OV2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C17 | sing | 1.53Å | 1.56Å | |
| C22 | C24 | sing | 1.53Å | 1.52Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C17 | O4 | sing | 1.43Å | 1.43Å | |
| C17 | C16 | sing | 1.53Å | 1.54Å | |
| C24 | O7 | sing | 1.43Å | 1.43Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C25 | C16 | sing | 1.53Å | 1.54Å | |
| C27 | C26 | sing | 1.53Å | 1.52Å | |
| C26 | C28 | sing | 1.53Å | 1.52Å | |
| C16 | N4 | sing | 1.47Å | 1.46Å | |
| N4 | C15 | sing | 1.35Å | 1.34Å | |
| C15 | O3 | doub | 1.21Å | 1.22Å | |
| C15 | C11 | sing | 1.51Å | 1.51Å | |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| C11 | N2 | sing | 1.47Å | 1.46Å | |
| O8 | C14 | doub | 1.21Å | 1.22Å | |
| C31 | N3 | sing | 1.46Å | 1.46Å | |
| C14 | N3 | sing | 1.35Å | 1.34Å | |
| C14 | C13 | sing | 1.51Å | 1.51Å | |
| N3 | C30 | sing | 1.47Å | 1.46Å | |
| N2 | C10 | sing | 1.35Å | 1.34Å | |
| O2 | C10 | doub | 1.21Å | 1.23Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C10 | C6 | sing | 1.51Å | 1.51Å | |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| C7 | C9 | sing | 1.53Å | 1.52Å | |
| C6 | N1 | sing | 1.47Å | 1.45Å | |
| N1 | C5 | sing | 1.35Å | 1.33Å | |
| O1 | C5 | doub | 1.21Å | 1.22Å | |
| C5 | C4 | sing | 1.51Å | 1.52Å | |
| C4 | C1 | sing | 1.53Å | 1.52Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C3 | C29 | sing | 1.53Å | 1.51Å | |
| C31 | H1 | sing | 1.09Å | 1.10Å | |
| C31 | H2 | sing | 1.09Å | 1.10Å | |
| C31 | H3 | sing | 1.09Å | 1.10Å | |
| C30 | H4 | sing | 1.09Å | 1.10Å | |
| C30 | H5 | sing | 1.09Å | 1.10Å | |
| C30 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| N4 | H12 | sing | 0.97Å | 1.00Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C25 | H15 | sing | 1.09Å | 1.10Å | |
| C26 | H16 | sing | 1.09Å | 1.10Å | |
| C28 | H17 | sing | 1.09Å | 1.10Å | |
| C28 | H18 | sing | 1.09Å | 1.10Å | |
| C28 | H19 | sing | 1.09Å | 1.10Å | |
| C27 | H20 | sing | 1.09Å | 1.10Å | |
| C27 | H21 | sing | 1.09Å | 1.10Å | |
| C27 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C24 | H28 | sing | 1.09Å | 1.10Å | |
| C24 | H29 | sing | 1.09Å | 1.10Å | |
| O7 | H30 | sing | 0.97Å | 0.95Å | |
| O4 | H31 | sing | 0.97Å | 0.95Å | |
| N2 | H32 | sing | 0.97Å | 1.00Å | |
| C6 | H33 | sing | 1.09Å | 1.10Å | |
| C7 | H34 | sing | 1.09Å | 1.10Å | |
| C9 | H35 | sing | 1.09Å | 1.10Å | |
| C9 | H36 | sing | 1.09Å | 1.10Å | |
| C9 | H37 | sing | 1.09Å | 1.10Å | |
| C8 | H38 | sing | 1.09Å | 1.10Å | |
| C8 | H39 | sing | 1.09Å | 1.10Å | |
| C8 | H40 | sing | 1.09Å | 1.10Å | |
| N1 | H41 | sing | 0.97Å | 1.00Å | |
| C4 | H42 | sing | 1.09Å | 1.10Å | |
| C4 | H43 | sing | 1.09Å | 1.10Å | |
| C1 | H44 | sing | 1.09Å | 1.10Å | |
| C1 | H45 | sing | 1.09Å | 1.10Å | |
| C2 | H46 | sing | 1.09Å | 1.10Å | |
| C2 | H47 | sing | 1.09Å | 1.10Å | |
| C3 | H48 | sing | 1.09Å | 1.10Å | |
