FBI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1S | S1 | doub | 1.42Å | 1.60Å | |
| O2S | S1 | doub | 1.42Å | 1.59Å | |
| N3 | C12 | sing | 1.46Å | 1.49Å | |
| N3 | S1 | sing | 1.66Å | 1.74Å | |
| N3 | C11 | sing | 1.38Å | 1.46Å | |
| C12 | H121 | sing | 1.09Å | 1.11Å | |
| C12 | H122 | sing | 1.09Å | 1.12Å | |
| C12 | H123 | sing | 1.09Å | 1.11Å | |
| S1 | C13 | sing | 1.81Å | 1.79Å | |
| C13 | H131 | sing | 1.09Å | 1.11Å | |
| C13 | H132 | sing | 1.09Å | 1.11Å | |
| C13 | H133 | sing | 1.09Å | 1.12Å | |
| C8 | C10 | doub | 1.40Å | 1.44Å | Aromatic |
| C8 | N1 | sing | 1.33Å | 1.35Å | Aromatic |
| C8 | C81 | sing | 1.48Å | 1.38Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.44Å | Aromatic |
| C10 | C7 | sing | 1.51Å | 1.55Å | |
| C9 | N2 | doub | 1.32Å | 1.33Å | Aromatic |
| C9 | C91 | sing | 1.51Å | 1.56Å | |
| N2 | C11 | sing | 1.33Å | 1.30Å | Aromatic |
| C11 | N1 | doub | 1.32Å | 1.31Å | Aromatic |
| C83 | C82 | doub | 1.38Å | 1.41Å | Aromatic |
| C83 | C84 | sing | 1.39Å | 1.41Å | Aromatic |
| C83 | H83 | sing | 1.08Å | 1.10Å | |
| C82 | C81 | sing | 1.39Å | 1.41Å | Aromatic |
| C82 | H82 | sing | 1.08Å | 1.10Å | |
| C81 | C86 | doub | 1.39Å | 1.41Å | Aromatic |
| C86 | C85 | sing | 1.38Å | 1.38Å | Aromatic |
| C86 | H86 | sing | 1.08Å | 1.10Å | |
| C85 | C84 | doub | 1.38Å | 1.37Å | Aromatic |
| C85 | H85 | sing | 1.08Å | 1.10Å | |
| C84 | F1 | sing | 1.35Å | 1.36Å | |
| O1B | C1 | sing | 1.34Å | 1.22Å | |
| O1B | H1B | sing | 0.97Å | 0.95Å | |
| O1A | C1 | doub | 1.21Å | 1.36Å | |
| O3 | C3 | sing | 1.43Å | 1.42Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C1 | C2 | sing | 1.51Å | 1.49Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | H21 | sing | 1.09Å | 1.11Å | |
| C2 | H22 | sing | 1.09Å | 1.12Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C3 | H3 | sing | 1.09Å | 1.11Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | H41 | sing | 1.09Å | 1.12Å | |
| C4 | H42 | sing | 1.09Å | 1.12Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C5 | O5 | sing | 1.43Å | 1.42Å | |
| C5 | H5 | sing | 1.09Å | 1.12Å | |
| C6 | C7 | sing | 1.53Å | 1.32Å | |
| C6 | H61 | sing | 1.09Å | 1.11Å | |
| C6 | H62 | sing | 1.09Å | 1.12Å | |
| C7 | H71 | sing | 1.09Å | 1.12Å | |
| C7 | H72 | sing | 1.09Å | 1.11Å | |
