6XX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | O05 | sing | 1.43Å | 1.42Å | |
| N11 | C08 | sing | 1.47Å | 1.46Å | |
| N11 | C13 | sing | 1.47Å | 1.46Å | |
| C08 | C06 | sing | 1.53Å | 1.52Å | |
| O05 | C06 | sing | 1.43Å | 1.44Å | |
| C13 | C16 | sing | 1.53Å | 1.52Å | |
| C06 | C39 | sing | 1.53Å | 1.52Å | |
| O18 | C16 | sing | 1.43Å | 1.43Å | |
| O18 | C19 | sing | 1.43Å | 1.42Å | |
| C16 | C39 | sing | 1.53Å | 1.52Å | |
| C19 | C22 | sing | 1.53Å | 1.50Å | |
| C39 | N41 | sing | 1.46Å | 1.45Å | |
| C36 | C22 | sing | 1.53Å | 1.51Å | |
| C36 | C33 | sing | 1.53Å | 1.53Å | |
| N41 | C43 | sing | 1.39Å | 1.35Å | |
| C22 | C24 | sing | 1.53Å | 1.51Å | |
| C33 | C30 | sing | 1.53Å | 1.50Å | |
| F32 | C30 | sing | 1.40Å | 1.38Å | |
| C24 | C27 | sing | 1.53Å | 1.53Å | |
| C30 | C27 | sing | 1.53Å | 1.51Å | |
| C30 | F31 | sing | 1.40Å | 1.37Å | |
| C43 | N44 | doub | 1.32Å | 1.36Å | Aromatic |
| C43 | C73 | sing | 1.40Å | 1.44Å | Aromatic |
| N71 | C73 | sing | 1.38Å | 1.39Å | |
| N71 | C69 | sing | 1.35Å | 1.36Å | |
| O70 | C69 | doub | 1.22Å | 1.23Å | |
| N44 | C45 | sing | 1.32Å | 1.34Å | Aromatic |
| C73 | C61 | doub | 1.40Å | 1.41Å | Aromatic |
| C69 | C64 | sing | 1.41Å | 1.46Å | |
| C45 | C47 | doub | 1.39Å | 1.38Å | Aromatic |
| C61 | C47 | sing | 1.41Å | 1.41Å | Aromatic |
| C61 | C62 | sing | 1.46Å | 1.44Å | |
| C64 | C62 | doub | 1.36Å | 1.35Å | |
| C64 | C65 | sing | 1.51Å | 1.51Å | |
| C47 | C48 | sing | 1.48Å | 1.49Å | |
| C48 | C59 | doub | 1.40Å | 1.39Å | Aromatic |
| C48 | C49 | sing | 1.39Å | 1.39Å | Aromatic |
| C59 | C54 | sing | 1.38Å | 1.38Å | Aromatic |
| C49 | N51 | doub | 1.32Å | 1.34Å | Aromatic |
| C54 | C55 | sing | 1.51Å | 1.51Å | |
| C54 | C52 | doub | 1.38Å | 1.39Å | Aromatic |
| N51 | C52 | sing | 1.32Å | 1.34Å | Aromatic |
| C13 | H1 | sing | 1.09Å | 1.10Å | |
| C13 | H2 | sing | 1.09Å | 1.10Å | |
| C22 | H3 | sing | 1.09Å | 1.10Å | |
| C24 | H4 | sing | 1.09Å | 1.10Å | |
| C24 | H5 | sing | 1.09Å | 1.10Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C01 | H7 | sing | 1.09Å | 1.10Å | |
| C01 | H8 | sing | 1.09Å | 1.10Å | |
| C06 | H9 | sing | 1.09Å | 1.10Å | |
| C08 | H10 | sing | 1.09Å | 1.10Å | |
| C08 | H11 | sing | 1.09Å | 1.10Å | |
| N11 | H12 | sing | 1.01Å | 1.00Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C33 | H19 | sing | 1.09Å | 1.10Å | |
| C33 | H20 | sing | 1.09Å | 1.10Å | |
| C36 | H21 | sing | 1.09Å | 1.10Å | |
| C36 | H22 | sing | 1.09Å | 1.10Å | |
| C39 | H23 | sing | 1.09Å | 1.10Å | |
| N41 | H24 | sing | 0.97Å | 1.00Å | |
| C45 | H25 | sing | 1.08Å | 1.08Å | |