| C3 | H49 | sing | 1.09Å | 1.10Å | |
| C29 | H50 | sing | 1.09Å | 1.10Å | |
| C29 | H51 | sing | 1.09Å | 1.10Å | |
| C29 | H52 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C22 | C24 | 111.8° | 109.5° |
| C17 | C22 | C23 | 111.3° | 109.5° |
| C22 | C17 | O4 | 109.1° | 109.5° |
| C22 | C17 | C16 | 117.4° | 109.5° |
| C22 | C17 | H23 | 106.8° | 109.5° |
| C17 | C22 | H24 | 108.4° | 109.5° |
| C24 | C22 | C23 | 107.6° | 109.5° |
| C22 | C24 | O7 | 111.0° | 109.5° |
| C24 | C22 | H24 | 108.9° | 109.5° |
| C22 | C24 | H28 | 109.1° | 109.5° |
| C22 | C24 | H29 | 109.1° | 109.4° |
| C23 | C22 | H24 | 108.8° | 109.4° |
| C22 | C23 | H25 | 109.5° | 109.4° |
| C22 | C23 | H26 | 109.5° | 109.5° |
| C22 | C23 | H27 | 109.5° | 109.5° |
| O4 | C17 | C16 | 107.9° | 109.4° |
| O4 | C17 | H23 | 108.3° | 109.4° |
| C17 | O4 | H31 | 109.5° | 114.0° |
| C17 | C16 | C25 | 109.6° | 109.5° |
| C17 | C16 | N4 | 116.9° | 109.5° |
| C17 | C16 | H13 | 108.8° | 109.5° |
| C16 | C17 | H23 | 107.0° | 109.5° |
| O7 | C24 | H28 | 109.1° | 109.5° |
| O7 | C24 | H29 | 109.1° | 109.5° |
| C24 | O7 | H30 | 109.5° | 114.0° |
| C26 | C25 | C16 | 118.4° | 109.5° |
| C25 | C26 | C27 | 110.2° | 109.5° |
| C25 | C26 | C28 | 114.7° | 109.5° |
| C26 | C25 | H14 | 107.2° | 109.5° |
| C26 | C25 | H15 | 107.2° | 109.5° |
| C25 | C26 | H16 | 107.7° | 109.4° |
| C25 | C16 | N4 | 102.4° | 109.5° |
| C25 | C16 | H13 | 108.8° | 109.5° |
| C16 | C25 | H14 | 107.2° | 109.4° |
| C16 | C25 | H15 | 107.2° | 109.4° |
| C27 | C26 | C28 | 108.3° | 109.5° |
| C27 | C26 | H16 | 107.8° | 109.5° |
| C26 | C27 | H20 | 109.5° | 109.5° |
| C26 | C27 | H21 | 109.5° | 109.5° |
| C26 | C27 | H22 | 109.5° | 109.5° |
| C28 | C26 | H16 | 107.9° | 109.5° |
| C26 | C28 | H17 | 109.5° | 109.5° |
| C26 | C28 | H18 | 109.5° | 109.5° |
| C26 | C28 | H19 | 109.5° | 109.5° |
| C16 | N4 | C15 | 125.5° | 120.0° |
| C16 | N4 | H12 | 117.3° | 119.9° |
| N4 | C16 | H13 | 109.9° | 109.4° |
| N4 | C15 | O3 | 123.8° | 120.0° |
| N4 | C15 | C11 | 116.3° | 120.0° |
| C15 | N4 | H12 | 117.3° | 120.0° |
| O3 | C15 | C11 | 119.8° | 120.0° |
| C15 | C11 | C12 | 112.3° | 109.4° |
| C15 | C11 | N2 | 115.0° | 109.5° |
| C15 | C11 | H11 | 106.0° | 109.5° |
| C11 | C12 | C13 | 110.0° | 109.4° |
| C12 | C11 | N2 | 110.3° | 109.5° |
| C11 | C12 | H9 | 109.3° | 109.5° |
| C11 | C12 | H10 | 109.4° | 109.4° |
| C12 | C11 | H11 | 105.9° | 109.4° |
| C12 | C13 | C14 | 109.0° | 109.5° |
| C12 | C13 | H7 | 109.6° | 109.5° |
| C12 | C13 | H8 | 109.6° | 109.5° |
| C13 | C12 | H9 | 109.4° | 109.5° |
| C13 | C12 | H10 | 109.3° | 109.5° |
| C11 | N2 | C10 | 121.2° | 119.9° |
| N2 | C11 | H11 | 106.6° | 109.5° |
| C11 | N2 | H32 | 119.4° | 120.0° |
| O8 | C14 | N3 | 123.6° | 120.0° |
| O8 | C14 | C13 | 119.4° | 120.0° |
| C31 | N3 | C14 | 122.8° | 120.0° |
| C31 | N3 | C30 | 115.1° | 120.1° |
