2OV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CE7 | CZ5 | doub | 1.38Å | 1.40Å | Aromatic |
| CE7 | CD7 | sing | 1.38Å | 1.39Å | Aromatic |
| CZ5 | CE5 | sing | 1.38Å | 1.39Å | Aromatic |
| CD7 | CB5 | doub | 1.38Å | 1.40Å | Aromatic |
| O44 | PA4 | doub | 1.48Å | 1.50Å | |
| CE5 | CD5 | doub | 1.38Å | 1.39Å | Aromatic |
| O24 | PA4 | sing | 1.61Å | 1.48Å | |
| CB5 | CD5 | sing | 1.38Å | 1.40Å | Aromatic |
| CB5 | CA5 | sing | 1.51Å | 1.39Å | |
| PA4 | O34 | sing | 1.61Å | 1.46Å | |
| PA4 | O14 | sing | 1.61Å | 1.61Å | |
| CA5 | O15 | sing | 1.43Å | 1.43Å | |
| O23 | PA3 | doub | 1.48Å | 1.46Å | |
| O14 | C4 | sing | 1.43Å | 1.45Å | |
| O15 | C5 | sing | 1.43Å | 1.44Å | |
| O43 | PA3 | sing | 1.61Å | 1.48Å | |
| PA3 | O13 | sing | 1.61Å | 1.67Å | |
| PA3 | O33 | sing | 1.61Å | 1.46Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C3 | sing | 1.53Å | 1.51Å | |
| C5 | C6 | sing | 1.53Å | 1.54Å | |
| O13 | C3 | sing | 1.43Å | 1.48Å | |
| O36 | PA6 | doub | 1.48Å | 1.61Å | |
| C3 | C2 | sing | 1.53Å | 1.55Å | |
| C6 | O16 | sing | 1.43Å | 1.45Å | |
| C6 | C1 | sing | 1.53Å | 1.53Å | |
| O16 | PA6 | sing | 1.61Å | 1.63Å | |
| PA6 | O46 | sing | 1.61Å | 1.47Å | |
| PA6 | O26 | sing | 1.61Å | 1.48Å | |
| C2 | O12 | sing | 1.43Å | 1.45Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| O12 | CA2 | sing | 1.43Å | 1.42Å | |
| C1 | O11 | sing | 1.43Å | 1.44Å | |
| CD2 | CE2 | doub | 1.38Å | 1.39Å | Aromatic |
| CD2 | CB2 | sing | 1.38Å | 1.40Å | Aromatic |
| CE2 | CZ | sing | 1.38Å | 1.39Å | Aromatic |
| CA2 | CB2 | sing | 1.51Å | 1.41Å | |
| CB2 | CD1 | doub | 1.38Å | 1.40Å | Aromatic |
| O11 | PA1 | sing | 1.61Å | 1.60Å | |
| CZ | CE1 | doub | 1.38Å | 1.39Å | Aromatic |
| CD1 | CE1 | sing | 1.38Å | 1.40Å | Aromatic |
| O21 | PA1 | doub | 1.48Å | 1.48Å | |
| PA1 | O31 | sing | 1.61Å | 1.48Å | |
| PA1 | O41 | sing | 1.61Å | 1.48Å | |
| CD5 | H1 | sing | 1.08Å | 1.08Å | |
| CE5 | H2 | sing | 1.08Å | 1.08Å | |
| CZ5 | H3 | sing | 1.08Å | 1.08Å | |
| CE7 | H4 | sing | 1.08Å | 1.08Å | |
| CD7 | H5 | sing | 1.08Å | 1.08Å | |
| CA5 | H6 | sing | 1.09Å | 1.10Å | |
| CA5 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| O46 | H10 | sing | 0.97Å | 0.95Å | |