| C49 | H26 | sing | 1.08Å | 1.08Å | |
| C52 | H27 | sing | 1.08Å | 1.08Å | |
| C55 | H28 | sing | 1.09Å | 1.10Å | |
| C55 | H29 | sing | 1.09Å | 1.10Å | |
| C55 | H30 | sing | 1.09Å | 1.10Å | |
| C59 | H31 | sing | 1.08Å | 1.08Å | |
| C62 | H32 | sing | 1.08Å | 1.08Å | |
| C65 | H33 | sing | 1.09Å | 1.10Å | |
| C65 | H34 | sing | 1.09Å | 1.10Å | |
| C65 | H35 | sing | 1.09Å | 1.10Å | |
| N71 | H36 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | O05 | C06 | 114.4° | 114.0° |
| O05 | C01 | H6 | 109.5° | 109.5° |
| O05 | C01 | H7 | 109.4° | 109.5° |
| O05 | C01 | H8 | 109.4° | 109.5° |
| C08 | N11 | C13 | 111.2° | 111.1° |
| N11 | C08 | C06 | 111.0° | 109.6° |
| N11 | C08 | H10 | 109.1° | 109.4° |
| N11 | C08 | H11 | 109.1° | 109.4° |
| C08 | N11 | H12 | 109.0° | 111.0° |
| N11 | C13 | C16 | 107.8° | 109.6° |
| N11 | C13 | H1 | 109.9° | 109.4° |
| N11 | C13 | H2 | 109.9° | 109.4° |
| C13 | N11 | H12 | 109.0° | 111.0° |
| C08 | C06 | O05 | 109.6° | 109.5° |
| C08 | C06 | C39 | 111.1° | 109.3° |
| C08 | C06 | H9 | 108.9° | 109.5° |
| C06 | C08 | H10 | 109.1° | 109.5° |
| C06 | C08 | H11 | 109.1° | 109.5° |
| O05 | C06 | C39 | 108.2° | 109.5° |
| O05 | C06 | H9 | 110.1° | 109.5° |
| C13 | C16 | O18 | 104.3° | 109.5° |
| C13 | C16 | C39 | 114.5° | 109.3° |
| C16 | C13 | H1 | 109.9° | 109.5° |
| C16 | C13 | H2 | 109.9° | 109.5° |
| C13 | C16 | H14 | 110.5° | 109.4° |
| C06 | C39 | C16 | 113.8° | 109.1° |
| C06 | C39 | N41 | 108.8° | 109.5° |
| C39 | C06 | H9 | 108.9° | 109.5° |
| C06 | C39 | H23 | 106.8° | 109.5° |
| C16 | O18 | C19 | 116.7° | 114.0° |
| O18 | C16 | C39 | 104.9° | 109.5° |
| O18 | C16 | H14 | 111.9° | 109.6° |
| O18 | C19 | C22 | 110.5° | 109.5° |
| O18 | C19 | H15 | 109.2° | 109.5° |
| O18 | C19 | H16 | 109.2° | 109.5° |
| C16 | C39 | N41 | 112.5° | 109.5° |
| C39 | C16 | H14 | 110.5° | 109.5° |
| C16 | C39 | H23 | 106.8° | 109.5° |
| C19 | C22 | C36 | 113.0° | 109.5° |
| C19 | C22 | C24 | 111.2° | 109.5° |
| C19 | C22 | H3 | 108.1° | 109.5° |
| C22 | C19 | H15 | 109.2° | 109.5° |
| C22 | C19 | H16 | 109.2° | 109.5° |
| C39 | N41 | C43 | 124.1° | 120.0° |
| N41 | C39 | H23 | 107.7° | 109.6° |
| C39 | N41 | H24 | 105.7° | 120.0° |
| C22 | C36 | C33 | 109.1° | 109.5° |
| C36 | C22 | C24 | 108.3° | 109.5° |
| C36 | C22 | H3 | 108.1° | 109.5° |
| C22 | C36 | H21 | 109.6° | 109.5° |
| C22 | C36 | H22 | 109.6° | 109.5° |
| C36 | C33 | C30 | 111.3° | 109.5° |
| C36 | C33 | H19 | 109.0° | 109.5° |
| C36 | C33 | H20 | 109.0° | 109.5° |
| C33 | C36 | H21 | 109.5° | 109.5° |
| C33 | C36 | H22 | 109.6° | 109.4° |