| N3 | C31 | H1 | 109.5° | 109.5° |
| N3 | C31 | H2 | 109.4° | 109.5° |
| N3 | C31 | H3 | 109.5° | 109.5° |
| N3 | C14 | C13 | 117.0° | 120.0° |
| C14 | N3 | C30 | 122.1° | 120.0° |
| C14 | C13 | H7 | 109.6° | 109.4° |
| C14 | C13 | H8 | 109.6° | 109.5° |
| N3 | C30 | H4 | 109.5° | 109.5° |
| N3 | C30 | H5 | 109.5° | 109.5° |
| N3 | C30 | H6 | 109.5° | 109.4° |
| N2 | C10 | O2 | 122.3° | 120.1° |
| N2 | C10 | C6 | 119.1° | 119.9° |
| C10 | N2 | H32 | 119.4° | 120.1° |
| O2 | C10 | C6 | 118.6° | 120.0° |
| C8 | C7 | C6 | 114.8° | 109.5° |
| C8 | C7 | C9 | 109.8° | 109.5° |
| C8 | C7 | H34 | 107.0° | 109.4° |
| C7 | C8 | H38 | 109.5° | 109.5° |
| C7 | C8 | H39 | 109.5° | 109.5° |
| C7 | C8 | H40 | 109.5° | 109.4° |
| C10 | C6 | C7 | 114.2° | 109.5° |
| C10 | C6 | N1 | 107.1° | 109.5° |
| C10 | C6 | H33 | 109.0° | 109.5° |
| C6 | C7 | C9 | 110.8° | 109.5° |
| C7 | C6 | N1 | 108.0° | 109.5° |
| C7 | C6 | H33 | 108.7° | 109.5° |
| C6 | C7 | H34 | 106.9° | 109.4° |
| C9 | C7 | H34 | 107.1° | 109.5° |
| C7 | C9 | H35 | 109.5° | 109.5° |
| C7 | C9 | H36 | 109.5° | 109.5° |
| C7 | C9 | H37 | 109.5° | 109.5° |
| C6 | N1 | C5 | 124.8° | 120.0° |
| N1 | C6 | H33 | 109.8° | 109.4° |
| C6 | N1 | H41 | 117.6° | 120.0° |
| N1 | C5 | O1 | 123.6° | 120.0° |
| N1 | C5 | C4 | 116.4° | 120.0° |
| C5 | N1 | H41 | 117.6° | 120.0° |
| O1 | C5 | C4 | 119.9° | 120.0° |
| C5 | C4 | C1 | 112.1° | 109.4° |
| C5 | C4 | H42 | 108.8° | 109.5° |
| C5 | C4 | H43 | 108.8° | 109.5° |
| C4 | C1 | C2 | 111.2° | 109.4° |
| C1 | C4 | H42 | 108.8° | 109.4° |
| C1 | C4 | H43 | 108.8° | 109.5° |
| C4 | C1 | H44 | 109.0° | 109.5° |
| C4 | C1 | H45 | 109.0° | 109.5° |
| C1 | C2 | C3 | 111.6° | 109.4° |
| C2 | C1 | H44 | 109.0° | 109.4° |
| C2 | C1 | H45 | 109.0° | 109.5° |
| C1 | C2 | H46 | 109.0° | 109.4° |
| C1 | C2 | H47 | 109.0° | 109.5° |
| C2 | C3 | C29 | 110.5° | 109.5° |
| C3 | C2 | H46 | 108.9° | 109.5° |
| C3 | C2 | H47 | 108.9° | 109.5° |
| C2 | C3 | H48 | 109.2° | 109.5° |
| C2 | C3 | H49 | 109.2° | 109.5° |
| C29 | C3 | H48 | 109.2° | 109.5° |
| C29 | C3 | H49 | 109.2° | 109.4° |
| C3 | C29 | H50 | 109.5° | 109.5° |
| C3 | C29 | H51 | 109.5° | 109.5° |
| C3 | C29 | H52 | 109.5° | 109.5° |
| H1 | C31 | H2 | 109.5° | 109.4° |
| H1 | C31 | H3 | 109.5° | 109.5° |
| H2 | C31 | H3 | 109.5° | 109.5° |
| H4 | C30 | H5 | 109.5° | 109.5° |
| H4 | C30 | H6 | 109.5° | 109.5° |
| H5 | C30 | H6 | 109.4° | 109.5° |
| H7 | C13 | H8 | 109.5° | 109.5° |
| H9 | C12 | H10 | 109.5° | 109.5° |
| H14 | C25 | H15 | 109.5° | 109.5° |
| H17 | C28 | H18 | 109.4° | 109.4° |
| H17 | C28 | H19 | 109.5° | 109.5° |
| H18 | C28 | H19 | 109.5° | 109.5° |
| H20 | C27 | H21 | 109.5° | 109.4° |
| H20 | C27 | H22 | 109.4° | 109.5° |
| H21 | C27 | H22 | 109.5° | 109.4° |
| H25 | C23 | H26 | 109.4° | 109.4° |
| H25 | C23 | H27 | 109.5° | 109.4° |
| H26 | C23 | H27 | 109.5° | 109.5° |