| O26 | H11 | sing | 0.97Å | 0.95Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| O41 | H13 | sing | 0.97Å | 0.95Å | |
| O31 | H14 | sing | 0.97Å | 0.95Å | |
| C4 | H15 | sing | 1.09Å | 1.10Å | |
| O34 | H16 | sing | 0.97Å | 0.95Å | |
| O24 | H17 | sing | 0.97Å | 0.95Å | |
| C3 | H18 | sing | 1.09Å | 1.10Å | |
| O43 | H19 | sing | 0.97Å | 0.95Å | |
| O33 | H20 | sing | 0.97Å | 0.95Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| CA2 | H22 | sing | 1.09Å | 1.10Å | |
| CA2 | H23 | sing | 1.09Å | 1.10Å | |
| CD2 | H24 | sing | 1.08Å | 1.08Å | |
| CE2 | H25 | sing | 1.08Å | 1.08Å | |
| CZ | H26 | sing | 1.08Å | 1.08Å | |
| CE1 | H27 | sing | 1.08Å | 1.08Å | |
| CD1 | H28 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CZ5 | CE7 | CD7 | 119.4° | 120.0° |
| CE7 | CZ5 | CE5 | 120.8° | 120.0° |
| CE7 | CZ5 | H3 | 119.6° | 120.0° |
| CZ5 | CE7 | H4 | 120.3° | 120.0° |
| CE7 | CD7 | CB5 | 120.0° | 120.0° |
| CD7 | CE7 | H4 | 120.3° | 120.0° |
| CE7 | CD7 | H5 | 120.0° | 120.0° |
| CZ5 | CE5 | CD5 | 119.7° | 120.0° |
| CZ5 | CE5 | H2 | 120.2° | 120.0° |
| CE5 | CZ5 | H3 | 119.6° | 120.0° |
| CD7 | CB5 | CD5 | 120.0° | 120.0° |
| CD7 | CB5 | CA5 | 120.6° | 120.0° |
| CB5 | CD7 | H5 | 120.0° | 120.0° |
| O44 | PA4 | O24 | 115.2° | 109.5° |
| O44 | PA4 | O34 | 116.7° | 109.5° |
| O44 | PA4 | O14 | 99.7° | 109.5° |
| CE5 | CD5 | CB5 | 120.1° | 119.9° |
| CE5 | CD5 | H1 | 120.0° | 120.0° |
| CD5 | CE5 | H2 | 120.2° | 120.0° |
| O24 | PA4 | O34 | 113.3° | 109.5° |
| O24 | PA4 | O14 | 101.3° | 109.4° |
| PA4 | O24 | H17 | 109.5° | 114.0° |
| CD5 | CB5 | CA5 | 119.3° | 120.0° |
| CB5 | CD5 | H1 | 120.0° | 120.0° |
| CB5 | CA5 | O15 | 108.4° | 109.4° |
| CB5 | CA5 | H6 | 109.7° | 109.5° |
| CB5 | CA5 | H7 | 109.7° | 109.4° |
| O34 | PA4 | O14 | 108.0° | 109.5° |
| PA4 | O34 | H16 | 109.5° | 114.0° |
| PA4 | O14 | C4 | 124.8° | 123.0° |
| CA5 | O15 | C5 | 112.8° | 114.0° |
| O15 | CA5 | H6 | 109.7° | 109.5° |
| O15 | CA5 | H7 | 109.7° | 109.5° |
| O23 | PA3 | O43 | 106.8° | 109.5° |
| O23 | PA3 | O13 | 119.6° | 109.5° |
| O23 | PA3 | O33 | 114.2° | 109.5° |