| N41 | C43 | N44 | 117.1° | 119.8° |
| N41 | C43 | C73 | 124.7° | 119.8° |
| C43 | N41 | H24 | 105.7° | 120.0° |
| C22 | C24 | C27 | 110.8° | 109.5° |
| C24 | C22 | H3 | 108.0° | 109.4° |
| C22 | C24 | H4 | 109.1° | 109.5° |
| C22 | C24 | H5 | 109.1° | 109.4° |
| C33 | C30 | F32 | 109.9° | 109.5° |
| C33 | C30 | C27 | 112.2° | 109.4° |
| C33 | C30 | F31 | 109.9° | 109.4° |
| C30 | C33 | H19 | 109.0° | 109.5° |
| C30 | C33 | H20 | 109.0° | 109.4° |
| F32 | C30 | C27 | 110.1° | 109.5° |
| F32 | C30 | F31 | 104.7° | 109.5° |
| C24 | C27 | C30 | 113.3° | 109.5° |
| C27 | C24 | H4 | 109.2° | 109.5° |
| C27 | C24 | H5 | 109.1° | 109.5° |
| C24 | C27 | H17 | 108.5° | 109.4° |
| C24 | C27 | H18 | 108.5° | 109.5° |
| C27 | C30 | F31 | 109.8° | 109.5° |
| C30 | C27 | H17 | 108.5° | 109.5° |
| C30 | C27 | H18 | 108.5° | 109.5° |
| N44 | C43 | C73 | 118.3° | 120.4° |
| C43 | N44 | C45 | 119.8° | 122.7° |
| C43 | C73 | N71 | 120.5° | 121.7° |
| C43 | C73 | C61 | 120.9° | 118.7° |
| C73 | N71 | C69 | 125.9° | 120.8° |
| N71 | C73 | C61 | 118.6° | 119.6° |
| C73 | N71 | H36 | 117.0° | 119.5° |
| N71 | C69 | O70 | 119.8° | 119.1° |
| N71 | C69 | C64 | 115.5° | 121.7° |
| C69 | N71 | H36 | 117.0° | 119.6° |
| O70 | C69 | C64 | 124.6° | 119.1° |
| N44 | C45 | C47 | 125.3° | 121.1° |
| N44 | C45 | H25 | 117.4° | 119.4° |
| C73 | C61 | C47 | 118.6° | 118.6° |
| C73 | C61 | C62 | 117.1° | 119.3° |
| C69 | C64 | C62 | 120.1° | 120.1° |
| C69 | C64 | C65 | 119.0° | 120.0° |
| C45 | C47 | C61 | 117.1° | 118.5° |
| C45 | C47 | C48 | 119.8° | 120.8° |
| C47 | C45 | H25 | 117.4° | 119.5° |
| C47 | C61 | C62 | 124.3° | 122.0° |
| C61 | C47 | C48 | 123.0° | 120.8° |
| C61 | C62 | C64 | 122.7° | 118.4° |
| C61 | C62 | H32 | 118.6° | 120.8° |
| C62 | C64 | C65 | 120.9° | 119.9° |
| C64 | C62 | H32 | 118.6° | 120.8° |
| C64 | C65 | H33 | 109.5° | 109.5° |
| C64 | C65 | H34 | 109.5° | 109.5° |
| C64 | C65 | H35 | 109.5° | 109.5° |
| C47 | C48 | C59 | 120.1° | 120.5° |
| C47 | C48 | C49 | 123.1° | 120.6° |
| C59 | C48 | C49 | 116.8° | 118.9° |
| C48 | C59 | C54 | 121.1° | 118.3° |
| C48 | C59 | H31 | 119.4° | 120.9° |
| C48 | C49 | N51 | 123.8° | 120.6° |
| C48 | C49 | H26 | 118.1° | 119.7° |
| C59 | C54 | C55 | 121.2° | 120.4° |
| C59 | C54 | C52 | 117.1° | 119.3° |
| C54 | C59 | H31 | 119.4° | 120.8° |
| C49 | N51 | C52 | 117.3° | 121.9° |
| N51 | C49 | H26 | 118.1° | 119.7° |
| C55 | C54 | C52 | 121.7° | 120.3° |
| C54 | C55 | H28 | 109.5° | 109.4° |
| C54 | C55 | H29 | 109.4° | 109.5° |
| C54 | C55 | H30 | 109.5° | 109.5° |
| C54 | C52 | N51 | 123.9° | 121.1° |