| C91 | C92 | sing | 1.53Å | 1.54Å | |
| C91 | C93 | sing | 1.53Å | 1.56Å | |
| C91 | H91 | sing | 1.09Å | 1.12Å | |
| C92 | H921 | sing | 1.09Å | 1.12Å | |
| C92 | H922 | sing | 1.09Å | 1.11Å | |
| C92 | H923 | sing | 1.09Å | 1.11Å | |
| C93 | H931 | sing | 1.09Å | 1.12Å | |
| C93 | H932 | sing | 1.09Å | 1.11Å | |
| C93 | H933 | sing | 1.09Å | 1.12Å | |
| O5 | HO5 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1S | S1 | O2S | 106.9° | 122.1° |
| O1S | S1 | N3 | 111.4° | 102.9° |
| O1S | S1 | C13 | 107.7° | 111.6° |
| O2S | S1 | N3 | 111.1° | 102.8° |
| O2S | S1 | C13 | 109.1° | 111.6° |
| C12 | N3 | S1 | 117.2° | 120.0° |
| C12 | N3 | C11 | 123.5° | 120.1° |
| N3 | C12 | H121 | 117.2° | 109.5° |
| N3 | C12 | H122 | 109.4° | 109.5° |
| N3 | C12 | H123 | 109.4° | 109.5° |
| S1 | N3 | C11 | 119.3° | 120.0° |
| N3 | S1 | C13 | 110.6° | 103.2° |
| N3 | C11 | N2 | 118.6° | 119.1° |
| N3 | C11 | N1 | 116.5° | 119.2° |
| H121 | C12 | H122 | 109.4° | 109.4° |
| H121 | C12 | H123 | 109.4° | 109.5° |
| H122 | C12 | H123 | 100.7° | 109.4° |
| S1 | C13 | H131 | 107.7° | 109.5° |
| S1 | C13 | H132 | 112.8° | 109.5° |
| S1 | C13 | H133 | 112.8° | 109.5° |
| H131 | C13 | H132 | 113.0° | 109.5° |
| H131 | C13 | H133 | 112.9° | 109.4° |
| H132 | C13 | H133 | 97.6° | 109.5° |
| C10 | C8 | N1 | 118.5° | 119.0° |
| C10 | C8 | C81 | 124.5° | 120.5° |
| C8 | C10 | C9 | 116.2° | 118.5° |
| C8 | C10 | C7 | 122.7° | 120.8° |
| N1 | C8 | C81 | 117.0° | 120.5° |
| C8 | N1 | C11 | 120.7° | 120.6° |
| C8 | C81 | C82 | 124.4° | 120.1° |
| C8 | C81 | C86 | 118.1° | 120.1° |
| C9 | C10 | C7 | 121.1° | 120.8° |
| C10 | C9 | N2 | 119.8° | 119.3° |
| C10 | C9 | C91 | 123.0° | 120.4° |
| C10 | C7 | C6 | 125.5° | 109.4° |
| C10 | C7 | H71 | 106.6° | 109.5° |
| C10 | C7 | H72 | 106.6° | 109.5° |
| N2 | C9 | C91 | 117.2° | 120.3° |
| C9 | N2 | C11 | 119.9° | 120.9° |
| C9 | C91 | C92 | 113.7° | 109.5° |
| C9 | C91 | C93 | 110.9° | 109.5° |
| C9 | C91 | H91 | 105.2° | 109.5° |
| N2 | C11 | N1 | 124.9° | 121.7° |
| C82 | C83 | C84 | 119.9° | 120.1° |
| C82 | C83 | H83 | 120.3° | 120.0° |
| C83 | C82 | C81 | 120.0° | 119.9° |
| C83 | C82 | H82 | 120.0° | 120.0° |
| C84 | C83 | H83 | 119.8° | 119.9° |
| C83 | C84 | C85 | 120.3° | 120.2° |
| C83 | C84 | F1 | 120.8° | 119.9° |