| O14 | C4 | C5 | 110.3° | 109.4° |
| O14 | C4 | C3 | 107.6° | 109.5° |
| O14 | C4 | H15 | 110.7° | 109.5° |
| O15 | C5 | C4 | 108.1° | 109.5° |
| O15 | C5 | C6 | 108.5° | 109.5° |
| O15 | C5 | H8 | 110.1° | 109.4° |
| O43 | PA3 | O13 | 101.4° | 109.4° |
| O43 | PA3 | O33 | 116.8° | 109.5° |
| PA3 | O43 | H19 | 109.5° | 113.9° |
| O13 | PA3 | O33 | 97.8° | 109.4° |
| PA3 | O13 | C3 | 125.8° | 123.0° |
| PA3 | O33 | H20 | 109.5° | 114.0° |
| C5 | C4 | C3 | 108.7° | 109.5° |
| C4 | C5 | C6 | 112.7° | 109.5° |
| C4 | C5 | H8 | 108.8° | 109.5° |
| C5 | C4 | H15 | 109.6° | 109.4° |
| C4 | C3 | O13 | 108.2° | 109.4° |
| C4 | C3 | C2 | 108.0° | 109.5° |
| C3 | C4 | H15 | 109.8° | 109.5° |
| C4 | C3 | H18 | 107.9° | 109.5° |
| C5 | C6 | O16 | 108.9° | 109.4° |
| C5 | C6 | C1 | 112.8° | 109.5° |
| C6 | C5 | H8 | 108.6° | 109.5° |
| C5 | C6 | H9 | 108.6° | 109.4° |
| O13 | C3 | C2 | 116.8° | 109.5° |
| O13 | C3 | H18 | 108.3° | 109.5° |
| O36 | PA6 | O16 | 103.8° | 109.5° |
| O36 | PA6 | O46 | 108.5° | 109.5° |
| O36 | PA6 | O26 | 107.6° | 109.5° |
| C3 | C2 | O12 | 112.9° | 109.5° |
| C3 | C2 | C1 | 107.5° | 109.5° |
| C2 | C3 | H18 | 107.4° | 109.5° |
| C3 | C2 | H21 | 108.9° | 109.5° |
| O16 | C6 | C1 | 108.0° | 109.4° |
| C6 | O16 | PA6 | 124.1° | 123.0° |
| O16 | C6 | H9 | 109.8° | 109.5° |
| C6 | C1 | C2 | 111.0° | 109.4° |
| C6 | C1 | O11 | 106.5° | 109.5° |
| C1 | C6 | H9 | 108.7° | 109.5° |
| C6 | C1 | H12 | 108.8° | 109.5° |
| O16 | PA6 | O46 | 109.2° | 109.5° |
| O16 | PA6 | O26 | 107.9° | 109.4° |
| O46 | PA6 | O26 | 118.8° | 109.5° |
| PA6 | O46 | H10 | 109.5° | 114.0° |
| PA6 | O26 | H11 | 109.5° | 113.9° |
| O12 | C2 | C1 | 108.0° | 109.5° |
| C2 | O12 | CA2 | 112.2° | 114.0° |
| O12 | C2 | H21 | 110.3° | 109.5° |
| C2 | C1 | O11 | 111.6° | 109.5° |
| C2 | C1 | H12 | 108.7° | 109.4° |
| C1 | C2 | H21 | 109.1° | 109.4° |
| O12 | CA2 | CB2 | 106.4° | 109.4° |
| O12 | CA2 | H22 | 110.3° | 109.4° |
| O12 | CA2 | H23 | 110.2° | 109.4° |
| C1 | O11 | PA1 | 123.7° | 123.0° |
| O11 | C1 | H12 | 110.1° | 109.5° |
| CE2 | CD2 | CB2 | 120.5° | 120.0° |
| CD2 | CE2 | CZ | 120.3° | 120.0° |
| CE2 | CD2 | H24 | 119.7° | 120.0° |
