0° | 120.0° |
| C31 | C34 | H30 | H32 | 120.0° | 120.0° |
| C31 | C34 | H31 | H32 | 120.0° | 120.0° |
| C4 | N5 | C6 | H35 | 180.0° | 179.9° |
| C4 | N5 | C6 | C7 | 177.3° | 35.2° |
| N5 | C4 | N1 | C1 | 174.5° | 180.0° |
| C4 | N5 | C6 | C11 | 0.6° | 144.7° |
| N1 | C4 | N5 | C6 | 1.1° | 4.0° |
| C4 | N1 | C1 | C12 | 179.8° | 180.0° |
| N1 | C4 | N5 | H35 | 178.9° | 176.2° |
| N5 | C6 | C7 | C11 | 177.9° | 179.9° |
| N5 | C6 | C7 | C8 | 178.8° | 180.0° |
| N5 | C6 | C11 | C10 | 177.5° | 179.7° |
| N5 | C6 | C7 | H10 | 1.1° | 0.1° |
| N5 | C6 | C11 | H11 | 2.5° | 0.4° |
| C33 | C31 | C22 | C32 | 120.9° | 120.0° |
| C33 | C31 | C22 | C23 | 147.8° | 60.0° |
| C33 | C31 | C22 | C21 | 32.4° | 119.7° |
| C33 | C31 | C32 | H24 | 67.3° | 60.0° |
| C33 | C31 | C32 | H25 | 172.7° | 180.0° |
| C33 | C31 | C32 | H26 | 52.6° | 60.0° |
| C31 | C33 | H27 | H28 | 120.0° | 120.0° |
| C31 | C33 | H27 | H29 | 120.0° | 120.0° |
| C31 | C33 | H28 | H29 | 120.0° | 120.0° |
| C33 | C31 | C34 | H30 | 180.0° | 60.0° |
| C33 | C31 | C34 | H31 | 60.0° | 180.0° |
| C33 | C31 | C34 | H32 | 60.0° | 60.0° |
| C26 | C13 | C12 | C1 | 5.9° | 0.0° |
| C26 | C13 | C12 | C14 | 176.9° | 179.7° |
| C26 | C13 | C12 | C17 | 175.4° | 180.0° |
| C26 | C13 | C14 | N6 | 7.6° | 0.3° |
| C26 | C13 | C14 | C15 | 174.5° | 179.9° |
| C13 | C26 | H21 | H22 | 120.0° | 120.0° |
| C13 | C26 | H21 | H23 | 120.0° | 120.0° |
| C13 | C26 | H22 | H23 | 120.0° | 120.0° |
| C6 | C7 | C8 | H10 | 180.0° | 179.9° |
| C6 | C7 | C8 | C9 | 0.7° | 0.1° |
| C7 | C6 | C11 | C10 | 0.4° | 0.2° |
| C6 | C7 | C8 | H5 | 179.3° | 179.7° |
| C7 | C6 | C11 | H11 | 179.6° | 179.7° |
| C7 | C6 | N5 | H35 | 2.7° | 144.9° |
| C8 | C7 | C6 | C11 | 0.9° | 0.1° |
| C7 | C8 | C9 | H5 | 180.0° | 179.8° |
| C7 | C8 | C9 | C10 | 0.9° | 0.2° |
| C7 | C8 | C9 | C25 | 177.2° | 179.8° |
| N1 | C1 | C12 | C13 | 138.4° | 130.7° |
| N1 | C1 | C12 | C17 | 42.9° | 49.3° |
| C1 | C12 | C13 | C17 | 178.7° | 180.0° |
| C1 | C12 | C13 | C14 | 177.2° | 179.7° |
| C1 | C12 | C17 | C16 | 178.9° | 179.9° |
| C1 | C12 | C17 | H2 | 1.1° | 0.0° |
| C31 | C22 | C23 | C21 | 179.8° | 179.7° |
| C31 | C22 | C23 | C24 | 179.8° | 179.9° |
| C31 | C22 | C21 | C20 | 179.4° | 179.7° |
| C31 | C22 | C21 | H7 | 0.6° | 0.2° |
| C31 | C22 | C23 | H8 | 0.2° | 0.3° |
| C22 | C31 | C32 | H24 | 56.4° | 180.0° |