| H28 | C24 | H29 | 109.5° | 109.5° |
| H35 | C9 | H36 | 109.5° | 109.5° |
| H35 | C9 | H37 | 109.5° | 109.5° |
| H36 | C9 | H37 | 109.5° | 109.4° |
| H38 | C8 | H39 | 109.5° | 109.5° |
| H38 | C8 | H40 | 109.4° | 109.5° |
| H39 | C8 | H40 | 109.4° | 109.5° |
| H42 | C4 | H43 | 109.5° | 109.5° |
| H44 | C1 | H45 | 109.5° | 109.5° |
| H46 | C2 | H47 | 109.5° | 109.5° |
| H48 | C3 | H49 | 109.4° | 109.5° |
| H50 | C29 | H51 | 109.5° | 109.4° |
| H50 | C29 | H52 | 109.5° | 109.5° |
| H51 | C29 | H52 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C22 | C24 | C23 | 122.4° | 120.0° |
| C17 | C22 | C24 | H24 | 119.8° | 120.1° |
| C17 | C22 | C23 | H24 | 119.4° | 120.0° |
| C22 | C17 | O4 | C16 | 128.7° | 120.0° |
| C22 | C17 | O4 | H23 | 115.9° | 120.0° |
| C22 | C17 | C16 | H23 | 119.9° | 120.0° |
| C17 | C22 | C24 | O7 | 51.8° | 175.0° |
| C22 | C17 | C16 | C25 | 161.9° | 180.0° |
| C22 | C17 | C16 | N4 | 82.2° | 59.9° |
| C22 | C17 | C16 | H13 | 43.0° | 60.0° |
| C17 | C22 | C23 | H25 | 180.0° | 64.4° |
| C17 | C22 | C23 | H26 | 60.0° | 55.5° |
| C17 | C22 | C23 | H27 | 60.0° | 175.6° |
| C17 | C22 | C24 | H28 | 172.0° | 55.0° |
| C17 | C22 | C24 | H29 | 68.5° | 65.0° |
| C22 | C17 | O4 | H31 | 180.0° | 60.0° |
| C24 | C22 | C23 | H24 | 117.8° | 120.0° |
| C24 | C22 | C17 | O4 | 23.2° | 174.6° |
| C24 | C22 | C17 | C16 | 99.9° | 65.4° |
| C22 | C24 | O7 | H28 | 120.2° | 120.0° |
| C22 | C24 | O7 | H29 | 120.2° | 120.0° |
| C24 | C22 | C17 | H23 | 140.1° | 54.6° |
| C24 | C22 | C23 | H25 | 57.3° | 55.6° |
| C24 | C22 | C23 | H26 | 62.7° | 175.6° |
| C24 | C22 | C23 | H27 | 177.3° | 64.3° |
| C22 | C24 | H28 | H29 | 119.3° | 119.9° |
| C22 | C24 | O7 | H30 | 180.0° | 180.0° |
| C23 | C22 | C17 | O4 | 143.6° | 54.6° |
| C23 | C22 | C17 | C16 | 20.4° | 174.6° |
| C23 | C22 | C24 | O7 | 70.7° | 65.0° |
| C23 | C22 | C17 | H23 | 99.6° | 65.4° |
| C22 | C23 | H25 | H26 | 120.0° | 120.0° |
| C22 | C23 | H25 | H27 | 120.0° | 120.0° |
| C22 | C23 | H26 | H27 | 120.0° | 120.1° |
| C23 | C22 | C24 | H28 | 49.6° | 175.0° |
| C23 | C22 | C24 | H29 | 169.1° | 55.1° |
| O4 | C17 | C16 | H23 | 116.3° | 119.9° |
| O4 | C17 | C16 | C25 | 74.3° | 59.9° |
| O4 | C17 | C16 | N4 | 41.5° | 60.1° |
| O4 | C17 | C16 | H13 | 166.8° | 180.0° |
| O4 | C17 | C22 | H24 | 96.8° | 65.3° |
| C17 | C16 | C25 | C26 | 131.4° | 175.0° |
| C17 | C16 | C25 | N4 | 124.8° | 120.0° |
| C17 | C16 | C25 | H13 | 118.9° | 120.0° |
| C17 | C16 | N4 | H13 | 124.7° | 120.0° |
| C17 | C16 | N4 | C15 | 127.7° | 134.9° |
| C17 | C16 | N4 | H12 | 52.3° | 45.2° |
| C17 | C16 | C25 | H14 | 10.1° | 65.0° |
| C17 | C16 | C25 | H15 | 107.3° | 55.0° |
| C16 | C17 | C22 | H24 | 140.0° | 54.6° |
| C16 | C17 | O4 | H31 | 51.3° | 60.0° |
| O7 | C24 | C22 | H24 | 171.5° | 54.9° |
| O7 | C24 | H28 | H29 | 119.3° | 120.0° |
| C26 | C25 | C16 | H14 | 121.3° | 120.0° |