| CD2 | CE2 | H25 | 119.9° | 119.9° |
| CD2 | CB2 | CA2 | 119.3° | 120.0° |
| CD2 | CB2 | CD1 | 119.0° | 120.0° |
| CB2 | CD2 | H24 | 119.7° | 120.0° |
| CE2 | CZ | CE1 | 119.7° | 120.0° |
| CZ | CE2 | H25 | 119.9° | 120.0° |
| CE2 | CZ | H26 | 120.1° | 120.0° |
| CA2 | CB2 | CD1 | 121.7° | 120.0° |
| CB2 | CA2 | H22 | 110.2° | 109.5° |
| CB2 | CA2 | H23 | 110.2° | 109.5° |
| CB2 | CD1 | CE1 | 120.4° | 120.0° |
| CB2 | CD1 | H28 | 119.8° | 120.0° |
| O11 | PA1 | O21 | 101.8° | 109.5° |
| O11 | PA1 | O31 | 103.0° | 109.5° |
| O11 | PA1 | O41 | 102.8° | 109.5° |
| CZ | CE1 | CD1 | 120.2° | 120.0° |
| CE1 | CZ | H26 | 120.2° | 120.0° |
| CZ | CE1 | H27 | 119.9° | 120.0° |
| CD1 | CE1 | H27 | 119.9° | 120.0° |
| CE1 | CD1 | H28 | 119.8° | 120.0° |
| O21 | PA1 | O31 | 115.1° | 109.5° |
| O21 | PA1 | O41 | 114.5° | 109.5° |
| O31 | PA1 | O41 | 116.6° | 109.5° |
| PA1 | O31 | H14 | 109.5° | 114.0° |
| PA1 | O41 | H13 | 109.5° | 114.0° |
| H6 | CA5 | H7 | 109.5° | 109.5° |
| H22 | CA2 | H23 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CZ5 | CE7 | CD7 | H4 | 180.0° | 180.0° |
| CE7 | CZ5 | CE5 | H3 | 180.0° | 180.0° |
| CZ5 | CE7 | CD7 | CB5 | 0.8° | 0.2° |
| CE7 | CZ5 | CE5 | CD5 | 0.9° | 0.0° |
| CE7 | CZ5 | CE5 | H2 | 179.1° | 179.9° |
| CZ5 | CE7 | CD7 | H5 | 179.2° | 180.0° |
| CD7 | CE7 | CZ5 | CE5 | 0.4° | 0.0° |
| CE7 | CD7 | CB5 | H5 | 180.0° | 179.8° |
| CE7 | CD7 | CB5 | CD5 | 1.5° | 0.5° |
| CE7 | CD7 | CB5 | CA5 | 179.7° | 180.0° |
| CD7 | CE7 | CZ5 | H3 | 179.6° | 180.0° |
| CZ5 | CE5 | CD5 | H2 | 180.0° | 179.9° |
| CZ5 | CE5 | CD5 | CB5 | 0.1° | 0.3° |
| CZ5 | CE5 | CD5 | H1 | 179.9° | 180.0° |
| CE5 | CZ5 | CE7 | H4 | 179.6° | 180.0° |
| CD7 | CB5 | CD5 | CE5 | 1.1° | 0.6° |
| CD7 | CB5 | CD5 | CA5 | 178.2° | 179.4° |
| CD7 | CB5 | CA5 | O15 | 109.5° | 90.0° |
| CD7 | CB5 | CD5 | H1 | 178.9° | 179.7° |
| CB5 | CD7 | CE7 | H4 | 179.2° | 179.8° |
| CD7 | CB5 | CA5 | H6 | 130.7° | 150.0° |
| CD7 | CB5 | CA5 | H7 | 10.3° | 30.0° |
| O44 | PA4 | O24 | O34 | 138.1° | 120.0° |
| O44 | PA4 | O24 | O14 | 106.5° | 120.0° |
| O44 | PA4 | O34 | O14 | 111.2° | 120.0° |
| O44 | PA4 | O14 | C4 | 95.4° | 55.1° |
