LA1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O70 | C69 | doub | 1.21Å | 1.22Å | |
| C69 | N71 | sing | 1.35Å | 1.34Å | |
| C69 | C30 | sing | 1.51Å | 1.51Å | |
| N71 | C73 | sing | 1.46Å | 1.45Å | |
| N71 | H71 | sing | 0.97Å | 1.02Å | |
| C73 | H731 | sing | 1.09Å | 1.11Å | |
| C73 | H732 | sing | 1.09Å | 1.12Å | |
| C73 | H733 | sing | 1.09Å | 1.11Å | |
| C30 | C49 | sing | 1.53Å | 1.54Å | |
| C30 | N2 | sing | 1.46Å | 1.47Å | |
| C30 | H30 | sing | 1.09Å | 1.11Å | |
| C49 | C52 | sing | 1.51Å | 1.52Å | |
| C49 | H491 | sing | 1.09Å | 1.11Å | |
| C49 | H492 | sing | 1.09Å | 1.11Å | |
| C52 | C59 | doub | 1.36Å | 1.42Å | Aromatic |
| C52 | C53 | sing | 1.39Å | 1.37Å | Aromatic |
| C59 | C58 | sing | 1.41Å | 1.40Å | Aromatic |
| C59 | H59 | sing | 1.08Å | 1.10Å | |
| C58 | C61 | doub | 1.41Å | 1.42Å | Aromatic |
| C58 | C57 | sing | 1.42Å | 1.39Å | Aromatic |
| C61 | C63 | sing | 1.36Å | 1.40Å | Aromatic |
| C61 | H61 | sing | 1.08Å | 1.10Å | |
| C63 | C65 | doub | 1.39Å | 1.40Å | Aromatic |
| C63 | H63 | sing | 1.08Å | 1.10Å | |
| C65 | C67 | sing | 1.36Å | 1.40Å | Aromatic |
| C65 | H65 | sing | 1.08Å | 1.10Å | |
| C67 | C57 | doub | 1.40Å | 1.40Å | Aromatic |
| C67 | H67 | sing | 1.08Å | 1.10Å | |
| C57 | C55 | sing | 1.41Å | 1.40Å | Aromatic |
| C55 | C53 | doub | 1.36Å | 1.39Å | Aromatic |
| C55 | H55 | sing | 1.08Å | 1.10Å | |
| C53 | H53 | sing | 1.08Å | 1.10Å | |
| N2 | C3 | sing | 1.45Å | 1.45Å | |
| N2 | C1 | sing | 1.26Å | 1.34Å | |
| C3 | C6 | sing | 1.54Å | 1.54Å | |
| C3 | H31 | sing | 1.09Å | 1.12Å | |
| C3 | H32 | sing | 1.09Å | 1.12Å | |
| C6 | C9 | sing | 1.49Å | 1.52Å | |
| C6 | H61A | sing | 1.09Å | 1.11Å | |
| C6 | H62 | sing | 1.09Å | 1.11Å | |
| C9 | O10 | doub | 1.21Å | 1.23Å | |
| C9 | N11 | sing | 1.26Å | 1.33Å | |
| N11 | C12 | sing | 1.45Å | 1.46Å | |
| N11 | C27 | sing | 1.46Å | 1.46Å | |
| C12 | C14 | sing | 1.53Å | 1.58Å | |
| C12 | C1 | sing | 1.49Å | 1.51Å | |
| C12 | H12 | sing | 1.09Å | 1.12Å | |
| C14 | C17 | sing | 1.53Å | 1.54Å | |
| C14 | H141 | sing | 1.09Å | 1.12Å | |
| C14 | H142 | sing | 1.09Å | 1.11Å | |
| C17 | C23 | sing | 1.53Å | 1.56Å | |
| C17 | C19 | sing | 1.53Å | 1.53Å | |
| C17 | H17 | sing | 1.09Å | 1.11Å | |
| C23 | H231 | sing | 1.09Å | 1.12Å | |
| C23 | H232 | sing | 1.09Å | 1.12Å | |
| C23 | H233 | sing | 1.09Å | 1.12Å | |
| C19 | H191 | sing | 1.09Å | 1.11Å | |
| C19 | H192 | sing | 1.09Å | 1.12Å | |
| C19 | H193 | sing | 1.09Å | 1.12Å | |
| C1 | O32 | doub | 1.21Å | 1.23Å | |
| C27 | C33 | sing | 1.51Å | 1.49Å | |
| C27 | H271 | sing | 1.09Å | 1.11Å | |
| C27 | H272 | sing | 1.09Å | 1.12Å | |