| C22 | C31 | C32 | H25 | 63.6° | 60.0° |
| C22 | C31 | C32 | H26 | 176.4° | 60.0° |
| C22 | C31 | C33 | H27 | 56.3° | 180.0° |
| C22 | C31 | C33 | H28 | 176.3° | 60.0° |
| C22 | C31 | C33 | H29 | 63.7° | 60.0° |
| C22 | C31 | C34 | H30 | 56.4° | 60.0° |
| C22 | C31 | C34 | H31 | 63.6° | 60.0° |
| C22 | C31 | C34 | H32 | 176.5° | 180.0° |
| C32 | C31 | C22 | C23 | 91.3° | 60.0° |
| C32 | C31 | C22 | C21 | 88.4° | 120.2° |
| C31 | C32 | H24 | H25 | 120.0° | 120.0° |
| C31 | C32 | H24 | H26 | 120.0° | 119.9° |
| C31 | C32 | H25 | H26 | 120.0° | 119.9° |
| C32 | C31 | C33 | H27 | 65.3° | 60.0° |
| C32 | C31 | C33 | H28 | 54.7° | 60.0° |
| C32 | C31 | C33 | H29 | 174.7° | 180.0° |
| C32 | C31 | C34 | H30 | 64.9° | 180.0° |
| C32 | C31 | C34 | H31 | 175.1° | 60.0° |
| C32 | C31 | C34 | H32 | 55.1° | 60.0° |
| C6 | C11 | C10 | H11 | 180.0° | 179.9° |
| C6 | C11 | C10 | C9 | 1.9° | 0.4° |
| C6 | C11 | C10 | H6 | 178.1° | 179.9° |
| C11 | C6 | C7 | H10 | 179.1° | 180.0° |
| C11 | C6 | N5 | H35 | 179.4° | 35.2° |
| C22 | C23 | C24 | H8 | 180.0° | 179.8° |
| C22 | C23 | C24 | C19 | 1.2° | 0.2° |
| C23 | C22 | C21 | C20 | 0.8° | 0.0° |
| C22 | C23 | C24 | H4 | 178.8° | 179.7° |
| C23 | C22 | C21 | H7 | 179.2° | 180.0° |
| C24 | C23 | C22 | C21 | 0.0° | 0.2° |
| C23 | C24 | C19 | H4 | 180.0° | 179.9° |
| C23 | C24 | C19 | C20 | 1.6° | 0.1° |
| C23 | C24 | C19 | C18 | 173.5° | 180.0° |
| C22 | C21 | C20 | H7 | 180.0° | 179.9° |
| C22 | C21 | C20 | C19 | 0.4° | 0.3° |
| C22 | C21 | C20 | H3 | 179.6° | 180.0° |
| C21 | C22 | C23 | H8 | 180.0° | 180.0° |
| C24 | C19 | C20 | C21 | 0.9° | 0.3° |
| C24 | C19 | C20 | C18 | 175.3° | 180.0° |
| C24 | C19 | C18 | O1 | 156.3° | 0.0° |
| C24 | C19 | C18 | N6 | 24.3° | 179.9° |
| C24 | C19 | C20 | H3 | 179.2° | 180.0° |
| C19 | C24 | C23 | H8 | 178.8° | 180.0° |
| C8 | C9 | C10 | C11 | 2.2° | 0.4° |
| C8 | C9 | C10 | C25 | 178.2° | 180.0° |
| C8 | C9 | C25 | N7 | 67.4° | 139.9° |
| C8 | C9 | C25 | O2 | 114.6° | 40.2° |
| C8 | C9 | C10 | H6 | 177.8° | 180.0° |
| C9 | C8 | C7 | H10 | 179.3° | 180.0° |
| C21 | C20 | C19 | H3 | 180.0° | 179.7° |
| C21 | C20 | C19 | C18 | 174.4° | 179.7° |
| C12 | C13 | C14 | N6 | 175.4° | 180.0° |
| C12 | C13 | C14 | C15 | 2.5° | 0.4° |
| C13 | C12 | C17 | C16 | 0.2° | 0.0° |
| C13 | C12 | C17 | H2 | 179.8° | 180.0° |
| C12 | C13 | C26 | H21 | 91.6° | 94.8° |