| O44 | PA4 | O34 | H16 | 0.0° | 179.9° |
| O44 | PA4 | O24 | H17 | 129.5° | 60.0° |
| CE5 | CD5 | CB5 | H1 | 180.0° | 179.7° |
| CE5 | CD5 | CB5 | CA5 | 179.3° | 180.0° |
| CD5 | CE5 | CZ5 | H3 | 179.1° | 180.0° |
| O24 | PA4 | O34 | O14 | 111.4° | 120.0° |
| O24 | PA4 | O14 | C4 | 146.2° | 175.0° |
| O24 | PA4 | O34 | H16 | 137.4° | 59.9° |
| CD5 | CB5 | CA5 | O15 | 68.7° | 90.6° |
| CB5 | CD5 | CE5 | H2 | 179.9° | 179.7° |
| CD5 | CB5 | CD7 | H5 | 178.5° | 179.7° |
| CD5 | CB5 | CA5 | H6 | 51.1° | 29.5° |
| CD5 | CB5 | CA5 | H7 | 171.5° | 149.4° |
| CB5 | CA5 | O15 | H6 | 119.8° | 120.0° |
| CB5 | CA5 | O15 | H7 | 119.8° | 120.0° |
| CB5 | CA5 | O15 | C5 | 176.6° | 180.0° |
| CA5 | CB5 | CD5 | H1 | 0.7° | 0.3° |
| CA5 | CB5 | CD7 | H5 | 0.3° | 0.2° |
| CB5 | CA5 | H6 | H7 | 120.5° | 120.0° |
| O34 | PA4 | O14 | C4 | 27.0° | 65.0° |
| O34 | PA4 | O24 | H17 | 92.4° | 60.0° |
| PA4 | O14 | C4 | C5 | 123.9° | 120.0° |
| PA4 | O14 | C4 | C3 | 117.6° | 120.0° |
| PA4 | O14 | C4 | H15 | 2.4° | 0.1° |
| O14 | PA4 | O34 | H16 | 111.2° | 60.0° |
| O14 | PA4 | O24 | H17 | 23.0° | 180.0° |
| CA5 | O15 | C5 | C4 | 126.4° | 90.0° |
| CA5 | O15 | C5 | C6 | 111.1° | 150.0° |
| O15 | CA5 | H6 | H7 | 120.5° | 120.0° |
| CA5 | O15 | C5 | H8 | 7.6° | 30.0° |
| O23 | PA3 | O43 | O13 | 126.0° | 120.0° |
| O23 | PA3 | O43 | O33 | 129.2° | 120.0° |
| O23 | PA3 | O13 | O33 | 123.6° | 120.0° |
| O23 | PA3 | O13 | C3 | 55.2° | 55.0° |
| O23 | PA3 | O43 | H19 | 0.0° | 60.0° |
| O23 | PA3 | O33 | H20 | 0.0° | 180.0° |
| O14 | C4 | C5 | O15 | 66.3° | 60.0° |
| O14 | C4 | C5 | C3 | 117.8° | 120.0° |
| O14 | C4 | C5 | H15 | 122.1° | 120.0° |
| O14 | C4 | C3 | H15 | 120.5° | 120.1° |
| O14 | C4 | C5 | C6 | 173.7° | 180.0° |
| O14 | C4 | C3 | O13 | 47.8° | 60.1° |
| O14 | C4 | C3 | C2 | 175.0° | 180.0° |
| O14 | C4 | C5 | H8 | 53.2° | 60.0° |
| O14 | C4 | C3 | H18 | 69.2° | 59.9° |
| O15 | C5 | C4 | C6 | 120.0° | 120.0° |
| O15 | C5 | C4 | H8 | 119.5° | 120.0° |
| O15 | C5 | C4 | C3 | 175.8° | 180.0° |
| O15 | C5 | C6 | H8 | 119.6° | 120.0° |
| O15 | C5 | C6 | O16 | 72.3° | 60.0° |
| O15 | C5 | C6 | C1 | 167.9° | 180.0° |
| C5 | O15 | CA5 | H6 | 63.5° | 60.0° |