| C81 | C82 | H82 | 120.0° | 120.1° |
| C82 | C81 | C86 | 117.4° | 119.8° |
| C81 | C86 | C85 | 122.3° | 119.9° |
| C81 | C86 | H86 | 120.0° | 120.0° |
| C85 | C86 | H86 | 117.7° | 120.0° |
| C86 | C85 | C84 | 119.9° | 120.1° |
| C86 | C85 | H85 | 120.5° | 120.0° |
| C84 | C85 | H85 | 119.6° | 119.9° |
| C85 | C84 | F1 | 118.9° | 119.9° |
| C1 | O1B | H1B | 123.9° | 120.0° |
| O1B | C1 | O1A | 123.9° | 120.0° |
| O1B | C1 | C2 | 124.0° | 120.0° |
| O1A | C1 | C2 | 112.2° | 120.0° |
| C3 | O3 | HO3 | 107.0° | 106.9° |
| O3 | C3 | C2 | 107.0° | 109.5° |
| O3 | C3 | C4 | 108.9° | 109.4° |
| O3 | C3 | H3 | 112.0° | 109.5° |
| C1 | C2 | C3 | 113.3° | 109.5° |
| C1 | C2 | H21 | 110.8° | 109.4° |
| C1 | C2 | H22 | 110.8° | 109.5° |
| C3 | C2 | H21 | 110.8° | 109.5° |
| C3 | C2 | H22 | 110.8° | 109.5° |
| C2 | C3 | C4 | 111.2° | 109.5° |
| C2 | C3 | H3 | 109.8° | 109.5° |
| H21 | C2 | H22 | 99.5° | 109.5° |
| C4 | C3 | H3 | 108.0° | 109.5° |
| C3 | C4 | C5 | 113.6° | 109.5° |
| C3 | C4 | H41 | 110.7° | 109.4° |
| C3 | C4 | H42 | 110.7° | 109.5° |
| C5 | C4 | H41 | 110.8° | 109.5° |
| C5 | C4 | H42 | 110.7° | 109.5° |
| C4 | C5 | C6 | 110.6° | 109.5° |
| C4 | C5 | O5 | 107.4° | 109.5° |
| C4 | C5 | H5 | 110.3° | 109.5° |
| H41 | C4 | H42 | 99.5° | 109.5° |
| C6 | C5 | O5 | 110.3° | 109.5° |
| C6 | C5 | H5 | 107.6° | 109.5° |
| C5 | C6 | C7 | 124.9° | 109.5° |
| C5 | C6 | H61 | 106.7° | 109.5° |
| C5 | C6 | H62 | 106.7° | 109.4° |
| O5 | C5 | H5 | 110.7° | 109.4° |
| C5 | O5 | HO5 | 107.4° | 106.8° |
| C7 | C6 | H61 | 106.8° | 109.4° |
| C7 | C6 | H62 | 106.8° | 109.4° |
| C6 | C7 | H71 | 106.5° | 109.4° |
| C6 | C7 | H72 | 106.5° | 109.4° |
| H61 | C6 | H62 | 102.8° | 109.6° |
| H71 | C7 | H72 | 103.0° | 109.5° |
| C92 | C91 | C93 | 108.7° | 109.5° |
| C92 | C91 | H91 | 107.6° | 109.5° |
| C91 | C92 | H921 | 113.7° | 109.5° |
| C91 | C92 | H922 | 110.6° | 109.5° |
| C91 | C92 | H923 | 110.6° | 109.6° |
| C93 | C91 | H91 | 110.5° | 109.4° |
| C91 | C93 | H931 | 110.9° | 109.5° |
| C91 | C93 | H932 | 111.7° | 109.5° |
| C91 | C93 | H933 | 111.7° | 109.5° |
| H921 | C92 | H922 | 110.7° | 109.5° |
| H921 | C92 | H923 | 110.7° | 109.4° |
| H922 | C92 | H923 | 99.7° | 109.4° |
| H931 | C93 | H932 | 111.7° | 109.5° |
| H931 | C93 | H933 | 111.6° | 109.5° |
