MFL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | C2 | sing | 1.53Å | 1.52Å | |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C2 | O1 | sing | 1.45Å | 1.49Å | |
| O1 | C5 | sing | 1.35Å | 1.35Å | |
| C5 | O2 | doub | 1.21Å | 1.21Å | |
| C5 | N1 | sing | 1.35Å | 1.35Å | |
| N1 | C6 | sing | 1.40Å | 1.40Å | |
| C6 | C10 | doub | 1.37Å | 1.40Å | |
| C6 | C7 | sing | 1.41Å | 1.39Å | |
| C10 | C9 | sing | 1.40Å | 1.39Å | |
| N4 | C22 | sing | 1.47Å | 1.46Å | |
| N4 | C23 | sing | 1.35Å | 1.31Å | |
| C22 | C21 | sing | 1.54Å | 1.51Å | |
| O3 | C7 | doub | 1.22Å | 1.22Å | |
| C7 | N2 | sing | 1.35Å | 1.41Å | |
| O5 | C23 | doub | 1.21Å | 1.24Å | |
| C23 | C20 | sing | 1.51Å | 1.52Å | |
| C9 | C8 | doub | 1.35Å | 1.35Å | |
| C21 | C20 | sing | 1.55Å | 1.52Å | |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| N2 | C8 | sing | 1.36Å | 1.37Å | |
| N2 | C11 | sing | 1.47Å | 1.48Å | |
| C11 | C12 | sing | 1.51Å | 1.52Å | |
| C11 | C13 | sing | 1.53Å | 1.53Å | |
| O4 | C12 | doub | 1.21Å | 1.22Å | |
| C19 | C17 | sing | 1.53Å | 1.53Å | |
| C12 | N3 | sing | 1.35Å | 1.33Å | |
| N3 | C17 | sing | 1.46Å | 1.45Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C14 | C15 | sing | 1.53Å | 1.50Å | |
| C14 | C13 | sing | 1.53Å | 1.51Å | |
| C14 | C16 | sing | 1.53Å | 1.50Å | |
| C15 | C16 | sing | 1.53Å | 1.49Å | |
| C18 | O6 | sing | 1.43Å | 1.40Å | |
| C18 | C24 | sing | 1.51Å | 1.50Å | |
| O7 | C24 | doub | 1.21Å | 1.23Å | |
| C24 | N5 | sing | 1.35Å | 1.32Å | |
| N5 | C25 | sing | 1.46Å | 1.45Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N3 | H2 | sing | 0.97Å | 1.00Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| C10 | H7 | sing | 1.08Å | 1.08Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C1 | H18 | sing | 1.09Å | 1.10Å | |
| C1 | H19 | sing | 1.09Å | 1.10Å | |
| C1 | H20 | sing | 1.09Å | 1.10Å | |
| C3 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.09Å | 1.10Å | |
| C9 | H24 | sing | 1.08Å | 1.08Å | |
| C11 | H25 | sing | 1.09Å | 1.10Å | |
| C14 | H26 | sing | 1.09Å | 1.10Å | |
| C16 | H27 | sing | 1.09Å | 1.10Å | |
| C16 | H28 | sing | 1.09Å | 1.10Å | |
| C18 | H29 | sing | 1.09Å | 1.10Å | |
| C19 | H30 | sing | 1.09Å | 1.10Å | |
| C19 | H31 | sing | 1.09Å | 1.10Å | |
| N4 | H32 | sing | 0.97Å | 1.00Å | |
| O6 | H33 | sing | 0.97Å | 0.95Å | |
| N5 | H34 | sing | 0.97Å | 1.00Å | |
| C25 | H35 | sing | 1.09Å | 1.10Å | |