| C5 | O15 | CA5 | H7 | 56.8° | 60.0° |
| O15 | C5 | C6 | H9 | 47.3° | 60.0° |
| O15 | C5 | C4 | H15 | 55.8° | 60.0° |
| O43 | PA3 | O13 | O33 | 119.4° | 120.0° |
| O43 | PA3 | O13 | C3 | 172.2° | 175.0° |
| O43 | PA3 | O33 | H20 | 125.6° | 59.9° |
| PA3 | O13 | C3 | C4 | 94.8° | 120.0° |
| PA3 | O13 | C3 | C2 | 143.1° | 120.0° |
| PA3 | O13 | C3 | H18 | 21.9° | 0.0° |
| O13 | PA3 | O43 | H19 | 126.0° | 180.0° |
| O13 | PA3 | O33 | H20 | 127.5° | 60.0° |
| O33 | PA3 | O13 | C3 | 68.4° | 65.0° |
| O33 | PA3 | O43 | H19 | 129.2° | 60.0° |
| C5 | C4 | C3 | H15 | 119.9° | 120.0° |
| C4 | C5 | C6 | H8 | 120.6° | 120.0° |
| C5 | C4 | C3 | O13 | 167.3° | 180.0° |
| C5 | C4 | C3 | C2 | 65.4° | 60.0° |
| C4 | C5 | C6 | O16 | 168.0° | 180.0° |
| C4 | C5 | C6 | C1 | 48.2° | 60.0° |
| C4 | C5 | C6 | H9 | 72.4° | 60.1° |
| C5 | C4 | C3 | H18 | 50.4° | 60.0° |
| C3 | C4 | C5 | C6 | 55.9° | 60.0° |
| C4 | C3 | O13 | C2 | 122.1° | 120.0° |
| C4 | C3 | O13 | H18 | 116.7° | 120.0° |
| C4 | C3 | C2 | H18 | 116.2° | 120.0° |
| C4 | C3 | C2 | O12 | 51.8° | 60.0° |
| C4 | C3 | C2 | C1 | 67.2° | 60.0° |
| C3 | C4 | C5 | H8 | 64.6° | 60.0° |
| C4 | C3 | C2 | H21 | 174.8° | 180.0° |
| C5 | C6 | O16 | C1 | 122.8° | 120.0° |
| C5 | C6 | O16 | H9 | 118.8° | 120.0° |
| C5 | C6 | C1 | H9 | 120.6° | 120.0° |
| C5 | C6 | O16 | PA6 | 126.2° | 120.0° |
| C5 | C6 | C1 | C2 | 49.8° | 60.0° |
| C5 | C6 | C1 | O11 | 171.5° | 180.0° |
| C5 | C6 | C1 | H12 | 69.8° | 60.0° |
| C6 | C5 | C4 | H15 | 64.2° | 60.1° |
| O13 | C3 | C2 | H18 | 121.7° | 120.0° |
| O13 | C3 | C2 | O12 | 70.3° | 60.0° |
| O13 | C3 | C2 | C1 | 170.6° | 180.0° |
| O13 | C3 | C4 | H15 | 72.8° | 60.0° |
| O13 | C3 | C2 | H21 | 52.6° | 60.0° |
| O36 | PA6 | O16 | C6 | 118.1° | 55.0° |
| O36 | PA6 | O16 | O46 | 115.6° | 120.0° |
| O36 | PA6 | O16 | O26 | 114.0° | 120.0° |
| O36 | PA6 | O46 | O26 | 123.2° | 120.0° |
| O36 | PA6 | O46 | H10 | 0.0° | 180.0° |
| O36 | PA6 | O26 | H11 | 0.0° | 60.0° |
| C3 | C2 | C1 | C6 | 58.6° | 60.0° |
| C3 | C2 | O12 | C1 | 118.7° | 120.0° |
| C3 | C2 | O12 | H21 | 122.1° | 120.0° |
| C3 | C2 | C1 | H21 | 117.9° | 120.0° |