| C33 | C39 | doub | 1.37Å | 1.45Å | Aromatic |
| C33 | C34 | sing | 1.39Å | 1.32Å | Aromatic |
| C39 | C38 | sing | 1.41Å | 1.51Å | Aromatic |
| C39 | H39 | sing | 1.08Å | 1.10Å | |
| C38 | C41 | doub | 1.40Å | 1.40Å | Aromatic |
| C38 | C37 | sing | 1.42Å | 1.39Å | Aromatic |
| C41 | C43 | sing | 1.36Å | 1.40Å | Aromatic |
| C41 | H41 | sing | 1.08Å | 1.10Å | |
| C43 | C45 | doub | 1.39Å | 1.40Å | Aromatic |
| C43 | H43 | sing | 1.08Å | 1.10Å | |
| C45 | C47 | sing | 1.36Å | 1.40Å | Aromatic |
| C45 | H45 | sing | 1.08Å | 1.10Å | |
| C47 | C37 | doub | 1.41Å | 1.40Å | Aromatic |
| C47 | H47 | sing | 1.08Å | 1.10Å | |
| C37 | N36 | sing | 1.34Å | 1.44Å | Aromatic |
| N36 | C34 | doub | 1.31Å | 1.45Å | Aromatic |
| C34 | H34 | sing | 1.08Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O70 | C69 | N71 | 123.6° | 119.9° |
| O70 | C69 | C30 | 120.4° | 120.0° |
| N71 | C69 | C30 | 115.9° | 120.1° |
| C69 | N71 | C73 | 122.4° | 120.0° |
| C69 | N71 | H71 | 114.8° | 120.0° |
| C69 | C30 | C49 | 111.4° | 109.4° |
| C69 | C30 | N2 | 108.4° | 109.5° |
| C69 | C30 | H30 | 109.8° | 109.4° |
| C73 | N71 | H71 | 122.8° | 120.0° |
| N71 | C73 | H731 | 107.6° | 109.5° |
| N71 | C73 | H732 | 122.4° | 109.4° |
| N71 | C73 | H733 | 107.7° | 109.4° |
| H731 | C73 | H732 | 107.6° | 109.5° |
| H731 | C73 | H733 | 102.2° | 109.5° |
| H732 | C73 | H733 | 107.6° | 109.5° |
| C49 | C30 | N2 | 111.8° | 109.5° |
| C49 | C30 | H30 | 106.2° | 109.4° |
| C30 | C49 | C52 | 115.1° | 109.4° |
| C30 | C49 | H491 | 110.2° | 109.5° |
| C30 | C49 | H492 | 110.2° | 109.5° |
| N2 | C30 | H30 | 109.3° | 109.5° |
| C30 | N2 | C3 | 120.7° | 109.9° |
| C30 | N2 | C1 | 118.3° | 109.9° |
| C52 | C49 | H491 | 110.1° | 109.5° |
| C52 | C49 | H492 | 110.1° | 109.5° |
| C49 | C52 | C59 | 120.9° | 119.5° |
| C49 | C52 | C53 | 119.8° | 119.5° |
| H491 | C49 | H492 | 100.1° | 109.5° |
| C59 | C52 | C53 | 119.2° | 121.0° |
| C52 | C59 | C58 | 120.6° | 119.6° |
| C52 | C59 | H59 | 120.4° | 120.2° |
| C52 | C53 | C55 | 120.2° | 121.0° |
| C52 | C53 | H53 | 119.3° | 119.5° |
| C58 | C59 | H59 | 119.0° | 120.1° |
| C59 | C58 | C61 | 121.7° | 121.3° |
| C59 | C58 | C57 | 119.3° | 119.4° |
| C61 | C58 | C57 | 119.0° | 119.3° |
| C58 | C61 | C63 | 119.5° | 119.7° |
| C58 | C61 | H61 | 120.8° | 120.1° |
| C58 | C57 | C67 | 121.3° | 119.4° |
| C58 | C57 | C55 | 119.6° | 119.3° |
| C63 | C61 | H61 | 119.7° | 120.2° |
| C61 | C63 | C65 | 121.0° | 121.0° |
| C61 | C63 | H63 | 119.4° | 119.5° |
| C65 | C63 | H63 | 119.6° | 119.5° |
| C63 | C65 | C67 | 118.9° | 121.0° |
| C63 | C65 | H65 | 120.8° | 119.5° |