| C25 | H36 | sing | 1.09Å | 1.10Å | |
| C25 | H37 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | C2 | C3 | 111.3° | 109.5° |
| C4 | C2 | C1 | 109.8° | 109.5° |
| C4 | C2 | O1 | 108.9° | 109.5° |
| C2 | C4 | H3 | 109.5° | 109.5° |
| C2 | C4 | H4 | 109.5° | 109.5° |
| C2 | C4 | H5 | 109.5° | 109.5° |
| C3 | C2 | C1 | 111.8° | 109.5° |
| C3 | C2 | O1 | 105.0° | 109.4° |
| C2 | C3 | H21 | 109.5° | 109.5° |
| C2 | C3 | H22 | 109.5° | 109.5° |
| C2 | C3 | H23 | 109.4° | 109.5° |
| C1 | C2 | O1 | 109.9° | 109.5° |
| C2 | C1 | H18 | 109.5° | 109.5° |
| C2 | C1 | H19 | 109.5° | 109.5° |
| C2 | C1 | H20 | 109.5° | 109.5° |
| C2 | O1 | C5 | 122.5° | 117.0° |
| O1 | C5 | O2 | 127.1° | 120.0° |
| O1 | C5 | N1 | 108.9° | 120.0° |
| O2 | C5 | N1 | 124.0° | 119.9° |
| C5 | N1 | C6 | 125.8° | 120.1° |
| C5 | N1 | H1 | 117.1° | 120.0° |
| N1 | C6 | C10 | 120.2° | 120.4° |
| N1 | C6 | C7 | 118.0° | 120.4° |
| C6 | N1 | H1 | 117.2° | 120.0° |
| C10 | C6 | C7 | 121.8° | 119.2° |
| C6 | C10 | C9 | 119.4° | 119.3° |
| C6 | C10 | H7 | 120.3° | 120.4° |
| C6 | C7 | O3 | 124.7° | 120.0° |
| C6 | C7 | N2 | 116.1° | 120.0° |
| C10 | C9 | C8 | 119.4° | 120.0° |
| C9 | C10 | H7 | 120.3° | 120.3° |
| C10 | C9 | H24 | 120.3° | 120.0° |
| C22 | N4 | C23 | 113.2° | 111.4° |
| N4 | C22 | C21 | 102.6° | 105.4° |
| N4 | C22 | H16 | 111.2° | 110.3° |
| N4 | C22 | H17 | 111.2° | 110.3° |
| C22 | N4 | H32 | 123.4° | 124.3° |
| N4 | C23 | O5 | 125.2° | 124.9° |
| N4 | C23 | C20 | 108.4° | 110.0° |
| C23 | N4 | H32 | 123.4° | 124.3° |
| C22 | C21 | C20 | 104.8° | 101.8° |
| C22 | C21 | H14 | 110.7° | 110.9° |
| C22 | C21 | H15 | 110.6° | 111.0° |
| C21 | C22 | H16 | 111.2° | 110.3° |
| C21 | C22 | H17 | 111.1° | 110.2° |
| O3 | C7 | N2 | 119.1° | 120.1° |
| C7 | N2 | C8 | 121.4° | 120.8° |
| C7 | N2 | C11 | 118.5° | 119.6° |
| O5 | C23 | C20 | 126.3° | 125.1° |
| C23 | C20 | C21 | 103.9° | 104.3° |
| C23 | C20 | C19 | 116.6° | 110.5° |
| C23 | C20 | H13 | 107.1° | 110.5° |
| C9 | C8 | N2 | 121.8° | 120.8° |
| C9 | C8 | H6 | 119.1° | 119.6° |
| C8 | C9 | H24 | 120.3° | 120.0° |
| C21 | C20 | C19 | 114.6° | 110.5° |
| C21 | C20 | H13 | 107.1° | 110.5° |
| C20 | C21 | H14 | 110.6° | 111.0° |
| C20 | C21 | H15 | 110.6° | 111.0° |
| C20 | C19 | C17 | 110.9° | 109.4° |
| C19 | C20 | H13 | 107.0° | 110.4° |
| C20 | C19 | H30 | 109.1° | 109.4° |