| C54 | C52 | H27 | 118.0° | 119.5° |
| N51 | C52 | H27 | 118.1° | 119.5° |
| H1 | C13 | H2 | 109.5° | 109.5° |
| H4 | C24 | H5 | 109.5° | 109.4° |
| H6 | C01 | H7 | 109.5° | 109.5° |
| H6 | C01 | H8 | 109.5° | 109.4° |
| H7 | C01 | H8 | 109.5° | 109.5° |
| H10 | C08 | H11 | 109.5° | 109.5° |
| H15 | C19 | H16 | 109.4° | 109.4° |
| H17 | C27 | H18 | 109.5° | 109.5° |
| H19 | C33 | H20 | 109.5° | 109.5° |
| H21 | C36 | H22 | 109.4° | 109.5° |
| H28 | C55 | H29 | 109.5° | 109.4° |
| H28 | C55 | H30 | 109.4° | 109.5° |
| H29 | C55 | H30 | 109.5° | 109.5° |
| H33 | C65 | H34 | 109.5° | 109.4° |
| H33 | C65 | H35 | 109.5° | 109.5° |
| H34 | C65 | H35 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | O05 | C06 | C08 | 76.2° | 90.2° |
| C01 | O05 | C06 | C39 | 162.5° | 150.0° |
| O05 | C01 | H6 | H7 | 120.0° | 120.0° |
| O05 | C01 | H6 | H8 | 120.0° | 120.0° |
| O05 | C01 | H7 | H8 | 120.0° | 120.0° |
| C01 | O05 | C06 | H9 | 43.6° | 29.9° |
| C08 | N11 | C13 | H12 | 120.3° | 124.0° |
| N11 | C08 | C06 | H10 | 120.2° | 120.0° |
| N11 | C08 | C06 | H11 | 120.2° | 120.0° |
| N11 | C08 | C06 | O05 | 66.8° | 179.1° |
| C08 | N11 | C13 | C16 | 63.6° | 61.7° |
| N11 | C08 | C06 | C39 | 52.7° | 59.2° |
| C08 | N11 | C13 | H1 | 56.1° | 178.3° |
| C08 | N11 | C13 | H2 | 176.7° | 58.4° |
| N11 | C08 | C06 | H9 | 172.7° | 60.8° |
| N11 | C08 | H10 | H11 | 119.3° | 119.9° |
| C13 | N11 | C08 | C06 | 65.7° | 61.7° |
| N11 | C13 | C16 | H1 | 119.7° | 120.0° |
| N11 | C13 | C16 | H2 | 119.7° | 120.0° |
| N11 | C13 | C16 | O18 | 61.7° | 179.2° |
| N11 | C13 | C16 | C39 | 52.4° | 59.2° |
| N11 | C13 | H1 | H2 | 120.8° | 119.9° |
| C13 | N11 | C08 | H10 | 174.1° | 178.3° |
| C13 | N11 | C08 | H11 | 54.5° | 58.3° |
| N11 | C13 | C16 | H14 | 177.9° | 60.7° |
| C08 | C06 | O05 | C39 | 121.3° | 119.8° |
| C08 | C06 | O05 | H9 | 119.8° | 120.1° |
| C08 | C06 | C39 | H9 | 120.0° | 120.0° |
| C08 | C06 | C39 | C16 | 42.0° | 57.7° |
| C08 | C06 | C39 | N41 | 84.3° | 177.5° |
| C06 | C08 | H10 | H11 | 119.3° | 120.0° |
| C06 | C08 | N11 | H12 | 174.1° | 62.3° |
| C08 | C06 | C39 | H23 | 159.7° | 62.2° |
| O05 | C06 | C39 | H9 | 119.7° | 120.1° |
| O05 | C06 | C39 | C16 | 78.3° | 177.6° |
| O05 | C06 | C39 | N41 | 155.4° | 62.5° |
| C06 | O05 | C01 | H6 | 180.0° | 180.0° |
| C06 | O05 | C01 | H7 | 60.0° | 60.0° |
| C06 | O05 | C01 | H8 | 60.0° | 60.0° |
| O05 | C06 | C08 | H10 | 53.4° | 60.9° |
| O05 | C06 | C08 | H11 | 173.0° | 59.1° |
| O05 | C06 | C39 | H23 | 39.4° | 57.7° |
| C13 | C16 | C39 | C06 | 43.4° | 57.6° |
| C13 | C16 | O18 | C39 | 120.6° | 119.8° |