| C67 | C65 | H65 | 120.2° | 119.5° |
| C65 | C67 | C57 | 120.3° | 119.6° |
| C65 | C67 | H67 | 119.8° | 120.1° |
| C57 | C67 | H67 | 119.9° | 120.2° |
| C67 | C57 | C55 | 119.1° | 121.3° |
| C57 | C55 | C53 | 120.9° | 119.7° |
| C57 | C55 | H55 | 119.8° | 120.2° |
| C53 | C55 | H55 | 119.3° | 120.1° |
| C55 | C53 | H53 | 120.5° | 119.5° |
| C3 | N2 | C1 | 120.9° | 140.2° |
| N2 | C3 | C6 | 110.3° | 109.2° |
| N2 | C3 | H31 | 111.9° | 109.5° |
| N2 | C3 | H32 | 111.9° | 109.6° |
| N2 | C1 | C12 | 122.1° | 130.2° |
| N2 | C1 | O32 | 123.3° | 114.8° |
| C6 | C3 | H31 | 111.9° | 109.5° |
| C6 | C3 | H32 | 111.9° | 109.5° |
| C3 | C6 | C9 | 117.7° | 109.1° |
| C3 | C6 | H61A | 109.2° | 109.5° |
| C3 | C6 | H62 | 109.2° | 109.6° |
| H31 | C3 | H32 | 98.5° | 109.6° |
| C9 | C6 | H61A | 109.2° | 109.6° |
| C9 | C6 | H62 | 109.2° | 109.5° |
| C6 | C9 | O10 | 115.3° | 110.5° |
| C6 | C9 | N11 | 127.2° | 138.9° |
| H61A | C6 | H62 | 100.9° | 109.6° |
| O10 | C9 | N11 | 117.5° | 110.6° |
| C9 | N11 | C12 | 125.0° | 131.5° |
| C9 | N11 | C27 | 117.0° | 114.2° |
| C12 | N11 | C27 | 118.0° | 114.3° |
| N11 | C12 | C14 | 106.2° | 108.5° |
| N11 | C12 | C1 | 120.6° | 114.4° |
| N11 | C12 | H12 | 105.3° | 108.5° |
| N11 | C27 | C33 | 110.1° | 109.4° |
| N11 | C27 | H271 | 112.0° | 109.5° |
| N11 | C27 | H272 | 111.9° | 109.5° |
| C14 | C12 | C1 | 113.0° | 108.3° |
| C14 | C12 | H12 | 114.4° | 108.4° |
| C12 | C14 | C17 | 117.4° | 109.4° |
| C12 | C14 | H141 | 109.3° | 109.5° |
| C12 | C14 | H142 | 109.3° | 109.5° |
| C1 | C12 | H12 | 97.2° | 108.6° |
| C12 | C1 | O32 | 114.5° | 114.9° |
| C17 | C14 | H141 | 109.4° | 109.5° |
| C17 | C14 | H142 | 109.4° | 109.4° |
| C14 | C17 | C23 | 109.2° | 109.5° |
| C14 | C17 | C19 | 110.9° | 109.5° |
| C14 | C17 | H17 | 109.1° | 109.5° |
| H141 | C14 | H142 | 100.8° | 109.5° |
| C23 | C17 | C19 | 110.6° | 109.5° |
| C23 | C17 | H17 | 109.4° | 109.5° |
| C17 | C23 | H231 | 112.3° | 109.5° |
| C17 | C23 | H232 | 109.2° | 109.5° |
| C17 | C23 | H233 | 112.3° | 109.5° |
| C19 | C17 | H17 | 107.6° | 109.4° |
| C17 | C19 | H191 | 111.7° | 109.5° |
| C17 | C19 | H192 | 111.0° | 109.5° |
| C17 | C19 | H193 | 111.7° | 109.5° |
| H231 | C23 | H232 | 112.3° | 109.5° |
| H231 | C23 | H233 | 98.2° | 109.5° |
| H232 | C23 | H233 | 112.3° | 109.4° |
| H191 | C19 | H192 | 111.6° | 109.5° |
| H191 | C19 | H193 | 98.7° | 109.4° |
| H192 | C19 | H193 | 111.7° | 109.5° |
| C33 | C27 | H271 | 111.9° | 109.5° |
| C33 | C27 | H272 | 112.0° | 109.4° |
| C27 | C33 | C39 | 119.7° | 120.1° |
| C27 | C33 | C34 | 118.9° | 120.0° |