| H932 | C93 | H933 | 98.7° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1S | S1 | O2S | N3 | 121.7° | 114.3° |
| O1S | S1 | O2S | C13 | 116.1° | 135.7° |
| O1S | S1 | N3 | C12 | 128.8° | 26.2° |
| O1S | S1 | N3 | C13 | 119.7° | 116.2° |
| O1S | S1 | N3 | C11 | 51.9° | 153.8° |
| O1S | S1 | C13 | H131 | 179.9° | 70.2° |
| O1S | S1 | C13 | H132 | 54.7° | 169.8° |
| O1S | S1 | C13 | H133 | 54.7° | 49.8° |
| O2S | S1 | N3 | C12 | 9.7° | 153.8° |
| O2S | S1 | N3 | C13 | 121.3° | 116.2° |
| O2S | S1 | N3 | C11 | 171.0° | 26.2° |
| O2S | S1 | C13 | H131 | 64.4° | 70.3° |
| O2S | S1 | C13 | H132 | 61.0° | 49.7° |
| O2S | S1 | C13 | H133 | 170.4° | 169.8° |
| C12 | N3 | S1 | C11 | 179.3° | 180.0° |
| N3 | C12 | H121 | H122 | 125.2° | 120.0° |
| N3 | C12 | H121 | H123 | 125.3° | 120.0° |
| N3 | C12 | H122 | H123 | 115.2° | 120.0° |
| C12 | N3 | S1 | C13 | 111.5° | 90.0° |
| C12 | N3 | C11 | N2 | 160.0° | 0.1° |
| C12 | N3 | C11 | N1 | 20.0° | 180.0° |
| S1 | N3 | C12 | H121 | 180.0° | 180.0° |
| S1 | N3 | C12 | H122 | 54.8° | 60.0° |
| S1 | N3 | C12 | H123 | 54.7° | 60.0° |
| N3 | S1 | C13 | H131 | 58.1° | 180.0° |
| N3 | S1 | C13 | H132 | 176.6° | 60.0° |
| N3 | S1 | C13 | H133 | 67.1° | 60.1° |
| S1 | N3 | C11 | N2 | 19.2° | 179.9° |
| S1 | N3 | C11 | N1 | 160.8° | 0.0° |
| C11 | N3 | C12 | H121 | 0.8° | 0.0° |
| C11 | N3 | C12 | H122 | 126.0° | 120.0° |
| C11 | N3 | C12 | H123 | 124.5° | 120.0° |
| C11 | N3 | S1 | C13 | 67.7° | 90.0° |
| N3 | C11 | N1 | C8 | 179.2° | 180.0° |
| N3 | C11 | N2 | C9 | 179.2° | 180.0° |
| N3 | C11 | N2 | N1 | 180.0° | 179.9° |
| H121 | C12 | H122 | H123 | 115.2° | 120.0° |
| S1 | C13 | H131 | H132 | 125.3° | 120.0° |
| S1 | C13 | H131 | H133 | 125.2° | 120.0° |
| S1 | C13 | H132 | H133 | 118.7° | 120.0° |
| H131 | C13 | H132 | H133 | 118.8° | 120.0° |
| C10 | C8 | N1 | C81 | 178.7° | 179.8° |
| C8 | C10 | C9 | C7 | 179.6° | 179.4° |
| C8 | C10 | C9 | N2 | 1.1° | 0.6° |
| C8 | C10 | C9 | C91 | 178.6° | 179.8° |
| C10 | C8 | N1 | C11 | 0.2° | 0.2° |
| C10 | C8 | C81 | C82 | 119.4° | 49.3° |
| C10 | C8 | C81 | C86 | 62.0° | 131.0° |
| C8 | C10 | C7 | C6 | 110.3° | 95.4° |
| C8 | C10 | C7 | H71 | 14.9° | 144.6° |
| C8 | C10 | C7 | H72 | 124.4° | 24.6° |
| N1 | C8 | C10 | C9 | 1.1° | 0.5° |