| C12 | C13 | C26 | H22 | 148.3° | 145.3° |
| C12 | C13 | C26 | H23 | 28.3° | 25.3° |
| C14 | C13 | C12 | C17 | 1.5° | 0.3° |
| C13 | C14 | N6 | C18 | 79.5° | 146.2° |
| C13 | C14 | N6 | C15 | 177.9° | 179.6° |
| C13 | C14 | C15 | C16 | 1.9° | 0.1° |
| C13 | C14 | C15 | H9 | 178.1° | 180.0° |
| C14 | C13 | C26 | H21 | 91.5° | 84.9° |
| C14 | C13 | C26 | H22 | 28.5° | 35.0° |
| C14 | C13 | C26 | H23 | 148.5° | 155.0° |
| C13 | C14 | N6 | H36 | 100.5° | 33.8° |
| C12 | C17 | C16 | H2 | 180.0° | 179.9° |
| C12 | C17 | C16 | C15 | 0.8° | 0.3° |
| C12 | C17 | C16 | H1 | 179.2° | 180.0° |
| C30 | C29 | O3 | H19 | 120.3° | 120.0° |
| C30 | C29 | O3 | H20 | 120.3° | 119.9° |
| C29 | C30 | N7 | H15 | 120.0° | 119.8° |
| C29 | C30 | N7 | H16 | 120.0° | 119.7° |
| C30 | C29 | O3 | C28 | 61.2° | 62.5° |
| C29 | C30 | N7 | C25 | 135.9° | 129.5° |
| C29 | C30 | N7 | C27 | 49.2° | 50.4° |
| C29 | C30 | H15 | H16 | 119.8° | 120.5° |
| C30 | C29 | H19 | H20 | 119.0° | 120.1° |
| O3 | C29 | C30 | N7 | 54.2° | 52.2° |
| C29 | O3 | C28 | C27 | 61.4° | 62.6° |
| O3 | C29 | C30 | H15 | 65.9° | 172.0° |
| O3 | C29 | C30 | H16 | 174.2° | 67.4° |
| C29 | O3 | C28 | H17 | 58.9° | 57.3° |
| C29 | O3 | C28 | H18 | 178.3° | 177.5° |
| O3 | C29 | H19 | H20 | 119.0° | 120.1° |
| C20 | C19 | C18 | O1 | 18.9° | 180.0° |
| C20 | C19 | C18 | N6 | 160.5° | 0.0° |
| C20 | C19 | C24 | H4 | 178.4° | 180.0° |
| C19 | C20 | C21 | H7 | 179.6° | 179.8° |
| C19 | C18 | O1 | N6 | 179.4° | 180.0° |
| C19 | C18 | N6 | C14 | 174.2° | 174.9° |
| C18 | C19 | C20 | H3 | 5.6° | 0.0° |
| C18 | C19 | C24 | H4 | 6.5° | 0.0° |
| C19 | C18 | N6 | H36 | 5.8° | 5.0° |
| C11 | C10 | C9 | H6 | 180.0° | 179.5° |
| C11 | C10 | C9 | C25 | 175.9° | 179.5° |
| O1 | C18 | N6 | C14 | 6.4° | 5.1° |
| O1 | C18 | N6 | H36 | 173.6° | 174.9° |
| C18 | N6 | C14 | H36 | 180.0° | 179.9° |
| C18 | N6 | C14 | C15 | 98.4° | 33.3° |
| C30 | N7 | C25 | C9 | 6.2° | 175.7° |
| C30 | N7 | C25 | C27 | 174.5° | 179.9° |
| C30 | N7 | C25 | O2 | 171.7° | 4.4° |
| C30 | N7 | C27 | C28 | 49.6° | 50.5° |
| C30 | N7 | C27 | H13 | 70.5° | 69.2° |
| C30 | N7 | C27 | H14 | 169.7° | 170.3° |
| N7 | C30 | H15 | H16 | 119.8° | 120.5° |
| N7 | C30 | C29 | H19 | 66.2° | 172.2° |
| N7 | C30 | C29 | H20 | 174.5° | 67.7° |
| N6 | C14 | C15 | C16 | 175.9° | 179.7° |
| N6 | C14 | C15 | H9 | 4.1° | 0.4° |
| C10 | C9 | C25 | N7 | 110.7° | 40.2° |