| H271 | C27 | H272 | 98.5° | 109.5° |
| C39 | C33 | C34 | 121.4° | 119.9° |
| C33 | C39 | C38 | 118.2° | 118.2° |
| C33 | C39 | H39 | 119.1° | 120.9° |
| C33 | C34 | N36 | 120.9° | 121.7° |
| C33 | C34 | H34 | 114.9° | 119.1° |
| C38 | C39 | H39 | 122.7° | 120.9° |
| C39 | C38 | C41 | 119.9° | 121.4° |
| C39 | C38 | C37 | 119.3° | 119.0° |
| C41 | C38 | C37 | 120.8° | 119.6° |
| C38 | C41 | C43 | 118.7° | 119.6° |
| C38 | C41 | H41 | 120.7° | 120.2° |
| C38 | C37 | C47 | 120.6° | 119.1° |
| C38 | C37 | N36 | 118.9° | 119.8° |
| C43 | C41 | H41 | 120.6° | 120.2° |
| C41 | C43 | C45 | 120.8° | 120.9° |
| C41 | C43 | H43 | 119.6° | 119.5° |
| C45 | C43 | H43 | 119.7° | 119.6° |
| C43 | C45 | C47 | 120.2° | 121.0° |
| C43 | C45 | H45 | 120.0° | 119.5° |
| C47 | C45 | H45 | 119.8° | 119.5° |
| C45 | C47 | C37 | 119.0° | 119.7° |
| C45 | C47 | H47 | 120.3° | 120.1° |
| C37 | C47 | H47 | 120.8° | 120.1° |
| C47 | C37 | N36 | 120.5° | 121.1° |
| C37 | N36 | C34 | 121.2° | 121.3° |
| N36 | C34 | H34 | 124.2° | 119.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O70 | C69 | N71 | C30 | 177.4° | 179.9° |
| O70 | C69 | N71 | C73 | 2.5° | 0.1° |
| O70 | C69 | N71 | H71 | 177.5° | 180.0° |
| O70 | C69 | C30 | C49 | 48.1° | 164.4° |
| O70 | C69 | C30 | N2 | 75.3° | 44.4° |
| O70 | C69 | C30 | H30 | 165.4° | 75.6° |
| C69 | N71 | C73 | H71 | 180.0° | 179.9° |
| C69 | N71 | C73 | H731 | 54.8° | 60.0° |
| C69 | N71 | C73 | H732 | 180.0° | 59.9° |
| C69 | N71 | C73 | H733 | 54.7° | 179.9° |
| N71 | C69 | C30 | C49 | 134.4° | 15.4° |
| N71 | C69 | C30 | N2 | 102.2° | 135.5° |
| N71 | C69 | C30 | H30 | 17.1° | 104.5° |
| C30 | C69 | N71 | C73 | 179.8° | 180.0° |
| C30 | C69 | N71 | H71 | 0.2° | 0.1° |
| C69 | C30 | C49 | N2 | 121.5° | 120.0° |
| C69 | C30 | C49 | H30 | 119.4° | 119.9° |
| C69 | C30 | N2 | H30 | 119.6° | 120.0° |
| C69 | C30 | C49 | C52 | 176.6° | 179.2° |
| C69 | C30 | C49 | H491 | 58.2° | 59.3° |
| C69 | C30 | C49 | H492 | 51.3° | 60.7° |
| C69 | C30 | N2 | C3 | 70.1° | 127.6° |
| C69 | C30 | N2 | C1 | 107.3° | 52.2° |
| N71 | C73 | H731 | H732 | 133.7° | 120.0° |
| N71 | C73 | H731 | H733 | 113.2° | 120.0° |
| N71 | C73 | H732 | H733 | 125.3° | 120.0° |
| H71 | N71 | C73 | H731 | 125.3° | 120.1° |
| H71 | N71 | C73 | H732 | 0.0° | 119.9° |
| H71 | N71 | C73 | H733 | 125.2° | 0.0° |
| H731 | C73 | H732 | H733 | 109.5° | 120.1° |
| C49 | C30 | N2 | H30 | 117.3° | 120.0° |
| C30 | C49 | C52 | H491 | 125.3° | 120.0° |
| C30 | C49 | C52 | H492 | 125.3° | 120.0° |
| C30 | C49 | H491 | H492 | 116.0° | 120.1° |
| C30 | C49 | C52 | C59 | 111.7° | 90.3° |