| C20 | C19 | H31 | 109.1° | 109.5° |
| C8 | N2 | C11 | 119.8° | 119.6° |
| N2 | C8 | H6 | 119.1° | 119.6° |
| N2 | C11 | C12 | 108.3° | 109.4° |
| N2 | C11 | C13 | 115.0° | 109.5° |
| N2 | C11 | H25 | 107.7° | 109.5° |
| C12 | C11 | C13 | 111.5° | 109.4° |
| C11 | C12 | O4 | 120.0° | 120.0° |
| C11 | C12 | N3 | 117.6° | 120.0° |
| C12 | C11 | H25 | 107.1° | 109.5° |
| C11 | C13 | C14 | 113.2° | 109.4° |
| C11 | C13 | H8 | 108.5° | 109.5° |
| C11 | C13 | H9 | 108.5° | 109.5° |
| C13 | C11 | H25 | 107.0° | 109.5° |
| O4 | C12 | N3 | 122.4° | 120.0° |
| C19 | C17 | N3 | 109.8° | 109.5° |
| C19 | C17 | C18 | 116.0° | 109.4° |
| C19 | C17 | H12 | 107.8° | 109.5° |
| C17 | C19 | H30 | 109.1° | 109.5° |
| C17 | C19 | H31 | 109.1° | 109.5° |
| C12 | N3 | C17 | 122.6° | 120.0° |
| C12 | N3 | H2 | 118.7° | 119.9° |
| N3 | C17 | C18 | 106.4° | 109.5° |
| C17 | N3 | H2 | 118.7° | 120.1° |
| N3 | C17 | H12 | 108.8° | 109.5° |
| C17 | C18 | O6 | 110.3° | 109.5° |
| C17 | C18 | C24 | 113.8° | 109.5° |
| C18 | C17 | H12 | 107.8° | 109.5° |
| C17 | C18 | H29 | 107.3° | 109.5° |
| C15 | C14 | C13 | 120.7° | 117.5° |
| C15 | C14 | C16 | 59.9° | 60.0° |
| C14 | C15 | C16 | 60.0° | 60.0° |
| C14 | C15 | H10 | 120.0° | 117.5° |
| C14 | C15 | H11 | 120.0° | 117.6° |
| C15 | C14 | H26 | 115.1° | 117.5° |
| C13 | C14 | C16 | 120.3° | 117.5° |
| C14 | C13 | H8 | 108.5° | 109.4° |
| C14 | C13 | H9 | 108.5° | 109.5° |
| C13 | C14 | H26 | 114.9° | 115.6° |
| C14 | C16 | C15 | 60.1° | 60.0° |
| C16 | C14 | H26 | 115.1° | 117.5° |
| C14 | C16 | H27 | 120.0° | 117.5° |
| C14 | C16 | H28 | 120.0° | 117.6° |
| C16 | C15 | H10 | 120.0° | 117.5° |
| C16 | C15 | H11 | 120.0° | 117.5° |
| C15 | C16 | H27 | 120.0° | 117.5° |
| C15 | C16 | H28 | 120.0° | 117.5° |
| O6 | C18 | C24 | 108.8° | 109.4° |
| O6 | C18 | H29 | 108.9° | 109.5° |
| C18 | O6 | H33 | 109.5° | 114.0° |
| C18 | C24 | O7 | 117.4° | 120.0° |
| C18 | C24 | N5 | 116.0° | 120.0° |
| C24 | C18 | H29 | 107.6° | 109.5° |
| O7 | C24 | N5 | 126.5° | 120.0° |
| C24 | N5 | C25 | 123.7° | 120.0° |
| C24 | N5 | H34 | 118.1° | 120.0° |
| C25 | N5 | H34 | 118.2° | 120.0° |
| N5 | C25 | H35 | 109.5° | 109.5° |
| N5 | C25 | H36 | 109.5° | 109.5° |
| N5 | C25 | H37 | 109.5° | 109.4° |
| H3 | C4 | H4 | 109.4° | 109.5° |
| H3 | C4 | H5 | 109.5° | 109.4° |
| H4 | C4 | H5 | 109.5° | 109.4° |
| H8 | C13 | H9 | 109.5° | 109.5° |