| N1 | C8 | C10 | C7 | 179.3° | 179.9° |
| C8 | N1 | C11 | N2 | 0.8° | 0.0° |
| N1 | C8 | C81 | C82 | 62.0° | 130.9° |
| N1 | C8 | C81 | C86 | 116.5° | 48.8° |
| C81 | C8 | C10 | C9 | 177.5° | 179.7° |
| C81 | C8 | C10 | C7 | 2.1° | 0.3° |
| C81 | C8 | N1 | C11 | 178.5° | 180.0° |
| C8 | C81 | C82 | C83 | 178.8° | 179.9° |
| C8 | C81 | C82 | C86 | 178.6° | 179.7° |
| C8 | C81 | C82 | H82 | 1.2° | 0.1° |
| C8 | C81 | C86 | C85 | 178.8° | 179.8° |
| C8 | C81 | C86 | H86 | 1.2° | 0.3° |
| C10 | C9 | N2 | C91 | 179.7° | 179.7° |
| C10 | C9 | N2 | C11 | 0.2° | 0.4° |
| C9 | C10 | C7 | C6 | 69.3° | 85.2° |
| C9 | C10 | C7 | H71 | 165.5° | 34.8° |
| C9 | C10 | C7 | H72 | 56.0° | 154.9° |
| C10 | C9 | C91 | C92 | 135.0° | 119.7° |
| C10 | C9 | C91 | C93 | 102.1° | 120.3° |
| C10 | C9 | C91 | H91 | 17.5° | 0.3° |
| C7 | C10 | C9 | N2 | 179.3° | 180.0° |
| C7 | C10 | C9 | C91 | 1.0° | 0.3° |
| C10 | C7 | C6 | C5 | 178.6° | 175.2° |
| C10 | C7 | C6 | H71 | 125.3° | 120.0° |
| C10 | C7 | C6 | H72 | 125.3° | 120.0° |
| C10 | C7 | C6 | H61 | 56.2° | 55.2° |
| C10 | C7 | C6 | H62 | 53.3° | 64.9° |
| C10 | C7 | H71 | H72 | 112.0° | 120.1° |
| C9 | N2 | C11 | N1 | 0.8° | 0.1° |
| N2 | C9 | C91 | C92 | 45.3° | 60.0° |
| N2 | C9 | C91 | C93 | 77.6° | 60.0° |
| N2 | C9 | C91 | H91 | 162.8° | 180.0° |
| C91 | C9 | N2 | C11 | 179.5° | 180.0° |
| C9 | C91 | C92 | C93 | 124.1° | 120.0° |
| C9 | C91 | C92 | H91 | 116.1° | 120.0° |
| C9 | C91 | C93 | H91 | 116.4° | 120.0° |
| C9 | C91 | C92 | H921 | 180.0° | 60.0° |
| C9 | C91 | C92 | H922 | 54.7° | 60.0° |
| C9 | C91 | C92 | H923 | 54.7° | 180.0° |
| C9 | C91 | C93 | H931 | 180.0° | 60.0° |
| C9 | C91 | C93 | H932 | 54.7° | 180.0° |
| C9 | C91 | C93 | H933 | 54.8° | 60.0° |
| C82 | C83 | C84 | H83 | 180.0° | 180.0° |
| C83 | C82 | C81 | H82 | 180.0° | 180.0° |
| C83 | C82 | C81 | C86 | 0.2° | 0.3° |
| C82 | C83 | C84 | C85 | 0.1° | 0.1° |
| C82 | C83 | C84 | F1 | 179.7° | 180.0° |
| C84 | C83 | C82 | C81 | 0.2° | 0.0° |
| C84 | C83 | C82 | H82 | 179.9° | 180.0° |
| C83 | C84 | C85 | C86 | 0.1° | 0.4° |
| C83 | C84 | C85 | F1 | 179.8° | 179.9° |
| C83 | C84 | C85 | H85 | 179.9° | 180.0° |
| H83 | C83 | C82 | C81 | 179.8° | 180.0° |
| H83 | C83 | C82 | H82 | 0.2° | 0.0° |
| H83 | C83 | C84 | C85 | 179.9° | 179.9° |