| C30 | C49 | C52 | C53 | 68.5° | 90.0° |
| C49 | C30 | N2 | C3 | 53.0° | 112.4° |
| C49 | C30 | N2 | C1 | 129.5° | 67.8° |
| N2 | C30 | C49 | C52 | 55.1° | 59.2° |
| N2 | C30 | C49 | H491 | 179.7° | 60.8° |
| N2 | C30 | C49 | H492 | 70.2° | 179.2° |
| C30 | N2 | C3 | C1 | 177.4° | 179.7° |
| C30 | N2 | C3 | C6 | 111.9° | 128.0° |
| C30 | N2 | C3 | H31 | 122.8° | 112.1° |
| C30 | N2 | C3 | H32 | 13.3° | 8.1° |
| C30 | N2 | C1 | C12 | 178.6° | 162.5° |
| C30 | N2 | C1 | O32 | 0.9° | 17.9° |
| H30 | C30 | C49 | C52 | 64.0° | 60.8° |
| H30 | C30 | C49 | H491 | 61.2° | 179.2° |
| H30 | C30 | C49 | H492 | 170.7° | 59.2° |
| H30 | C30 | N2 | C3 | 170.3° | 7.6° |
| H30 | C30 | N2 | C1 | 12.2° | 172.2° |
| C52 | C49 | H491 | H492 | 115.9° | 120.0° |
| C49 | C52 | C59 | C53 | 179.8° | 179.7° |
| C49 | C52 | C59 | C58 | 178.3° | 179.7° |
| C49 | C52 | C59 | H59 | 1.7° | 0.0° |
| C49 | C52 | C53 | C55 | 178.9° | 180.0° |
| C49 | C52 | C53 | H53 | 1.2° | 0.0° |
| H491 | C49 | C52 | C59 | 123.1° | 149.7° |
| H491 | C49 | C52 | C53 | 56.8° | 30.0° |
| H492 | C49 | C52 | C59 | 13.6° | 29.7° |
| H492 | C49 | C52 | C53 | 166.2° | 150.0° |
| C52 | C59 | C58 | H59 | 180.0° | 179.7° |
| C52 | C59 | C58 | C61 | 179.6° | 179.7° |
| C52 | C59 | C58 | C57 | 1.9° | 0.5° |
| C59 | C52 | C53 | C55 | 1.0° | 0.3° |
| C59 | C52 | C53 | H53 | 179.0° | 179.7° |
| C53 | C52 | C59 | C58 | 1.6° | 0.6° |
| C53 | C52 | C59 | H59 | 178.5° | 179.7° |
| C52 | C53 | C55 | C57 | 0.7° | 0.0° |
| C52 | C53 | C55 | H53 | 180.0° | 180.0° |
| C52 | C53 | C55 | H55 | 179.3° | 179.9° |
| C59 | C58 | C61 | C57 | 177.7° | 179.7° |
| C59 | C58 | C61 | C63 | 179.3° | 179.7° |
| C59 | C58 | C61 | H61 | 0.7° | 0.3° |
| C59 | C58 | C57 | C67 | 179.2° | 179.7° |
| C59 | C58 | C57 | C55 | 1.5° | 0.2° |
| H59 | C59 | C58 | C61 | 0.4° | 0.0° |
| H59 | C59 | C58 | C57 | 178.2° | 179.7° |
| C58 | C61 | C63 | H61 | 180.0° | 180.0° |
| C58 | C61 | C63 | C65 | 0.5° | 0.0° |
| C58 | C61 | C63 | H63 | 179.5° | 180.0° |
| C61 | C58 | C57 | C67 | 1.4° | 0.0° |
| C61 | C58 | C57 | C55 | 179.3° | 180.0° |
| C57 | C58 | C61 | C63 | 1.5° | 0.0° |
| C57 | C58 | C61 | H61 | 178.4° | 179.9° |
| C58 | C57 | C67 | C65 | 0.3° | 0.0° |
| C58 | C57 | C67 | C55 | 179.2° | 179.9° |
| C58 | C57 | C67 | H67 | 179.8° | 180.0° |
| C58 | C57 | C55 | C53 | 1.0° | 0.0° |
| C58 | C57 | C55 | H55 | 179.0° | 180.0° |
| C61 | C63 | C65 | H63 | 180.0° | 180.0° |
| C61 | C63 | C65 | C67 | 0.7° | 0.0° |
| C61 | C63 | C65 | H65 | 179.4° | 180.0° |
| H61 | C61 | C63 | C65 | 179.5° | 180.0° |
| H61 | C61 | C63 | H63 | 0.5° | 0.0° |
| C63 | C65 | C67 | H65 | 180.0° | 180.0° |