| H10 | C15 | H11 | 109.5° | 115.5° |
| H14 | C21 | H15 | 109.4° | 110.8° |
| H16 | C22 | H17 | 109.5° | 110.2° |
| H18 | C1 | H19 | 109.5° | 109.4° |
| H18 | C1 | H20 | 109.4° | 109.5° |
| H19 | C1 | H20 | 109.5° | 109.5° |
| H21 | C3 | H22 | 109.5° | 109.5° |
| H21 | C3 | H23 | 109.5° | 109.4° |
| H22 | C3 | H23 | 109.5° | 109.5° |
| H27 | C16 | H28 | 109.4° | 115.6° |
| H30 | C19 | H31 | 109.5° | 109.5° |
| H35 | C25 | H36 | 109.5° | 109.5° |
| H35 | C25 | H37 | 109.5° | 109.5° |
| H36 | C25 | H37 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | C2 | C3 | C1 | 123.2° | 120.0° |
| C4 | C2 | C3 | O1 | 117.6° | 119.9° |
| C4 | C2 | C1 | O1 | 119.7° | 120.0° |
| C4 | C2 | O1 | C5 | 163.7° | 60.0° |
| C2 | C4 | H3 | H4 | 120.0° | 120.1° |
| C2 | C4 | H3 | H5 | 120.0° | 120.0° |
| C2 | C4 | H4 | H5 | 120.0° | 120.0° |
| C4 | C2 | C1 | H18 | 180.0° | 60.1° |
| C4 | C2 | C1 | H19 | 60.0° | 180.0° |
| C4 | C2 | C1 | H20 | 60.0° | 60.0° |
| C4 | C2 | C3 | H21 | 180.0° | 59.9° |
| C4 | C2 | C3 | H22 | 60.0° | 180.0° |
| C4 | C2 | C3 | H23 | 60.0° | 60.0° |
| C3 | C2 | C1 | O1 | 116.2° | 120.0° |
| C3 | C2 | O1 | C5 | 77.0° | 180.0° |
| C3 | C2 | C4 | H3 | 180.0° | 180.0° |
| C3 | C2 | C4 | H4 | 60.0° | 60.0° |
| C3 | C2 | C4 | H5 | 60.0° | 60.0° |
| C3 | C2 | C1 | H18 | 55.9° | 60.0° |
| C3 | C2 | C1 | H19 | 64.1° | 59.9° |
| C3 | C2 | C1 | H20 | 175.9° | 180.0° |
| C2 | C3 | H21 | H22 | 120.0° | 120.0° |
| C2 | C3 | H21 | H23 | 120.0° | 120.0° |
| C2 | C3 | H22 | H23 | 120.0° | 120.0° |
| C1 | C2 | O1 | C5 | 43.4° | 60.0° |
| C1 | C2 | C4 | H3 | 55.6° | 59.9° |
| C1 | C2 | C4 | H4 | 64.4° | 180.0° |
| C1 | C2 | C4 | H5 | 175.6° | 60.0° |
| C2 | C1 | H18 | H19 | 120.0° | 119.9° |
| C2 | C1 | H18 | H20 | 120.0° | 120.0° |
| C2 | C1 | H19 | H20 | 120.0° | 120.0° |
| C1 | C2 | C3 | H21 | 56.8° | 180.0° |
| C1 | C2 | C3 | H22 | 176.8° | 60.0° |
| C1 | C2 | C3 | H23 | 63.2° | 60.0° |
| C2 | O1 | C5 | O2 | 0.2° | 0.0° |
| C2 | O1 | C5 | N1 | 179.4° | 180.0° |
| O1 | C2 | C4 | H3 | 64.8° | 60.1° |
| O1 | C2 | C4 | H4 | 175.3° | 60.0° |
| O1 | C2 | C4 | H5 | 55.3° | 179.9° |
| O1 | C2 | C1 | H18 | 60.3° | 180.0° |
| O1 | C2 | C1 | H19 | 179.7° | 60.0° |
| O1 | C2 | C1 | H20 | 59.7° | 60.0° |
| O1 | C2 | C3 | H21 | 62.3° | 60.0° |
| O1 | C2 | C3 | H22 | 57.7° | 60.0° |
| O1 | C2 | C3 | H23 | 177.6° | 180.0° |
| O1 | C5 | O2 | N1 | 179.1° | 180.0° |