| C26 | C25 | C16 | H15 | 121.3° | 120.0° |
| C25 | C26 | C27 | C28 | 126.2° | 120.0° |
| C25 | C26 | C27 | H16 | 117.3° | 120.0° |
| C25 | C26 | C28 | H16 | 120.1° | 120.0° |
| C26 | C25 | C16 | N4 | 103.8° | 65.0° |
| C26 | C25 | C16 | H13 | 12.5° | 55.0° |
| C26 | C25 | H14 | H15 | 115.9° | 120.0° |
| C25 | C26 | C28 | H17 | 180.0° | 60.0° |
| C25 | C26 | C28 | H18 | 60.0° | 180.0° |
| C25 | C26 | C28 | H19 | 60.0° | 60.0° |
| C25 | C26 | C27 | H20 | 180.0° | 180.0° |
| C25 | C26 | C27 | H21 | 60.0° | 60.0° |
| C25 | C26 | C27 | H22 | 60.0° | 60.0° |
| C16 | C25 | C26 | C27 | 176.4° | 65.0° |
| C16 | C25 | C26 | C28 | 54.0° | 175.0° |
| C25 | C16 | N4 | H13 | 115.6° | 120.0° |
| C25 | C16 | N4 | C15 | 112.5° | 105.0° |
| C25 | C16 | N4 | H12 | 67.5° | 74.9° |
| C16 | C25 | H14 | H15 | 115.9° | 119.9° |
| C16 | C25 | C26 | H16 | 66.2° | 55.0° |
| C25 | C16 | C17 | H23 | 42.0° | 60.0° |
| C27 | C26 | C28 | H16 | 116.4° | 120.0° |
| C27 | C26 | C25 | H14 | 62.3° | 175.0° |
| C27 | C26 | C25 | H15 | 55.2° | 55.0° |
| C27 | C26 | C28 | H17 | 56.5° | 60.0° |
| C27 | C26 | C28 | H18 | 176.5° | 60.0° |
| C27 | C26 | C28 | H19 | 63.5° | 180.0° |
| C26 | C27 | H20 | H21 | 120.0° | 120.0° |
| C26 | C27 | H20 | H22 | 120.0° | 120.0° |
| C26 | C27 | H21 | H22 | 120.0° | 120.0° |
| C28 | C26 | C25 | H14 | 175.2° | 55.0° |
| C28 | C26 | C25 | H15 | 67.3° | 65.0° |
| C26 | C28 | H17 | H18 | 120.0° | 120.0° |
| C26 | C28 | H17 | H19 | 120.0° | 120.0° |
| C26 | C28 | H18 | H19 | 120.0° | 120.0° |
| C28 | C26 | C27 | H20 | 53.8° | 60.0° |
| C28 | C26 | C27 | H21 | 66.2° | 60.0° |
| C28 | C26 | C27 | H22 | 173.8° | 180.0° |
| C16 | N4 | C15 | H12 | 180.0° | 179.9° |
| C16 | N4 | C15 | O3 | 2.7° | 0.0° |
| C16 | N4 | C15 | C11 | 177.0° | 180.0° |
| N4 | C16 | C25 | H14 | 134.9° | 55.0° |
| N4 | C16 | C25 | H15 | 17.5° | 175.0° |
| N4 | C16 | C17 | H23 | 157.9° | 180.0° |
| N4 | C15 | O3 | C11 | 179.6° | 180.0° |
| N4 | C15 | C11 | C12 | 64.5° | 60.0° |
| N4 | C15 | C11 | N2 | 168.2° | 180.0° |
| N4 | C15 | C11 | H11 | 50.7° | 60.0° |
| C15 | N4 | C16 | H13 | 3.1° | 14.9° |
| O3 | C15 | C11 | C12 | 115.9° | 120.1° |
| O3 | C15 | C11 | N2 | 11.4° | 0.1° |
| O3 | C15 | C11 | H11 | 128.9° | 120.0° |
| O3 | C15 | N4 | H12 | 177.4° | 179.9° |
| C15 | C11 | C12 | N2 | 129.8° | 120.0° |
| C15 | C11 | C12 | H11 | 115.3° | 119.9° |
| C15 | C11 | C12 | C13 | 170.0° | 175.0° |
| C15 | C11 | N2 | H11 | 117.2° | 120.0° |
| C15 | C11 | N2 | C10 | 109.6° | 155.0° |
| C15 | C11 | C12 | H9 | 69.9° | 55.0° |
| C15 | C11 | C12 | H10 | 49.9° | 65.1° |
| C11 | C15 | N4 | H12 | 3.0° | 0.0° |
| C15 | C11 | N2 | H32 | 70.4° | 25.0° |
| C11 | C12 | C13 | H9 | 120.1° | 120.0° |
| C11 | C12 | C13 | H10 | 120.1° | 119.9° |
| C12 | C11 | N2 | H11 | 114.5° | 120.0° |
| C11 | C12 | C13 | C14 | 147.8° | 180.0° |
| C12 | C11 | N2 | C10 | 122.1° | 85.0° |