| C63 | C65 | C67 | C57 | 0.8° | 0.0° |
| C63 | C65 | C67 | H67 | 179.2° | 180.0° |
| H63 | C63 | C65 | C67 | 179.3° | 180.0° |
| H63 | C63 | C65 | H65 | 0.6° | 0.0° |
| C65 | C67 | C57 | H67 | 180.0° | 180.0° |
| C65 | C67 | C57 | C55 | 179.5° | 179.9° |
| H65 | C65 | C67 | C57 | 179.2° | 180.0° |
| H65 | C65 | C67 | H67 | 0.8° | 0.0° |
| C67 | C57 | C55 | C53 | 179.8° | 180.0° |
| C67 | C57 | C55 | H55 | 0.2° | 0.1° |
| H67 | C67 | C57 | C55 | 0.5° | 0.0° |
| C57 | C55 | C53 | H55 | 180.0° | 179.9° |
| C57 | C55 | C53 | H53 | 179.3° | 179.9° |
| H55 | C55 | C53 | H53 | 0.7° | 0.0° |
| N2 | C3 | C6 | H31 | 125.3° | 119.9° |
| N2 | C3 | C6 | H32 | 125.2° | 119.9° |
| N2 | C3 | H31 | H32 | 117.8° | 120.2° |
| N2 | C3 | C6 | C9 | 72.0° | 56.2° |
| N2 | C3 | C6 | H61A | 162.8° | 176.2° |
| N2 | C3 | C6 | H62 | 53.3° | 63.7° |
| C3 | N2 | C1 | C12 | 3.9° | 17.2° |
| C3 | N2 | C1 | O32 | 178.4° | 162.4° |
| C1 | N2 | C3 | C6 | 65.5° | 51.7° |
| C1 | N2 | C3 | H31 | 59.8° | 68.2° |
| C1 | N2 | C3 | H32 | 169.3° | 171.6° |
| N2 | C1 | C12 | N11 | 59.3° | 2.8° |
| N2 | C1 | C12 | C14 | 67.7° | 123.9° |
| N2 | C1 | C12 | O32 | 177.9° | 179.6° |
| N2 | C1 | C12 | H12 | 171.9° | 118.6° |
| C6 | C3 | H31 | H32 | 117.8° | 120.1° |
| C3 | C6 | C9 | H61A | 125.3° | 119.9° |
| C3 | C6 | C9 | H62 | 125.3° | 119.9° |
| C3 | C6 | H61A | H62 | 115.0° | 120.2° |
| C3 | C6 | C9 | O10 | 158.8° | 130.3° |
| C3 | C6 | C9 | N11 | 23.1° | 49.7° |
| H31 | C3 | C6 | C9 | 53.3° | 63.7° |
| H31 | C3 | C6 | H61A | 72.0° | 56.2° |
| H31 | C3 | C6 | H62 | 178.6° | 176.4° |
| H32 | C3 | C6 | C9 | 162.8° | 176.2° |
| H32 | C3 | C6 | H61A | 37.5° | 63.9° |
| H32 | C3 | C6 | H62 | 71.9° | 56.3° |
| C9 | C6 | H61A | H62 | 115.0° | 120.2° |
| C6 | C9 | O10 | N11 | 178.3° | 180.0° |
| C6 | C9 | N11 | C12 | 2.8° | 15.9° |
| C6 | C9 | N11 | C27 | 179.7° | 164.1° |
| H61A | C6 | C9 | O10 | 33.5° | 10.4° |
| H61A | C6 | C9 | N11 | 148.3° | 169.5° |
| H62 | C6 | C9 | O10 | 75.9° | 109.7° |
| H62 | C6 | C9 | N11 | 102.2° | 70.3° |
| O10 | C9 | N11 | C12 | 179.0° | 164.1° |
| O10 | C9 | N11 | C27 | 1.6° | 15.9° |
| C9 | N11 | C12 | C27 | 177.4° | 180.0° |
| C9 | N11 | C12 | C14 | 92.8° | 118.7° |
| C9 | N11 | C12 | C1 | 37.3° | 2.2° |
| C9 | N11 | C12 | H12 | 145.5° | 123.7° |
| C9 | N11 | C27 | C33 | 89.1° | 91.8° |
| C9 | N11 | C27 | H271 | 145.7° | 28.2° |
| C9 | N11 | C27 | H272 | 36.2° | 148.2° |
| N11 | C12 | C14 | C1 | 134.4° | 124.7° |
| N11 | C12 | C14 | H12 | 115.7° | 117.7° |
| N11 | C12 | C1 | H12 | 112.6° | 121.4° |
| N11 | C12 | C14 | C17 | 178.8° | 54.7° |