| H83 | C83 | C84 | F1 | 0.4° | 0.1° |
| C82 | C81 | C86 | C85 | 0.2° | 0.6° |
| C82 | C81 | C86 | H86 | 179.8° | 180.0° |
| H82 | C82 | C81 | C86 | 179.8° | 179.7° |
| C81 | C86 | C85 | H86 | 180.0° | 179.5° |
| C81 | C86 | C85 | C84 | 0.1° | 0.6° |
| C81 | C86 | C85 | H85 | 179.9° | 179.8° |
| C86 | C85 | C84 | H85 | 180.0° | 179.6° |
| C86 | C85 | C84 | F1 | 179.7° | 179.8° |
| H86 | C86 | C85 | C84 | 179.9° | 179.9° |
| H86 | C86 | C85 | H85 | 0.1° | 0.3° |
| H85 | C85 | C84 | F1 | 0.3° | 0.1° |
| O1B | C1 | O1A | C2 | 179.7° | 180.0° |
| O1B | C1 | C2 | C3 | 102.5° | 180.0° |
| O1B | C1 | C2 | H21 | 132.2° | 60.0° |
| O1B | C1 | C2 | H22 | 22.8° | 60.0° |
| H1B | O1B | C1 | O1A | 180.0° | 0.0° |
| H1B | O1B | C1 | C2 | 0.3° | 180.0° |
| O1A | C1 | C2 | C3 | 77.2° | 0.0° |
| O1A | C1 | C2 | H21 | 48.1° | 120.0° |
| O1A | C1 | C2 | H22 | 157.5° | 120.0° |
| O3 | C3 | C2 | C1 | 61.8° | 60.0° |
| O3 | C3 | C2 | C4 | 118.8° | 120.0° |
| O3 | C3 | C2 | H3 | 121.8° | 120.0° |
| O3 | C3 | C2 | H21 | 172.9° | 59.9° |
| O3 | C3 | C2 | H22 | 63.5° | 180.0° |
| O3 | C3 | C4 | H3 | 121.8° | 120.0° |
| O3 | C3 | C4 | C5 | 68.0° | 60.0° |
| O3 | C3 | C4 | H41 | 166.6° | 60.0° |
| O3 | C3 | C4 | H42 | 57.2° | 180.0° |
| HO3 | O3 | C3 | C2 | 180.0° | 60.0° |
| HO3 | O3 | C3 | C4 | 59.7° | 60.0° |
| HO3 | O3 | C3 | H3 | 59.7° | 180.0° |
| C1 | C2 | C3 | H21 | 125.3° | 120.0° |
| C1 | C2 | C3 | H22 | 125.2° | 120.0° |
| C1 | C2 | H21 | H22 | 116.6° | 120.0° |
| C1 | C2 | C3 | C4 | 179.4° | 180.0° |
| C1 | C2 | C3 | H3 | 60.0° | 60.0° |
| C3 | C2 | H21 | H22 | 116.7° | 120.0° |
| C2 | C3 | C4 | H3 | 120.5° | 120.0° |
| C2 | C3 | C4 | C5 | 174.3° | 180.0° |
| C2 | C3 | C4 | H41 | 48.9° | 60.0° |
| C2 | C3 | C4 | H42 | 60.4° | 60.0° |
| H21 | C2 | C3 | C4 | 54.1° | 60.0° |
| H21 | C2 | C3 | H3 | 65.3° | 179.9° |
| H22 | C2 | C3 | C4 | 55.3° | 60.0° |
| H22 | C2 | C3 | H3 | 174.7° | 60.0° |
| C3 | C4 | C5 | H41 | 125.3° | 120.0° |
| C3 | C4 | C5 | H42 | 125.3° | 120.0° |
| C3 | C4 | H41 | H42 | 116.5° | 120.0° |
| C3 | C4 | C5 | C6 | 60.3° | 180.0° |
| C3 | C4 | C5 | O5 | 179.3° | 60.0° |
| C3 | C4 | C5 | H5 | 58.6° | 60.0° |
| H3 | C3 | C4 | C5 | 53.8° | 60.0° |
| H3 | C3 | C4 | H41 | 71.5° | 180.0° |
| H3 | C3 | C4 | H42 | 179.1° | 60.0° |
| C5 | C4 | H41 | H42 | 116.6° | 120.0° |