| C10 | C9 | C25 | O2 | 67.2° | 139.7° |
| C10 | C9 | C8 | H5 | 179.1° | 180.0° |
| C9 | C10 | C11 | H11 | 178.1° | 179.5° |
| C9 | C25 | N7 | O2 | 177.9° | 179.9° |
| C9 | C25 | N7 | C27 | 179.3° | 4.2° |
| C25 | C9 | C8 | H5 | 2.7° | 0.0° |
| C25 | C9 | C10 | H6 | 4.1° | 0.0° |
| C14 | C15 | C16 | C17 | 0.2° | 0.2° |
| C14 | C15 | C16 | H9 | 180.0° | 179.9° |
| C14 | C15 | C16 | H1 | 179.8° | 179.9° |
| C15 | C14 | N6 | H36 | 81.6° | 146.6° |
| O3 | C28 | C27 | N7 | 54.8° | 52.3° |
| O3 | C28 | C27 | H17 | 120.3° | 119.9° |
| O3 | C28 | C27 | H18 | 120.3° | 120.0° |
| O3 | C28 | C27 | H13 | 65.2° | 67.4° |
| O3 | C28 | C27 | H14 | 174.9° | 172.0° |
| O3 | C28 | H17 | H18 | 119.1° | 120.2° |
| C28 | O3 | C29 | H19 | 59.1° | 177.5° |
| C28 | O3 | C29 | H20 | 178.5° | 57.3° |
| C17 | C16 | C15 | H1 | 180.0° | 179.7° |
| C17 | C16 | C15 | H9 | 179.8° | 179.7° |
| C25 | N7 | C27 | C28 | 135.4° | 129.4° |
| C25 | N7 | C27 | H13 | 104.5° | 110.9° |
| C25 | N7 | C27 | H14 | 15.3° | 9.6° |
| C25 | N7 | C30 | H15 | 104.0° | 9.7° |
| C25 | N7 | C30 | H16 | 15.9° | 110.8° |
| C27 | N7 | C25 | O2 | 2.8° | 175.7° |
| N7 | C27 | C28 | H13 | 120.0° | 119.7° |
| N7 | C27 | C28 | H14 | 120.1° | 119.8° |
| N7 | C27 | H13 | H14 | 119.8° | 120.5° |
| C27 | N7 | C30 | H15 | 70.8° | 170.2° |
| C27 | N7 | C30 | H16 | 169.3° | 69.3° |
| N7 | C27 | C28 | H17 | 65.5° | 67.6° |
| N7 | C27 | C28 | H18 | 175.1° | 172.3° |
| C28 | C27 | H13 | H14 | 119.8° | 120.5° |
| C27 | C28 | H17 | H18 | 119.0° | 120.1° |
| C15 | C16 | C17 | H2 | 179.2° | 179.8° |
| H1 | C16 | C17 | H2 | 0.8° | 0.1° |
| H1 | C16 | C15 | H9 | 0.2° | 0.0° |
| H3 | C20 | C21 | H7 | 0.4° | 0.0° |
| H4 | C24 | C23 | H8 | 1.2° | 0.0° |
| H5 | C8 | C7 | H10 | 0.7° | 0.2° |
| H6 | C10 | C11 | H11 | 1.9° | 0.1° |
| H12 | C5 | N4 | H33 | 0.6° | 0.3° |
| H13 | C27 | C28 | H17 | 174.5° | 172.7° |
| H13 | C27 | C28 | H18 | 55.1° | 52.5° |
| H14 | C27 | C28 | H17 | 54.6° | 52.2° |
| H14 | C27 | C28 | H18 | 64.8° | 68.0° |
| H15 | C30 | C29 | H19 | 173.8° | 68.0° |
| H15 | C30 | C29 | H20 | 54.5° | 52.2° |
| H16 | C30 | C29 | H19 | 53.9° | 52.5° |
| H16 | C30 | C29 | H20 | 65.5° | 172.7° |
| H21 | C26 | H22 | H23 | 119.9° | 120.0° |
| H24 | C32 | H25 | H26 | 120.0° | 120.1° |
| H27 | C33 | H28 | H29 | 120.0° | 120.0° |
| H30 | C34 | H31 | H32 | 120.0° | 120.0° |