| C3 | C2 | O12 | CA2 | 151.6° | 150.0° |
| C3 | C2 | C1 | O11 | 177.3° | 180.0° |
| C3 | C2 | C1 | H12 | 61.1° | 60.0° |
| C2 | C3 | C4 | H15 | 54.5° | 60.0° |
| O16 | C6 | C1 | H9 | 119.0° | 120.0° |
| C6 | O16 | PA6 | O46 | 2.5° | 65.0° |
| C6 | O16 | PA6 | O26 | 127.9° | 175.0° |
| O16 | C6 | C1 | C2 | 170.2° | 180.0° |
| O16 | C6 | C1 | O11 | 68.1° | 60.0° |
| O16 | C6 | C5 | H8 | 47.4° | 60.0° |
| O16 | C6 | C1 | H12 | 50.6° | 60.0° |
| C1 | C6 | O16 | PA6 | 111.0° | 120.0° |
| C6 | C1 | C2 | O12 | 63.5° | 60.0° |
| C6 | C1 | C2 | O11 | 118.7° | 120.0° |
| C6 | C1 | C2 | H12 | 119.7° | 120.0° |
| C6 | C1 | O11 | H12 | 117.8° | 120.0° |
| C6 | C1 | O11 | PA1 | 131.4° | 120.0° |
| C1 | C6 | C5 | H8 | 72.5° | 60.0° |
| C6 | C1 | C2 | H21 | 176.5° | 180.0° |
| O16 | PA6 | O46 | O26 | 124.2° | 120.0° |
| PA6 | O16 | C6 | H9 | 7.4° | 0.0° |
| O16 | PA6 | O46 | H10 | 112.5° | 60.0° |
| O16 | PA6 | O26 | H11 | 111.5° | 180.0° |
| O46 | PA6 | O26 | H11 | 123.7° | 60.0° |
| O26 | PA6 | O46 | H10 | 123.2° | 60.0° |
| O12 | C2 | C1 | H21 | 120.0° | 119.9° |
| O12 | C2 | C1 | O11 | 55.2° | 60.0° |
| C2 | O12 | CA2 | CB2 | 150.3° | 180.0° |
| O12 | C2 | C1 | H12 | 176.8° | 180.0° |
| O12 | C2 | C3 | H18 | 168.0° | 180.0° |
| C2 | O12 | CA2 | H22 | 30.8° | 60.0° |
| C2 | O12 | CA2 | H23 | 90.1° | 60.1° |
| C1 | C2 | O12 | CA2 | 89.7° | 89.9° |
| C2 | C1 | O11 | H12 | 120.9° | 120.0° |
| C2 | C1 | O11 | PA1 | 107.3° | 120.0° |
| C2 | C1 | C6 | H9 | 70.8° | 60.0° |
| C1 | C2 | C3 | H18 | 49.0° | 60.0° |
| O12 | CA2 | CB2 | CD2 | 93.7° | 89.7° |
| O12 | CA2 | CB2 | H22 | 119.5° | 120.0° |
| O12 | CA2 | CB2 | H23 | 119.5° | 119.9° |
| O12 | CA2 | CB2 | CD1 | 87.2° | 90.1° |
| CA2 | O12 | C2 | H21 | 29.4° | 30.0° |
| O12 | CA2 | H22 | H23 | 121.4° | 119.9° |
| C1 | O11 | PA1 | O21 | 69.5° | 55.0° |
| C1 | O11 | PA1 | O31 | 50.1° | 65.0° |
| C1 | O11 | PA1 | O41 | 171.7° | 175.0° |
| O11 | C1 | C6 | H9 | 50.9° | 60.0° |
| O11 | C1 | C2 | H21 | 64.8° | 60.0° |
| CE2 | CD2 | CB2 | H24 | 180.0° | 180.0° |
| CD2 | CE2 | CZ | H25 | 180.0° | 180.0° |
| CE2 | CD2 | CB2 | CA2 | 179.6° | 180.0° |
| CE2 | CD2 | CB2 | CD1 | 0.5° | 0.2° |