| O1 | C5 | N1 | C6 | 172.3° | 174.2° |
| O1 | C5 | N1 | H1 | 7.7° | 5.4° |
| O2 | C5 | N1 | C6 | 6.9° | 5.8° |
| O2 | C5 | N1 | H1 | 173.1° | 174.6° |
| C5 | N1 | C6 | H1 | 180.0° | 179.7° |
| C5 | N1 | C6 | C10 | 50.8° | 120.7° |
| C5 | N1 | C6 | C7 | 128.4° | 59.5° |
| N1 | C6 | C10 | C7 | 179.2° | 179.8° |
| N1 | C6 | C10 | C9 | 180.0° | 180.0° |
| N1 | C6 | C7 | O3 | 0.5° | 0.1° |
| N1 | C6 | C7 | N2 | 178.0° | 180.0° |
| N1 | C6 | C10 | H7 | 0.0° | 0.1° |
| C6 | C10 | C9 | H7 | 180.0° | 179.9° |
| C10 | C6 | C7 | O3 | 178.7° | 179.8° |
| C10 | C6 | C7 | N2 | 2.9° | 0.3° |
| C6 | C10 | C9 | C8 | 0.1° | 0.1° |
| C10 | C6 | N1 | H1 | 129.2° | 59.6° |
| C6 | C10 | C9 | H24 | 179.9° | 180.0° |
| C7 | C6 | C10 | C9 | 0.9° | 0.2° |
| C6 | C7 | O3 | N2 | 178.4° | 179.9° |
| C6 | C7 | N2 | C8 | 4.1° | 0.0° |
| C6 | C7 | N2 | C11 | 178.1° | 180.0° |
| C7 | C6 | N1 | H1 | 51.6° | 120.1° |
| C7 | C6 | C10 | H7 | 179.1° | 179.7° |
| C10 | C9 | C8 | H24 | 180.0° | 180.0° |
| C10 | C9 | C8 | N2 | 1.2° | 0.3° |
| C10 | C9 | C8 | H6 | 178.8° | 180.0° |
| C22 | N4 | C23 | H32 | 180.0° | 179.8° |
| N4 | C22 | C21 | H16 | 118.9° | 119.1° |
| N4 | C22 | C21 | H17 | 118.9° | 119.1° |
| C22 | N4 | C23 | O5 | 166.8° | 179.6° |
| C22 | N4 | C23 | C20 | 15.8° | 0.6° |
| N4 | C22 | C21 | C20 | 24.9° | 25.4° |
| N4 | C22 | C21 | H14 | 94.4° | 92.8° |
| N4 | C22 | C21 | H15 | 144.2° | 143.6° |
| N4 | C22 | H16 | H17 | 123.2° | 122.0° |
| C23 | N4 | C22 | C21 | 26.3° | 17.1° |
| N4 | C23 | O5 | C20 | 176.9° | 179.8° |
| N4 | C23 | C20 | C21 | 1.4° | 16.1° |
| N4 | C23 | C20 | C19 | 125.7° | 134.8° |
| N4 | C23 | C20 | H13 | 114.5° | 102.7° |
| C23 | N4 | C22 | H16 | 145.2° | 136.2° |
| C23 | N4 | C22 | H17 | 92.6° | 101.9° |
| C22 | C21 | C20 | C23 | 16.8° | 24.7° |
| C22 | C21 | C20 | H14 | 119.3° | 118.1° |
| C22 | C21 | C20 | H15 | 119.3° | 118.2° |
| C22 | C21 | C20 | C19 | 111.6° | 143.4° |
| C22 | C21 | C20 | H13 | 129.9° | 94.0° |
| C22 | C21 | H14 | H15 | 122.2° | 123.8° |
| C21 | C22 | H16 | H17 | 123.2° | 121.9° |
| C21 | C22 | N4 | H32 | 153.7° | 163.0° |
| O3 | C7 | N2 | C8 | 177.4° | 179.9° |
| O3 | C7 | N2 | C11 | 3.4° | 0.0° |
| C7 | N2 | C8 | C9 | 3.4° | 0.3° |
| C7 | N2 | C8 | C11 | 173.9° | 180.0° |
| C7 | N2 | C11 | C12 | 77.4° | 120.0° |
| C7 | N2 | C11 | C13 | 157.1° | 120.0° |
| C7 | N2 | C8 | H6 | 176.6° | 179.9° |
| C7 | N2 | C11 | H25 | 38.1° | 0.0° |