| C11 | C12 | C13 | H7 | 27.9° | 60.0° |
| C11 | C12 | C13 | H8 | 92.3° | 60.0° |
| C11 | C12 | H9 | H10 | 119.8° | 120.0° |
| C12 | C11 | N2 | H32 | 57.9° | 95.0° |
| C13 | C12 | C11 | N2 | 60.2° | 65.0° |
| C12 | C13 | C14 | O8 | 82.0° | 0.0° |
| C12 | C13 | C14 | N3 | 98.5° | 179.7° |
| C12 | C13 | C14 | H7 | 119.9° | 120.0° |
| C12 | C13 | C14 | H8 | 119.9° | 120.0° |
| C12 | C13 | H7 | H8 | 120.2° | 120.0° |
| C13 | C12 | H9 | H10 | 119.7° | 120.0° |
| C13 | C12 | C11 | H11 | 54.7° | 55.1° |
| C11 | N2 | C10 | H32 | 180.0° | 180.0° |
| C11 | N2 | C10 | O2 | 0.3° | 0.0° |
| C11 | N2 | C10 | C6 | 178.6° | 180.0° |
| N2 | C11 | C12 | H9 | 59.9° | 175.0° |
| N2 | C11 | C12 | H10 | 179.7° | 54.9° |
| O8 | C14 | N3 | C31 | 104.3° | 180.0° |
| O8 | C14 | N3 | C13 | 179.6° | 179.7° |
| O8 | C14 | N3 | C30 | 75.3° | 0.0° |
| O8 | C14 | C13 | H7 | 37.9° | 120.0° |
| O8 | C14 | C13 | H8 | 158.1° | 120.0° |
| C31 | N3 | C14 | C30 | 179.6° | 180.0° |
| C31 | N3 | C14 | C13 | 76.1° | 0.3° |
| N3 | C31 | H1 | H2 | 120.0° | 120.0° |
| N3 | C31 | H1 | H3 | 120.0° | 120.1° |
| N3 | C31 | H2 | H3 | 120.0° | 120.1° |
| C31 | N3 | C30 | H4 | 180.0° | 180.0° |
| C31 | N3 | C30 | H5 | 60.0° | 60.0° |
| C31 | N3 | C30 | H6 | 60.0° | 60.0° |
| C14 | N3 | C31 | H1 | 180.0° | 90.0° |
| C14 | N3 | C31 | H2 | 60.0° | 150.0° |
| C14 | N3 | C31 | H3 | 60.0° | 30.0° |
| C14 | N3 | C30 | H4 | 0.4° | 0.0° |
| C14 | N3 | C30 | H5 | 120.4° | 120.0° |
| C14 | N3 | C30 | H6 | 119.7° | 120.0° |
| N3 | C14 | C13 | H7 | 141.6° | 60.3° |
| N3 | C14 | C13 | H8 | 21.4° | 59.7° |
| C13 | C14 | N3 | C30 | 104.2° | 179.7° |
| C14 | C13 | H7 | H8 | 120.3° | 120.0° |
| C14 | C13 | C12 | H9 | 92.1° | 60.0° |
| C14 | C13 | C12 | H10 | 27.7° | 60.1° |
| C30 | N3 | C31 | H1 | 0.3° | 90.0° |
| C30 | N3 | C31 | H2 | 120.4° | 30.0° |
| C30 | N3 | C31 | H3 | 119.7° | 150.0° |
| N3 | C30 | H4 | H5 | 120.0° | 120.0° |
| N3 | C30 | H4 | H6 | 120.0° | 119.9° |
| N3 | C30 | H5 | H6 | 120.0° | 119.9° |
| N2 | C10 | O2 | C6 | 178.9° | 180.0° |
| N2 | C10 | C6 | C7 | 99.5° | 60.0° |
| N2 | C10 | C6 | N1 | 141.0° | 180.0° |
| C10 | N2 | C11 | H11 | 7.7° | 35.0° |
| N2 | C10 | C6 | H33 | 22.3° | 60.0° |
| O2 | C10 | C6 | C7 | 81.5° | 120.0° |
| O2 | C10 | C6 | N1 | 38.0° | 0.0° |
| O2 | C10 | N2 | H32 | 179.7° | 180.0° |
| O2 | C10 | C6 | H33 | 156.7° | 120.0° |
| C8 | C7 | C6 | C10 | 14.9° | 59.9° |
| C8 | C7 | C6 | C9 | 125.1° | 120.1° |
| C8 | C7 | C6 | H34 | 118.5° | 119.9° |
| C8 | C7 | C9 | H34 | 115.9° | 120.0° |
| C8 | C7 | C6 | N1 | 133.9° | 60.1° |
| C8 | C7 | C6 | H33 | 107.1° | 180.0° |
| C8 | C7 | C9 | H35 | 180.0° | 60.0° |
| C8 | C7 | C9 | H36 | 60.0° | 180.0° |
| C8 | C7 | C9 | H37 | 60.0° | 60.0° |
| C7 | C8 | H38 | H39 | 120.1° | 120.0° |
| C7 | C8 | H38 | H40 | 120.0° | 120.0° |
| C7 | C8 | H39 | H40 | 120.0° | 119.9° |