| C13 | C16 | O18 | H14 | 119.5° | 120.0° |
| C13 | C16 | O18 | C19 | 127.7° | 90.0° |
| C13 | C16 | C39 | H14 | 125.5° | 119.9° |
| C13 | C16 | C39 | N41 | 81.0° | 177.5° |
| C16 | C13 | H1 | H2 | 120.8° | 120.0° |
| C16 | C13 | N11 | H12 | 176.1° | 62.3° |
| C13 | C16 | C39 | H23 | 161.0° | 62.2° |
| C06 | C39 | C16 | O18 | 70.2° | 177.6° |
| C06 | C39 | C16 | N41 | 124.4° | 119.9° |
| C06 | C39 | C16 | H23 | 117.6° | 119.9° |
| C06 | C39 | N41 | H23 | 115.4° | 120.2° |
| C06 | C39 | N41 | C43 | 154.0° | 85.0° |
| C39 | C06 | C08 | H10 | 172.9° | 179.2° |
| C39 | C06 | C08 | H11 | 67.5° | 60.8° |
| C06 | C39 | C16 | H14 | 169.0° | 62.2° |
| C06 | C39 | N41 | H24 | 32.0° | 95.0° |
| O18 | C16 | C39 | H14 | 120.8° | 120.2° |
| C16 | O18 | C19 | C22 | 90.5° | 180.0° |
| O18 | C16 | C39 | N41 | 165.4° | 62.5° |
| O18 | C16 | C13 | H1 | 178.6° | 60.9° |
| O18 | C16 | C13 | H2 | 58.0° | 59.1° |
| C16 | O18 | C19 | H15 | 29.7° | 59.9° |
| C16 | O18 | C19 | H16 | 149.4° | 60.0° |
| O18 | C16 | C39 | H23 | 47.4° | 57.7° |
| C19 | O18 | C16 | C39 | 111.6° | 150.2° |
| O18 | C19 | C22 | H15 | 120.2° | 120.1° |
| O18 | C19 | C22 | H16 | 120.2° | 120.0° |
| O18 | C19 | C22 | C36 | 52.5° | 65.0° |
| O18 | C19 | C22 | C24 | 174.6° | 175.0° |
| O18 | C19 | C22 | H3 | 67.1° | 55.0° |
| C19 | O18 | C16 | H14 | 8.2° | 30.1° |
| O18 | C19 | H15 | H16 | 119.5° | 120.0° |
| C16 | C39 | N41 | H23 | 117.5° | 120.2° |
| C16 | C39 | N41 | C43 | 78.9° | 155.3° |
| C39 | C16 | C13 | H1 | 67.4° | 179.2° |
| C39 | C16 | C13 | H2 | 172.1° | 60.8° |
| C16 | C39 | C06 | H9 | 162.1° | 62.3° |
| C16 | C39 | N41 | H24 | 159.1° | 24.7° |
| C19 | C22 | C36 | C24 | 123.7° | 120.0° |
| C19 | C22 | C36 | H3 | 119.6° | 120.0° |
| C19 | C22 | C36 | C33 | 172.9° | 180.0° |
| C19 | C22 | C24 | H3 | 118.4° | 120.0° |
| C19 | C22 | C24 | C27 | 175.7° | 179.9° |
| C19 | C22 | C24 | H4 | 55.5° | 60.0° |
| C19 | C22 | C24 | H5 | 64.1° | 60.0° |
| C22 | C19 | H15 | H16 | 119.5° | 120.0° |
| C19 | C22 | C36 | H21 | 67.2° | 60.0° |
| C19 | C22 | C36 | H22 | 52.9° | 60.0° |
| C39 | N41 | C43 | H24 | 122.0° | 180.0° |
| C39 | N41 | C43 | N44 | 9.0° | 0.0° |
| C39 | N41 | C43 | C73 | 170.6° | 179.7° |
| N41 | C39 | C06 | H9 | 35.7° | 57.6° |
| N41 | C39 | C16 | H14 | 44.6° | 57.7° |
| C22 | C36 | C33 | H21 | 119.9° | 120.0° |
| C22 | C36 | C33 | H22 | 120.0° | 120.0° |
| C36 | C22 | C24 | H3 | 116.8° | 120.0° |
| C22 | C36 | C33 | C30 | 60.3° | 60.0° |
| C36 | C22 | C24 | C27 | 59.5° | 59.9° |
| C36 | C22 | C24 | H4 | 179.7° | 180.0° |
| C36 | C22 | C24 | H5 | 60.7° | 60.0° |