| O5 | C23 | C20 | C21 | 175.9° | 163.7° |
| O5 | C23 | C20 | C19 | 57.0° | 45.0° |
| O5 | C23 | C20 | H13 | 62.8° | 77.5° |
| O5 | C23 | N4 | H32 | 13.2° | 0.2° |
| C23 | C20 | C21 | C19 | 128.4° | 118.7° |
| C23 | C20 | C21 | H13 | 113.1° | 118.7° |
| C23 | C20 | C19 | H13 | 119.8° | 122.5° |
| C23 | C20 | C19 | C17 | 169.8° | 179.6° |
| C23 | C20 | C21 | H14 | 102.5° | 93.4° |
| C23 | C20 | C21 | H15 | 136.1° | 142.9° |
| C23 | C20 | C19 | H30 | 70.0° | 60.5° |
| C23 | C20 | C19 | H31 | 49.6° | 59.5° |
| C20 | C23 | N4 | H32 | 164.1° | 179.6° |
| C9 | C8 | N2 | H6 | 180.0° | 179.6° |
| C9 | C8 | N2 | C11 | 177.3° | 179.7° |
| C8 | C9 | C10 | H7 | 179.9° | 180.0° |
| C21 | C20 | C19 | H13 | 118.5° | 122.6° |
| C21 | C20 | C19 | C17 | 68.5° | 64.6° |
| C20 | C21 | H14 | H15 | 122.1° | 123.8° |
| C20 | C21 | C22 | H16 | 143.8° | 144.4° |
| C20 | C21 | C22 | H17 | 94.0° | 93.7° |
| C21 | C20 | C19 | H30 | 51.7° | 175.4° |
| C21 | C20 | C19 | H31 | 171.3° | 55.4° |
| C20 | C19 | C17 | H30 | 120.2° | 119.9° |
| C20 | C19 | C17 | H31 | 120.2° | 120.0° |
| C20 | C19 | C17 | N3 | 57.2° | 64.6° |
| C20 | C19 | C17 | C18 | 177.9° | 175.5° |
| C20 | C19 | C17 | H12 | 61.2° | 55.5° |
| C19 | C20 | C21 | H14 | 129.1° | 25.3° |
| C19 | C20 | C21 | H15 | 7.7° | 98.4° |
| C20 | C19 | H30 | H31 | 119.4° | 120.0° |
| C8 | N2 | C11 | C12 | 96.6° | 59.9° |
| C8 | N2 | C11 | C13 | 28.8° | 60.0° |
| N2 | C8 | C9 | H24 | 178.8° | 179.7° |
| C8 | N2 | C11 | H25 | 147.9° | 180.0° |
| N2 | C11 | C12 | C13 | 127.4° | 120.0° |
| N2 | C11 | C12 | H25 | 115.9° | 120.0° |
| N2 | C11 | C13 | H25 | 119.5° | 120.0° |
| N2 | C11 | C12 | O4 | 35.7° | 0.0° |
| N2 | C11 | C12 | N3 | 141.1° | 180.0° |
| N2 | C11 | C13 | C14 | 59.3° | 65.0° |
| C11 | N2 | C8 | H6 | 2.7° | 0.1° |
| N2 | C11 | C13 | H8 | 61.2° | 54.9° |
| N2 | C11 | C13 | H9 | 179.8° | 175.0° |
| C12 | C11 | C13 | H25 | 116.8° | 120.0° |
| C11 | C12 | O4 | N3 | 176.7° | 180.0° |
| C11 | C12 | N3 | C17 | 169.1° | 180.0° |
| C12 | C11 | C13 | C14 | 177.0° | 175.0° |
| C11 | C12 | N3 | H2 | 10.9° | 0.0° |
| C12 | C11 | C13 | H8 | 62.5° | 65.0° |
| C12 | C11 | C13 | H9 | 56.4° | 55.0° |
| C13 | C11 | C12 | O4 | 91.7° | 120.0° |
| C13 | C11 | C12 | N3 | 91.4° | 60.0° |
| C11 | C13 | C14 | C15 | 84.3° | 175.0° |
| C11 | C13 | C14 | H8 | 120.5° | 120.0° |
| C11 | C13 | C14 | H9 | 120.6° | 120.0° |