| CD2 | CE2 | CZ | CE1 | 0.1° | 0.0° |
| CD2 | CE2 | CZ | H26 | 179.9° | 180.0° |
| CB2 | CD2 | CE2 | CZ | 0.3° | 0.0° |
| CD2 | CB2 | CA2 | CD1 | 179.1° | 179.8° |
| CD2 | CB2 | CD1 | CE1 | 0.3° | 0.5° |
| CD2 | CB2 | CA2 | H22 | 146.8° | 150.3° |
| CD2 | CB2 | CA2 | H23 | 25.9° | 30.2° |
| CB2 | CD2 | CE2 | H25 | 179.8° | 180.0° |
| CD2 | CB2 | CD1 | H28 | 179.7° | 179.7° |
| CE2 | CZ | CE1 | H26 | 180.0° | 180.0° |
| CE2 | CZ | CE1 | CD1 | 0.3° | 0.2° |
| CZ | CE2 | CD2 | H24 | 179.8° | 180.0° |
| CE2 | CZ | CE1 | H27 | 179.7° | 180.0° |
| CA2 | CB2 | CD1 | CE1 | 179.4° | 179.7° |
| CB2 | CA2 | H22 | H23 | 121.4° | 120.1° |
| CA2 | CB2 | CD2 | H24 | 0.4° | 0.0° |
| CA2 | CB2 | CD1 | H28 | 0.6° | 0.1° |
| CB2 | CD1 | CE1 | CZ | 0.1° | 0.5° |
| CB2 | CD1 | CE1 | H28 | 180.0° | 179.8° |
| CD1 | CB2 | CA2 | H22 | 32.3° | 29.9° |
| CD1 | CB2 | CA2 | H23 | 153.3° | 150.0° |
| CD1 | CB2 | CD2 | H24 | 179.6° | 179.8° |
| CB2 | CD1 | CE1 | H27 | 179.9° | 179.8° |
| O11 | PA1 | O21 | O31 | 110.6° | 120.0° |
| O11 | PA1 | O21 | O41 | 110.1° | 120.0° |
| O11 | PA1 | O31 | O41 | 111.7° | 120.0° |
| PA1 | O11 | C1 | H12 | 13.5° | 0.0° |
| O11 | PA1 | O41 | H13 | 109.5° | 180.0° |
| O11 | PA1 | O31 | H14 | 109.8° | 60.1° |
| CZ | CE1 | CD1 | H27 | 180.0° | 179.8° |
| CE1 | CZ | CE2 | H25 | 179.8° | 180.0° |
| CZ | CE1 | CD1 | H28 | 179.9° | 179.7° |
| CD1 | CE1 | CZ | H26 | 179.7° | 179.8° |
| O21 | PA1 | O31 | O41 | 138.4° | 120.0° |
| O21 | PA1 | O41 | H13 | 0.0° | 60.0° |
| O21 | PA1 | O31 | H14 | 0.0° | 179.9° |
| O31 | PA1 | O41 | H13 | 138.7° | 60.0° |
| O41 | PA1 | O31 | H14 | 138.5° | 60.0° |
| H1 | CD5 | CE5 | H2 | 0.1° | 0.1° |
| H2 | CE5 | CZ5 | H3 | 0.9° | 0.0° |
| H3 | CZ5 | CE7 | H4 | 0.4° | 0.0° |
| H4 | CE7 | CD7 | H5 | 0.8° | 0.1° |
| H8 | C5 | C6 | H9 | 166.9° | 180.0° |
| H8 | C5 | C4 | H15 | 175.3° | 179.9° |
| H9 | C6 | C1 | H12 | 169.6° | 180.0° |
| H12 | C1 | C2 | H21 | 56.9° | 60.1° |
| H15 | C4 | C3 | H18 | 170.3° | 180.0° |
| H18 | C3 | C2 | H21 | 69.1° | 60.0° |
| H24 | CD2 | CE2 | H25 | 0.2° | 0.0° |
| H25 | CE2 | CZ | H26 | 0.1° | 0.0° |
| H26 | CZ | CE1 | H27 | 0.3° | 0.0° |
| H27 | CE1 | CD1 | H28 | 0.1° | 0.0° |