| C36 | C22 | C19 | H15 | 172.7° | 55.0° |
| C36 | C22 | C19 | H16 | 67.6° | 175.0° |
| C22 | C36 | C33 | H19 | 179.4° | 60.0° |
| C22 | C36 | C33 | H20 | 59.9° | 180.0° |
| C22 | C36 | H21 | H22 | 120.2° | 120.0° |
| C33 | C36 | C22 | C24 | 63.5° | 60.0° |
| C36 | C33 | C30 | H19 | 120.3° | 120.0° |
| C36 | C33 | C30 | H20 | 120.2° | 120.0° |
| C36 | C33 | C30 | F32 | 70.7° | 60.0° |
| C36 | C33 | C30 | C27 | 52.1° | 60.0° |
| C36 | C33 | C30 | F31 | 174.6° | 180.0° |
| C33 | C36 | C22 | H3 | 53.3° | 60.0° |
| C36 | C33 | H19 | H20 | 119.2° | 120.0° |
| C33 | C36 | H21 | H22 | 120.2° | 120.0° |
| N41 | C43 | N44 | C73 | 179.6° | 179.7° |
| N41 | C43 | C73 | N71 | 1.0° | 0.5° |
| N41 | C43 | N44 | C45 | 179.4° | 180.0° |
| N41 | C43 | C73 | C61 | 179.1° | 179.8° |
| C43 | N41 | C39 | H23 | 38.5° | 35.1° |
| C22 | C24 | C27 | H4 | 120.2° | 120.1° |
| C22 | C24 | C27 | H5 | 120.2° | 120.0° |
| C22 | C24 | C27 | C30 | 52.4° | 60.0° |
| C22 | C24 | H4 | H5 | 119.4° | 119.9° |
| C24 | C22 | C19 | H15 | 65.2° | 65.0° |
| C24 | C22 | C19 | H16 | 54.4° | 55.0° |
| C22 | C24 | C27 | H17 | 68.2° | 60.0° |
| C22 | C24 | C27 | H18 | 172.9° | 180.0° |
| C24 | C22 | C36 | H21 | 56.5° | 60.1° |
| C24 | C22 | C36 | H22 | 176.6° | 180.0° |
| C33 | C30 | F32 | C27 | 124.0° | 120.0° |
| C33 | C30 | F32 | F31 | 118.0° | 120.0° |
| C33 | C30 | C27 | C24 | 48.4° | 60.0° |
| C33 | C30 | C27 | F31 | 122.5° | 119.9° |
| C33 | C30 | C27 | H17 | 72.1° | 60.0° |
| C33 | C30 | C27 | H18 | 169.0° | 180.0° |
| C30 | C33 | H19 | H20 | 119.2° | 120.0° |
| C30 | C33 | C36 | H21 | 59.6° | 60.0° |
| C30 | C33 | C36 | H22 | 179.7° | 180.0° |
| F32 | C30 | C27 | C24 | 74.3° | 60.0° |
| F32 | C30 | C27 | F31 | 114.8° | 120.0° |
| F32 | C30 | C27 | H17 | 165.2° | 180.0° |
| F32 | C30 | C27 | H18 | 46.3° | 60.0° |
| F32 | C30 | C33 | H19 | 49.6° | 180.0° |
| F32 | C30 | C33 | H20 | 169.1° | 60.0° |
| C24 | C27 | C30 | H17 | 120.6° | 120.0° |
| C24 | C27 | C30 | H18 | 120.5° | 120.0° |
| C24 | C27 | C30 | F31 | 170.9° | 179.9° |
| C27 | C24 | C22 | H3 | 57.3° | 60.0° |
| C27 | C24 | H4 | H5 | 119.4° | 120.0° |
| C24 | C27 | H17 | H18 | 118.3° | 120.0° |
| C30 | C27 | C24 | H4 | 172.6° | 179.9° |
| C30 | C27 | C24 | H5 | 67.8° | 60.0° |
| C30 | C27 | H17 | H18 | 118.3° | 120.0° |
| C27 | C30 | C33 | H19 | 172.4° | 60.0° |
| C27 | C30 | C33 | H20 | 68.1° | 180.0° |
| F31 | C30 | C27 | H17 | 50.4° | 60.0° |
| F31 | C30 | C27 | H18 | 68.5° | 60.0° |
| F31 | C30 | C33 | H19 | 65.2° | 60.0° |
| F31 | C30 | C33 | H20 | 54.3° | 60.0° |
| N44 | C43 | C73 | N71 | 179.4° | 179.8° |