| N11 | C12 | C14 | H141 | 55.9° | 174.7° |
| N11 | C12 | C14 | H142 | 53.5° | 65.2° |
| N11 | C12 | C1 | O32 | 122.8° | 177.6° |
| C12 | N11 | C27 | C33 | 93.3° | 88.2° |
| C12 | N11 | C27 | H271 | 31.9° | 151.8° |
| C12 | N11 | C27 | H272 | 141.4° | 31.7° |
| C27 | N11 | C12 | C14 | 84.6° | 61.2° |
| C27 | N11 | C12 | C1 | 145.3° | 177.8° |
| C27 | N11 | C12 | H12 | 37.1° | 56.3° |
| N11 | C27 | C33 | H271 | 125.3° | 120.0° |
| N11 | C27 | C33 | H272 | 125.3° | 120.0° |
| N11 | C27 | H271 | H272 | 117.9° | 120.0° |
| N11 | C27 | C33 | C39 | 92.3° | 84.5° |
| N11 | C27 | C33 | C34 | 88.5° | 95.8° |
| C14 | C12 | C1 | H12 | 120.3° | 117.5° |
| C12 | C14 | C17 | H141 | 125.3° | 120.0° |
| C12 | C14 | C17 | H142 | 125.3° | 120.0° |
| C12 | C14 | H141 | H142 | 115.1° | 120.0° |
| C12 | C14 | C17 | C23 | 176.2° | 169.7° |
| C12 | C14 | C17 | C19 | 61.6° | 70.3° |
| C12 | C14 | C17 | H17 | 56.7° | 49.7° |
| C14 | C12 | C1 | O32 | 110.1° | 56.5° |
| C1 | C12 | C14 | C17 | 46.8° | 69.9° |
| C1 | C12 | C14 | H141 | 78.4° | 50.1° |
| C1 | C12 | C14 | H142 | 172.1° | 170.1° |
| H12 | C12 | C14 | C17 | 63.1° | 172.4° |
| H12 | C12 | C14 | H141 | 171.6° | 67.6° |
| H12 | C12 | C14 | H142 | 62.2° | 52.4° |
| H12 | C12 | C1 | O32 | 10.2° | 61.0° |
| C17 | C14 | H141 | H142 | 115.1° | 120.0° |
| C14 | C17 | C23 | C19 | 122.4° | 120.0° |
| C14 | C17 | C23 | H17 | 119.3° | 120.0° |
| C14 | C17 | C19 | H17 | 119.2° | 120.0° |
| C14 | C17 | C23 | H231 | 54.8° | 64.9° |
| C14 | C17 | C23 | H232 | 180.0° | 175.0° |
| C14 | C17 | C23 | H233 | 54.8° | 55.1° |
| C14 | C17 | C19 | H191 | 54.7° | 163.3° |
| C14 | C17 | C19 | H192 | 180.0° | 43.3° |
| C14 | C17 | C19 | H193 | 54.7° | 76.7° |
| H141 | C14 | C17 | C23 | 51.0° | 49.7° |
| H141 | C14 | C17 | C19 | 173.2° | 169.7° |
| H141 | C14 | C17 | H17 | 68.5° | 70.3° |
| H142 | C14 | C17 | C23 | 58.5° | 70.3° |
| H142 | C14 | C17 | C19 | 63.7° | 49.7° |
| H142 | C14 | C17 | H17 | 178.0° | 169.7° |
| C23 | C17 | C19 | H17 | 119.4° | 120.0° |
| C17 | C23 | H231 | H232 | 123.6° | 120.0° |
| C17 | C23 | H231 | H233 | 118.2° | 120.0° |
| C17 | C23 | H232 | H233 | 125.2° | 120.0° |
| C23 | C17 | C19 | H191 | 66.7° | 43.3° |
| C23 | C17 | C19 | H192 | 58.6° | 76.7° |
| C23 | C17 | C19 | H193 | 176.1° | 163.2° |
| C19 | C17 | C23 | H231 | 177.2° | 55.1° |
| C19 | C17 | C23 | H232 | 57.6° | 64.9° |
| C19 | C17 | C23 | H233 | 67.6° | 175.1° |
| C17 | C19 | H191 | H192 | 124.9° | 120.0° |
| C17 | C19 | H191 | H193 | 117.6° | 120.0° |
| C17 | C19 | H192 | H193 | 125.3° | 120.0° |
| H17 | C17 | C23 | H231 | 64.5° | 175.1° |