| C10 | C6 | C7 | N1 | 119.0° | 120.0° |
| C10 | C6 | C7 | H33 | 121.9° | 120.1° |
| C10 | C6 | C7 | C9 | 140.0° | 180.0° |
| C10 | C6 | N1 | H33 | 118.2° | 120.0° |
| C10 | C6 | N1 | C5 | 83.2° | 155.0° |
| C6 | C10 | N2 | H32 | 1.4° | 0.0° |
| C10 | C6 | C7 | H34 | 103.7° | 60.0° |
| C10 | C6 | N1 | H41 | 96.7° | 25.0° |
| C6 | C7 | C9 | H34 | 116.3° | 120.0° |
| C7 | C6 | N1 | H33 | 118.4° | 120.0° |
| C7 | C6 | N1 | C5 | 153.3° | 85.0° |
| C6 | C7 | C9 | H35 | 52.1° | 180.0° |
| C6 | C7 | C9 | H36 | 172.1° | 60.0° |
| C6 | C7 | C9 | H37 | 67.9° | 60.0° |
| C6 | C7 | C8 | H38 | 180.0° | 60.0° |
| C6 | C7 | C8 | H39 | 60.0° | 180.0° |
| C6 | C7 | C8 | H40 | 60.0° | 60.1° |
| C7 | C6 | N1 | H41 | 26.7° | 95.0° |
| C9 | C7 | C6 | N1 | 101.0° | 60.0° |
| C9 | C7 | C6 | H33 | 18.1° | 60.0° |
| C7 | C9 | H35 | H36 | 120.0° | 120.0° |
| C7 | C9 | H35 | H37 | 120.0° | 120.0° |
| C7 | C9 | H36 | H37 | 120.0° | 120.0° |
| C9 | C7 | C8 | H38 | 54.4° | 180.0° |
| C9 | C7 | C8 | H39 | 174.4° | 60.0° |
| C9 | C7 | C8 | H40 | 65.6° | 60.0° |
| C6 | N1 | C5 | H41 | 180.0° | 179.9° |
| C6 | N1 | C5 | O1 | 1.5° | 0.0° |
| C6 | N1 | C5 | C4 | 178.2° | 180.0° |
| N1 | C6 | C7 | H34 | 15.3° | 180.0° |
| N1 | C5 | O1 | C4 | 179.7° | 179.9° |
| N1 | C5 | C4 | C1 | 103.5° | 180.0° |
| C5 | N1 | C6 | H33 | 34.9° | 35.0° |
| N1 | C5 | C4 | H42 | 136.1° | 60.0° |
| N1 | C5 | C4 | H43 | 16.9° | 60.0° |
| O1 | C5 | C4 | C1 | 76.8° | 0.0° |
| O1 | C5 | N1 | H41 | 178.5° | 180.0° |
| O1 | C5 | C4 | H42 | 43.6° | 119.9° |
| O1 | C5 | C4 | H43 | 162.8° | 120.0° |
| C5 | C4 | C1 | H42 | 120.4° | 120.0° |
| C5 | C4 | C1 | H43 | 120.4° | 120.0° |
| C5 | C4 | C1 | C2 | 119.3° | 180.0° |
| C4 | C5 | N1 | H41 | 1.8° | 0.1° |
| C5 | C4 | H42 | H43 | 118.8° | 120.0° |
| C5 | C4 | C1 | H44 | 120.4° | 60.0° |
| C5 | C4 | C1 | H45 | 1.0° | 60.0° |
| C4 | C1 | C2 | H44 | 120.3° | 120.0° |
| C4 | C1 | C2 | H45 | 120.2° | 120.0° |
| C4 | C1 | C2 | C3 | 110.6° | 180.0° |
| C1 | C4 | H42 | H43 | 118.8° | 120.0° |
| C4 | C1 | H44 | H45 | 119.2° | 120.0° |
| C4 | C1 | C2 | H46 | 129.0° | 60.1° |
| C4 | C1 | C2 | H47 | 9.6° | 60.0° |
| C1 | C2 | C3 | H46 | 120.3° | 119.9° |
| C1 | C2 | C3 | H47 | 120.3° | 120.0° |
| C1 | C2 | C3 | C29 | 118.3° | 180.0° |
| C2 | C1 | C4 | H42 | 1.1° | 60.0° |
| C2 | C1 | C4 | H43 | 120.3° | 60.0° |
| C2 | C1 | H44 | H45 | 119.2° | 120.0° |
| C1 | C2 | H46 | H47 | 119.1° | 120.1° |
| C1 | C2 | C3 | H48 | 121.5° | 60.0° |
| C1 | C2 | C3 | H49 | 1.8° | 60.0° |
| C2 | C3 | C29 | H48 | 120.2° | 120.0° |
| C2 | C3 | C29 | H49 | 120.2° | 120.0° |
| C3 | C2 | C1 | H44 | 9.6° | 60.0° |
| C3 | C2 | C1 | H45 | 129.1° | 60.0° |
| C3 | C2 | H46 | H47 | 119.0° | 120.0° |
| C2 | C3 | H48 | H49 | 119.5° | 120.1° |
| C2 | C3 | C29 | H50 | 180.0° | 60.0° |
| C2 | C3 | C29 | H51 | 60.0° | 60.0° |
| C2 | C3 | C29 | H52 | 60.0° | 180.0° |