| N44 | C43 | C73 | C61 | 0.5° | 0.5° |
| C43 | N44 | C45 | C47 | 0.8° | 0.0° |
| N44 | C43 | N41 | H24 | 113.0° | 180.0° |
| C43 | N44 | C45 | H25 | 179.2° | 179.9° |
| C43 | C73 | N71 | C61 | 179.9° | 179.3° |
| C43 | C73 | N71 | C69 | 179.4° | 179.7° |
| C73 | C43 | N44 | C45 | 0.2° | 0.3° |
| C43 | C73 | C61 | C47 | 1.2° | 0.5° |
| C43 | C73 | C61 | C62 | 179.8° | 179.8° |
| C73 | C43 | N41 | H24 | 67.4° | 0.3° |
| C43 | C73 | N71 | H36 | 0.6° | 0.1° |
| C73 | N71 | C69 | H36 | 180.0° | 179.7° |
| C73 | N71 | C69 | O70 | 179.1° | 179.7° |
| C73 | N71 | C69 | C64 | 1.4° | 0.2° |
| N71 | C73 | C61 | C47 | 178.7° | 179.7° |
| N71 | C73 | C61 | C62 | 0.4° | 0.5° |
| N71 | C69 | O70 | C64 | 177.5° | 180.0° |
| C69 | N71 | C73 | C61 | 0.7° | 0.5° |
| N71 | C69 | C64 | C62 | 1.8° | 0.0° |
| N71 | C69 | C64 | C65 | 179.9° | 180.0° |
| O70 | C69 | C64 | C62 | 179.4° | 180.0° |
| O70 | C69 | C64 | C65 | 2.3° | 0.0° |
| O70 | C69 | N71 | H36 | 0.8° | 0.6° |
| N44 | C45 | C47 | H25 | 180.0° | 180.0° |
| N44 | C45 | C47 | C61 | 1.5° | 0.0° |
| N44 | C45 | C47 | C48 | 180.0° | 180.0° |
| C73 | C61 | C47 | C45 | 1.7° | 0.2° |
| C73 | C61 | C47 | C62 | 178.9° | 179.8° |
| C73 | C61 | C62 | C64 | 0.9° | 0.3° |
| C73 | C61 | C47 | C48 | 179.9° | 179.7° |
| C73 | C61 | C62 | H32 | 179.1° | 179.8° |
| C61 | C73 | N71 | H36 | 179.3° | 179.2° |
| C69 | C64 | C62 | C61 | 1.6° | 0.0° |
| C69 | C64 | C62 | C65 | 178.2° | 180.0° |
| C69 | C64 | C62 | H32 | 178.4° | 180.0° |
| C69 | C64 | C65 | H33 | 180.0° | 90.0° |
| C69 | C64 | C65 | H34 | 60.0° | 30.0° |
| C69 | C64 | C65 | H35 | 60.0° | 150.0° |
| C64 | C69 | N71 | H36 | 178.6° | 179.4° |
| C45 | C47 | C61 | C48 | 178.4° | 180.0° |
| C45 | C47 | C61 | C62 | 179.4° | 180.0° |
| C45 | C47 | C48 | C59 | 52.0° | 50.0° |
| C45 | C47 | C48 | C49 | 125.9° | 130.2° |
| C47 | C61 | C62 | C64 | 178.1° | 180.0° |
| C61 | C47 | C48 | C59 | 126.4° | 130.1° |
| C61 | C47 | C48 | C49 | 55.8° | 49.7° |
| C61 | C47 | C45 | H25 | 178.4° | 180.0° |
| C47 | C61 | C62 | H32 | 2.0° | 0.0° |
| C61 | C62 | C64 | H32 | 180.0° | 179.9° |
| C61 | C62 | C64 | C65 | 179.9° | 180.0° |
| C62 | C61 | C47 | C48 | 1.0° | 0.0° |
| C62 | C64 | C65 | H33 | 1.8° | 90.0° |
| C62 | C64 | C65 | H34 | 121.7° | 150.1° |
| C62 | C64 | C65 | H35 | 118.3° | 30.0° |
| C65 | C64 | C62 | H32 | 0.1° | 0.1° |
| C64 | C65 | H33 | H34 | 120.0° | 120.0° |
| C64 | C65 | H33 | H35 | 120.0° | 120.0° |
| C64 | C65 | H34 | H35 | 120.0° | 120.0° |
| C47 | C48 | C59 | C49 | 178.0° | 179.8° |
| C47 | C48 | C59 | C54 | 178.8° | 179.7° |