| C11 | C13 | C14 | C16 | 155.2° | 116.4° |
| C11 | C13 | H8 | H9 | 118.3° | 120.0° |
| C11 | C13 | C14 | H26 | 60.6° | 29.3° |
| O4 | C12 | N3 | C17 | 14.1° | 0.0° |
| O4 | C12 | N3 | H2 | 165.9° | 180.0° |
| O4 | C12 | C11 | H25 | 151.6° | 120.0° |
| C19 | C17 | N3 | C12 | 130.1° | 141.3° |
| C19 | C17 | N3 | C18 | 126.3° | 120.0° |
| C19 | C17 | N3 | H12 | 117.7° | 120.0° |
| C19 | C17 | C18 | H12 | 120.9° | 120.0° |
| C19 | C17 | C18 | O6 | 164.0° | 60.0° |
| C19 | C17 | C18 | C24 | 73.4° | 180.0° |
| C19 | C17 | N3 | H2 | 49.9° | 38.7° |
| C17 | C19 | C20 | H13 | 50.0° | 57.9° |
| C19 | C17 | C18 | H29 | 45.5° | 60.0° |
| C17 | C19 | H30 | H31 | 119.4° | 120.1° |
| C12 | N3 | C17 | H2 | 180.0° | 180.0° |
| C12 | N3 | C17 | C18 | 103.6° | 98.7° |
| C12 | N3 | C17 | H12 | 12.4° | 21.3° |
| N3 | C12 | C11 | H25 | 25.3° | 60.0° |
| N3 | C17 | C18 | H12 | 116.6° | 120.0° |
| N3 | C17 | C18 | O6 | 41.6° | 60.0° |
| N3 | C17 | C18 | C24 | 164.1° | 60.0° |
| N3 | C17 | C18 | H29 | 76.9° | 180.0° |
| N3 | C17 | C19 | H30 | 177.4° | 55.4° |
| N3 | C17 | C19 | H31 | 63.0° | 175.4° |
| C17 | C18 | O6 | C24 | 125.5° | 120.0° |
| C17 | C18 | O6 | H29 | 117.5° | 120.0° |
| C17 | C18 | C24 | H29 | 118.8° | 120.0° |
| C17 | C18 | C24 | O7 | 66.6° | 115.0° |
| C17 | C18 | C24 | N5 | 116.7° | 65.1° |
| C18 | C17 | N3 | H2 | 76.4° | 81.3° |
| C18 | C17 | C19 | H30 | 61.9° | 64.6° |
| C18 | C17 | C19 | H31 | 57.7° | 55.4° |
| C17 | C18 | O6 | H33 | 180.0° | 60.0° |
| C15 | C14 | C13 | C16 | 70.8° | 68.7° |
| C15 | C14 | C13 | H26 | 145.0° | 145.7° |
| C15 | C14 | C16 | H26 | 105.6° | 107.5° |
| C14 | C15 | C16 | H10 | 109.5° | 107.5° |
| C14 | C15 | C16 | H11 | 109.5° | 107.6° |
| C15 | C14 | C13 | H8 | 155.1° | 65.1° |
| C15 | C14 | C13 | H9 | 36.2° | 55.0° |
| C14 | C15 | H10 | H11 | 144.8° | 145.7° |
| C15 | C14 | C16 | H27 | 109.5° | 107.5° |
| C15 | C14 | C16 | H28 | 109.5° | 107.4° |
| C13 | C14 | C16 | H26 | 144.2° | 145.0° |
| C14 | C13 | H8 | H9 | 118.3° | 120.0° |
| C13 | C14 | C15 | H10 | 0.0° | 0.0° |
| C13 | C14 | C15 | H11 | 141.1° | 145.0° |
| C14 | C13 | C11 | H25 | 60.2° | 55.0° |
| C13 | C14 | C16 | H27 | 140.3° | 0.1° |
| C13 | C14 | C16 | H28 | 0.7° | 145.1° |
| C16 | C14 | C13 | H8 | 84.3° | 3.6° |
| C16 | C14 | C13 | H9 | 34.6° | 123.6° |
| C14 | C16 | H27 | H28 | 144.7° | 145.8° |
| C16 | C15 | H10 | H11 | 144.7° | 145.6° |