| C29 | C3 | C2 | H46 | 2.0° | 60.0° |
| C29 | C3 | C2 | H47 | 121.3° | 60.0° |
| C29 | C3 | H48 | H49 | 119.5° | 119.9° |
| C3 | C29 | H50 | H51 | 120.0° | 120.0° |
| C3 | C29 | H50 | H52 | 120.0° | 120.0° |
| C3 | C29 | H51 | H52 | 120.0° | 120.0° |
| H1 | C31 | H2 | H3 | 120.0° | 119.9° |
| H4 | C30 | H5 | H6 | 120.0° | 120.1° |
| H7 | C13 | C12 | H9 | 147.9° | 180.0° |
| H7 | C13 | C12 | H10 | 92.2° | 59.9° |
| H8 | C13 | C12 | H9 | 27.8° | 60.0° |
| H8 | C13 | C12 | H10 | 147.6° | 179.9° |
| H9 | C12 | C11 | H11 | 174.8° | 64.9° |
| H10 | C12 | C11 | H11 | 65.3° | 175.0° |
| H11 | C11 | N2 | H32 | 172.3° | 145.0° |
| H12 | N4 | C16 | H13 | 177.0° | 165.1° |
| H13 | C16 | C25 | H14 | 108.8° | 175.0° |
| H13 | C16 | C25 | H15 | 133.8° | 65.0° |
| H13 | C16 | C17 | H23 | 76.9° | 60.0° |
| H14 | C25 | C26 | H16 | 55.1° | 65.0° |
| H15 | C25 | C26 | H16 | 172.5° | 175.0° |
| H16 | C26 | C28 | H17 | 59.9° | 180.0° |
| H16 | C26 | C28 | H18 | 60.1° | 60.1° |
| H16 | C26 | C28 | H19 | 179.9° | 60.0° |
| H16 | C26 | C27 | H20 | 62.7° | 60.1° |
| H16 | C26 | C27 | H21 | 177.3° | 180.0° |
| H16 | C26 | C27 | H22 | 57.3° | 60.0° |
| H17 | C28 | H18 | H19 | 120.0° | 119.9° |
| H20 | C27 | H21 | H22 | 120.0° | 120.0° |
| H23 | C17 | C22 | H24 | 20.1° | 174.7° |
| H23 | C17 | O4 | H31 | 64.1° | 180.0° |
| H24 | C22 | C23 | H25 | 60.6° | 175.6° |
| H24 | C22 | C23 | H26 | 179.4° | 64.5° |
| H24 | C22 | C23 | H27 | 59.4° | 55.6° |
| H24 | C22 | C24 | H28 | 68.2° | 65.1° |
| H24 | C22 | C24 | H29 | 51.3° | 175.0° |
| H25 | C23 | H26 | H27 | 120.0° | 119.9° |
| H28 | C24 | O7 | H30 | 59.8° | 60.0° |
| H29 | C24 | O7 | H30 | 59.8° | 60.0° |
| H33 | C6 | C7 | H34 | 134.4° | 60.1° |
| H33 | C6 | N1 | H41 | 145.1° | 145.0° |
| H34 | C7 | C9 | H35 | 64.2° | 60.0° |
| H34 | C7 | C9 | H36 | 55.8° | 60.0° |
| H34 | C7 | C9 | H37 | 175.8° | 180.0° |
| H34 | C7 | C8 | H38 | 61.5° | 60.0° |
| H34 | C7 | C8 | H39 | 58.5° | 60.0° |
| H34 | C7 | C8 | H40 | 178.5° | 180.0° |
| H35 | C9 | H36 | H37 | 120.0° | 120.0° |
| H38 | C8 | H39 | H40 | 119.9° | 120.0° |
| H42 | C4 | C1 | H44 | 119.2° | 180.0° |
| H42 | C4 | C1 | H45 | 121.4° | 60.0° |
| H43 | C4 | C1 | H44 | 0.0° | 60.0° |
| H43 | C4 | C1 | H45 | 119.4° | 180.0° |
| H44 | C1 | C2 | H46 | 110.7° | 180.0° |
| H44 | C1 | C2 | H47 | 129.9° | 60.0° |
| H45 | C1 | C2 | H46 | 8.8° | 60.0° |
| H45 | C1 | C2 | H47 | 110.6° | 180.0° |
| H46 | C2 | C3 | H48 | 118.2° | 179.9° |
| H46 | C2 | C3 | H49 | 122.2° | 59.9° |
| H47 | C2 | C3 | H48 | 1.2° | 60.0° |
| H47 | C2 | C3 | H49 | 118.5° | 179.9° |
| H48 | C3 | C29 | H50 | 59.8° | 180.0° |
| H48 | C3 | C29 | H51 | 179.8° | 60.1° |
| H48 | C3 | C29 | H52 | 60.2° | 60.0° |
| H49 | C3 | C29 | H50 | 59.9° | 60.1° |
| H49 | C3 | C29 | H51 | 60.2° | 180.0° |
| H49 | C3 | C29 | H52 | 179.9° | 60.0° |
| H50 | C29 | H51 | H52 | 120.0° | 120.0° |