| H17 | C17 | C23 | H232 | 60.7° | 55.0° |
| H17 | C17 | C23 | H233 | 174.1° | 64.9° |
| H17 | C17 | C19 | H191 | 173.9° | 76.7° |
| H17 | C17 | C19 | H192 | 60.8° | 163.3° |
| H17 | C17 | C19 | H193 | 64.5° | 43.2° |
| H231 | C23 | H232 | H233 | 109.5° | 120.0° |
| H191 | C19 | H192 | H193 | 109.4° | 120.0° |
| C33 | C27 | H271 | H272 | 117.9° | 120.0° |
| C27 | C33 | C39 | C34 | 179.2° | 179.6° |
| C27 | C33 | C39 | C38 | 179.1° | 179.8° |
| C27 | C33 | C39 | H39 | 0.9° | 0.1° |
| C27 | C33 | C34 | N36 | 179.2° | 180.0° |
| C27 | C33 | C34 | H34 | 0.8° | 0.1° |
| H271 | C27 | C33 | C39 | 142.4° | 155.5° |
| H271 | C27 | C33 | C34 | 36.8° | 24.2° |
| H272 | C27 | C33 | C39 | 32.9° | 35.4° |
| H272 | C27 | C33 | C34 | 146.3° | 144.2° |
| C33 | C39 | C38 | H39 | 180.0° | 179.7° |
| C33 | C39 | C38 | C41 | 180.0° | 179.7° |
| C33 | C39 | C38 | C37 | 0.2° | 0.5° |
| C39 | C33 | C34 | N36 | 0.0° | 0.4° |
| C39 | C33 | C34 | H34 | 180.0° | 179.7° |
| C34 | C33 | C39 | C38 | 0.1° | 0.6° |
| C34 | C33 | C39 | H39 | 179.9° | 179.8° |
| C33 | C34 | N36 | C37 | 0.1° | 0.1° |
| C33 | C34 | N36 | H34 | 180.0° | 179.9° |
| C39 | C38 | C41 | C37 | 179.8° | 179.7° |
| C39 | C38 | C41 | C43 | 179.9° | 179.7° |
| C39 | C38 | C41 | H41 | 0.1° | 0.3° |
| C39 | C38 | C37 | C47 | 179.9° | 179.7° |
| C39 | C38 | C37 | N36 | 0.3° | 0.3° |
| H39 | C39 | C38 | C41 | 0.0° | 0.1° |
| H39 | C39 | C38 | C37 | 179.8° | 179.8° |
| C38 | C41 | C43 | H41 | 180.0° | 180.0° |
| C38 | C41 | C43 | C45 | 0.2° | 0.0° |
| C38 | C41 | C43 | H43 | 179.8° | 180.0° |
| C41 | C38 | C37 | C47 | 0.0° | 0.0° |
| C41 | C38 | C37 | N36 | 179.9° | 180.0° |
| C37 | C38 | C41 | C43 | 0.0° | 0.0° |
| C37 | C38 | C41 | H41 | 179.9° | 180.0° |
| C38 | C37 | C47 | C45 | 0.2° | 0.0° |
| C38 | C37 | C47 | N36 | 179.9° | 180.0° |
| C38 | C37 | C47 | H47 | 179.8° | 179.9° |
| C38 | C37 | N36 | C34 | 0.2° | 0.0° |
| C41 | C43 | C45 | H43 | 180.0° | 180.0° |
| C41 | C43 | C45 | C47 | 0.4° | 0.0° |
| C41 | C43 | C45 | H45 | 179.6° | 180.0° |
| H41 | C41 | C43 | C45 | 179.8° | 180.0° |
| H41 | C41 | C43 | H43 | 0.2° | 0.0° |
| C43 | C45 | C47 | H45 | 180.0° | 180.0° |
| C43 | C45 | C47 | C37 | 0.4° | 0.0° |
| C43 | C45 | C47 | H47 | 179.6° | 179.9° |
| H43 | C43 | C45 | C47 | 179.6° | 180.0° |
| H43 | C43 | C45 | H45 | 0.4° | 0.0° |
| C45 | C47 | C37 | H47 | 180.0° | 179.9° |
| C45 | C47 | C37 | N36 | 179.9° | 180.0° |
| H45 | C45 | C47 | C37 | 179.6° | 180.0° |
| H45 | C45 | C47 | H47 | 0.4° | 0.1° |
| C47 | C37 | N36 | C34 | 179.9° | 179.9° |
| H47 | C47 | C37 | N36 | 0.1° | 0.1° |
| C37 | N36 | C34 | H34 | 179.9° | 180.0° |