| C47 | C48 | C49 | N51 | 178.6° | 180.0° |
| C48 | C47 | C45 | H25 | 0.0° | 0.1° |
| C47 | C48 | C49 | H26 | 1.4° | 0.1° |
| C47 | C48 | C59 | H31 | 1.3° | 0.0° |
| C48 | C59 | C54 | H31 | 180.0° | 179.7° |
| C59 | C48 | C49 | N51 | 0.7° | 0.2° |
| C48 | C59 | C54 | C55 | 179.0° | 179.7° |
| C48 | C59 | C54 | C52 | 0.5° | 0.6° |
| C59 | C48 | C49 | H26 | 179.3° | 179.7° |
| C49 | C48 | C59 | C54 | 0.8° | 0.5° |
| C48 | C49 | N51 | H26 | 180.0° | 180.0° |
| C48 | C49 | N51 | C52 | 0.3° | 0.0° |
| C49 | C48 | C59 | H31 | 179.2° | 179.8° |
| C59 | C54 | C55 | C52 | 179.4° | 179.7° |
| C59 | C54 | C52 | N51 | 0.0° | 0.3° |
| C59 | C54 | C52 | H27 | 180.0° | 179.7° |
| C59 | C54 | C55 | H28 | 90.3° | 89.7° |
| C59 | C54 | C55 | H29 | 149.7° | 30.3° |
| C59 | C54 | C55 | H30 | 29.7° | 150.3° |
| C49 | N51 | C52 | C54 | 0.1° | 0.0° |
| C49 | N51 | C52 | H27 | 179.9° | 180.0° |
| C55 | C54 | C52 | N51 | 179.5° | 179.9° |
| C55 | C54 | C52 | H27 | 0.5° | 0.1° |
| C54 | C55 | H28 | H29 | 120.0° | 120.0° |
| C54 | C55 | H28 | H30 | 120.0° | 120.0° |
| C54 | C55 | H29 | H30 | 120.0° | 120.0° |
| C55 | C54 | C59 | H31 | 1.0° | 0.0° |
| C54 | C52 | N51 | H27 | 180.0° | 180.0° |
| C52 | C54 | C55 | H28 | 90.3° | 90.0° |
| C52 | C54 | C55 | H29 | 29.7° | 150.0° |
| C52 | C54 | C55 | H30 | 149.7° | 30.0° |
| C52 | C54 | C59 | H31 | 179.6° | 179.7° |
| C52 | N51 | C49 | H26 | 179.7° | 180.0° |
| H1 | C13 | N11 | H12 | 64.1° | 57.7° |
| H1 | C13 | C16 | H14 | 58.2° | 59.2° |
| H2 | C13 | N11 | H12 | 56.4° | 177.7° |
| H2 | C13 | C16 | H14 | 62.4° | 179.2° |
| H3 | C22 | C24 | H4 | 62.9° | 60.0° |
| H3 | C22 | C24 | H5 | 177.5° | 180.0° |
| H3 | C22 | C19 | H15 | 53.1° | 175.0° |
| H3 | C22 | C19 | H16 | 172.8° | 65.0° |
| H3 | C22 | C36 | H21 | 173.2° | 180.0° |
| H3 | C22 | C36 | H22 | 66.7° | 60.0° |
| H4 | C24 | C27 | H17 | 52.0° | 60.0° |
| H4 | C24 | C27 | H18 | 66.8° | 59.9° |
| H5 | C24 | C27 | H17 | 171.6° | 180.0° |
| H5 | C24 | C27 | H18 | 52.8° | 60.0° |
| H6 | C01 | H7 | H8 | 120.0° | 120.0° |
| H9 | C06 | C08 | H10 | 67.1° | 59.2° |
| H9 | C06 | C08 | H11 | 52.4° | 179.2° |
| H9 | C06 | C39 | H23 | 80.3° | 177.8° |
| H10 | C08 | N11 | H12 | 53.8° | 57.8° |
| H11 | C08 | N11 | H12 | 65.7° | 177.7° |
| H14 | C16 | C39 | H23 | 73.4° | 177.9° |
| H19 | C33 | C36 | H21 | 60.6° | 180.0° |
| H19 | C33 | C36 | H22 | 59.4° | 60.0° |
| H20 | C33 | C36 | H21 | 179.9° | 60.0° |
| H20 | C33 | C36 | H22 | 60.0° | 60.0° |
| H23 | C39 | N41 | H24 | 83.5° | 144.8° |
| H28 | C55 | H29 | H30 | 120.0° | 120.0° |
| H33 | C65 | H34 | H35 | 120.0° | 120.0° |