| C15 | C16 | H27 | H28 | 144.7° | 145.6° |
| O6 | C18 | C24 | H29 | 117.8° | 120.0° |
| O6 | C18 | C24 | O7 | 170.0° | 5.0° |
| O6 | C18 | C24 | N5 | 6.7° | 175.0° |
| O6 | C18 | C17 | H12 | 75.0° | 180.0° |
| C18 | C24 | O7 | N5 | 176.3° | 179.9° |
| C18 | C24 | N5 | C25 | 175.9° | 180.0° |
| C24 | C18 | C17 | H12 | 47.5° | 60.1° |
| C24 | C18 | O6 | H33 | 54.5° | 60.0° |
| C18 | C24 | N5 | H34 | 4.1° | 0.1° |
| O7 | C24 | N5 | C25 | 7.7° | 0.1° |
| O7 | C24 | C18 | H29 | 52.2° | 125.0° |
| O7 | C24 | N5 | H34 | 172.3° | 180.0° |
| C24 | N5 | C25 | H34 | 180.0° | 179.9° |
| N5 | C24 | C18 | H29 | 124.5° | 55.0° |
| C24 | N5 | C25 | H35 | 180.0° | 59.9° |
| C24 | N5 | C25 | H36 | 60.0° | 180.0° |
| C24 | N5 | C25 | H37 | 60.0° | 60.0° |
| N5 | C25 | H35 | H36 | 120.0° | 120.1° |
| N5 | C25 | H35 | H37 | 120.0° | 119.9° |
| N5 | C25 | H36 | H37 | 120.0° | 120.0° |
| H2 | N3 | C17 | H12 | 167.6° | 158.7° |
| H3 | C4 | H4 | H5 | 120.0° | 119.9° |
| H6 | C8 | C9 | H24 | 1.2° | 0.1° |
| H7 | C10 | C9 | H24 | 0.1° | 0.1° |
| H8 | C13 | C11 | H25 | 179.3° | 174.9° |
| H8 | C13 | C14 | H26 | 59.9° | 149.3° |
| H9 | C13 | C11 | H25 | 60.4° | 65.0° |
| H9 | C13 | C14 | H26 | 178.8° | 90.7° |
| H10 | C15 | C14 | H26 | 144.9° | 145.0° |
| H10 | C15 | C16 | H27 | 141.0° | 0.0° |
| H10 | C15 | C16 | H28 | 0.0° | 144.9° |
| H11 | C15 | C14 | H26 | 3.8° | 0.0° |
| H11 | C15 | C16 | H27 | 0.0° | 144.9° |
| H11 | C15 | C16 | H28 | 141.0° | 0.0° |
| H12 | C17 | C18 | H29 | 166.4° | 60.0° |
| H12 | C17 | C19 | H30 | 59.0° | 175.4° |
| H12 | C17 | C19 | H31 | 178.6° | 64.5° |
| H13 | C20 | C21 | H14 | 10.6° | 147.9° |
| H13 | C20 | C21 | H15 | 110.8° | 24.2° |
| H13 | C20 | C19 | H30 | 170.2° | 62.0° |
| H13 | C20 | C19 | H31 | 70.2° | 178.0° |
| H14 | C21 | C22 | H16 | 24.5° | 26.3° |
| H14 | C21 | C22 | H17 | 146.8° | 148.2° |
| H15 | C21 | C22 | H16 | 96.9° | 97.4° |
| H15 | C21 | C22 | H17 | 25.3° | 24.5° |
| H16 | C22 | N4 | H32 | 34.8° | 44.0° |
| H17 | C22 | N4 | H32 | 87.5° | 78.0° |
| H18 | C1 | H19 | H20 | 120.0° | 120.1° |
| H21 | C3 | H22 | H23 | 120.0° | 120.0° |
| H26 | C14 | C16 | H27 | 3.9° | 145.1° |
| H26 | C14 | C16 | H28 | 144.9° | 0.0° |
| H29 | C18 | O6 | H33 | 62.5° | 180.0° |
| H34 | N5 | C25 | H35 | 0.0° | 120.0° |
| H34 | N5 | C25 | H36 | 120.0° | 0.1° |
| H34 | N5 | C25 | H37 | 120.0° | 120.0° |
| H35 | C25 | H36 | H37 | 120.0° | 120.0° |