| C4 | C5 | C6 | O5 | 118.6° | 120.0° |
| C4 | C5 | C6 | H5 | 120.6° | 120.1° |
| C4 | C5 | O5 | H5 | 120.5° | 120.0° |
| C4 | C5 | C6 | C7 | 140.7° | 180.0° |
| C4 | C5 | C6 | H61 | 15.4° | 60.1° |
| C4 | C5 | C6 | H62 | 94.0° | 60.1° |
| C4 | C5 | O5 | HO5 | 180.0° | 60.0° |
| H41 | C4 | C5 | C6 | 65.0° | 60.0° |
| H41 | C4 | C5 | O5 | 55.4° | 60.0° |
| H41 | C4 | C5 | H5 | 176.1° | 179.9° |
| H42 | C4 | C5 | C6 | 174.4° | 60.0° |
| H42 | C4 | C5 | O5 | 54.1° | 180.0° |
| H42 | C4 | C5 | H5 | 66.7° | 60.0° |
| C6 | C5 | O5 | H5 | 118.9° | 119.9° |
| C5 | C6 | C7 | H61 | 125.3° | 120.0° |
| C5 | C6 | C7 | H62 | 125.3° | 119.9° |
| C5 | C6 | H61 | H62 | 112.1° | 120.0° |
| C5 | C6 | C7 | H71 | 56.2° | 64.8° |
| C5 | C6 | C7 | H72 | 53.3° | 55.2° |
| C6 | C5 | O5 | HO5 | 59.5° | 60.0° |
| O5 | C5 | C6 | C7 | 100.7° | 60.0° |
| O5 | C5 | C6 | H61 | 134.0° | 59.9° |
| O5 | C5 | C6 | H62 | 24.6° | 179.9° |
| H5 | C5 | C6 | C7 | 20.1° | 59.9° |
| H5 | C5 | C6 | H61 | 105.2° | 179.9° |
| H5 | C5 | C6 | H62 | 145.4° | 60.0° |
| H5 | C5 | O5 | HO5 | 59.4° | 180.0° |
| C7 | C6 | H61 | H62 | 112.2° | 120.0° |
| C6 | C7 | H71 | H72 | 111.9° | 119.9° |
| H61 | C6 | C7 | H71 | 69.1° | 175.2° |
| H61 | C6 | C7 | H72 | 178.5° | 64.8° |
| H62 | C6 | C7 | H71 | 178.6° | 55.1° |
| H62 | C6 | C7 | H72 | 72.0° | 175.1° |
| C92 | C91 | C93 | H91 | 117.9° | 120.0° |
| C91 | C92 | H921 | H922 | 125.2° | 120.0° |
| C91 | C92 | H921 | H923 | 125.2° | 120.1° |
| C91 | C92 | H922 | H923 | 116.5° | 120.1° |
| C92 | C91 | C93 | H931 | 54.3° | 180.0° |
| C92 | C91 | C93 | H932 | 71.0° | 59.9° |
| C92 | C91 | C93 | H933 | 179.5° | 60.0° |
| C93 | C91 | C92 | H921 | 55.9° | 180.0° |
| C93 | C91 | C92 | H922 | 178.8° | 60.0° |
| C93 | C91 | C92 | H923 | 69.3° | 60.0° |
| C91 | C93 | H931 | H932 | 125.3° | 120.1° |
| C91 | C93 | H931 | H933 | 125.2° | 120.1° |
| C91 | C93 | H932 | H933 | 117.6° | 120.0° |
| H91 | C91 | C92 | H921 | 63.8° | 60.1° |
| H91 | C91 | C92 | H922 | 61.4° | 179.9° |
| H91 | C91 | C92 | H923 | 170.9° | 60.0° |
| H91 | C91 | C93 | H931 | 63.6° | 60.0° |
| H91 | C91 | C93 | H932 | 171.1° | 60.1° |
| H91 | C91 | C93 | H933 | 61.6° | 180.0° |
| H921 | C92 | H922 | H923 | 116.6° | 119.9° |
| H931 | C93 | H932 | H933 | 117.5° | 119.9° |
