TP4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.55Å | 1.54Å | |
| C1 | C5 | sing | 1.55Å | 1.54Å | |
| C1 | HC11 | sing | 1.09Å | 1.12Å | |
| C1 | HC12 | sing | 1.09Å | 1.12Å | |
| C2 | N3 | sing | 1.48Å | 1.47Å | |
| C2 | HC21 | sing | 1.09Å | 1.11Å | |
| C2 | HC22 | sing | 1.09Å | 1.11Å | |
| N3 | C4 | sing | 1.47Å | 1.48Å | |
| N3 | S9 | sing | 1.66Å | 1.72Å | |
| C4 | C5 | sing | 1.54Å | 1.55Å | |
| C4 | C6 | sing | 1.51Å | 1.57Å | |
| C4 | HC41 | sing | 1.09Å | 1.11Å | |
| C5 | HC51 | sing | 1.09Å | 1.12Å | |
| C5 | HC52 | sing | 1.09Å | 1.12Å | |
| C6 | O7 | doub | 1.21Å | 1.24Å | |
| C6 | N8 | sing | 1.35Å | 1.34Å | |
| N8 | C30 | sing | 1.47Å | 1.46Å | |
| N8 | HN81 | sing | 0.97Å | 1.02Å | |
| S9 | C10 | sing | 1.76Å | 1.75Å | |
| S9 | O11 | doub | 1.42Å | 1.57Å | |
| S9 | O12 | doub | 1.42Å | 1.57Å | |
| C10 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | H131 | sing | 1.08Å | 1.10Å | |
| C14 | C15 | doub | 1.40Å | 1.41Å | Aromatic |
| C14 | H141 | sing | 1.08Å | 1.10Å | |
| C15 | C16 | sing | 1.40Å | 1.40Å | Aromatic |
| C15 | C18 | sing | 1.48Å | 1.52Å | |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C16 | H161 | sing | 1.08Å | 1.10Å | |
| C17 | H171 | sing | 1.08Å | 1.10Å | |
| C18 | N19 | sing | 1.35Å | 1.34Å | |
| C18 | O24 | doub | 1.22Å | 1.24Å | |
| N19 | C20 | sing | 1.46Å | 1.51Å | |
| N19 | H191 | sing | 0.97Å | 1.02Å | |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C20 | C25 | sing | 1.51Å | 1.57Å | |
| C20 | H201 | sing | 1.09Å | 1.12Å | |
| C21 | C22 | sing | 1.53Å | 1.54Å | |
| C21 | H211 | sing | 1.09Å | 1.11Å | |
| C21 | H212 | sing | 1.09Å | 1.12Å | |
| C22 | C23 | sing | 1.51Å | 1.53Å | |
| C22 | H221 | sing | 1.09Å | 1.12Å | |
| C22 | H222 | sing | 1.09Å | 1.11Å | |
| C23 | O28 | sing | 1.34Å | 1.25Å | |
| C23 | O29 | doub | 1.21Å | 1.25Å | |
| C25 | O26 | doub | 1.21Å | 1.23Å | |
| C25 | O27 | sing | 1.34Å | 1.25Å | |
| O27 | H271 | sing | 0.97Å | 0.95Å | |
| O28 | H281 | sing | 0.97Å | 0.95Å | |
| C30 | C31 | sing | 1.53Å | 1.54Å | |
| C30 | H301 | sing | 1.09Å | 1.11Å | |
| C30 | H302 | sing | 1.09Å | 1.12Å | |
| C31 | C32 | sing | 1.51Å | 1.54Å | |
| C31 | H311 | sing | 1.09Å | 1.11Å | |
| C31 | H312 | sing | 1.09Å | 1.11Å | |
| C32 | O33 | sing | 1.34Å | 1.25Å | |
| C32 | O34 | doub | 1.21Å | 1.24Å | |
| O33 | H331 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C5 | 103.1° | 101.6° |
| C2 | C1 | HC11 | 114.7° | 111.0° |
| C2 | C1 | HC12 | 114.7° | 111.0° |
| C1 | C2 | N3 | 102.3° | 104.8° |
| C1 | C2 | HC21 | 114.9° | 110.4° |
| C1 | C2 | HC22 | 114.9° | 110.3° |
| C5 | C1 | HC11 | 114.6° | 111.0° |
| C5 | C1 | HC12 | 114.7° | 111.0° |
| C1 | C5 | C4 | 100.8° | 102.9° |
| C1 | C5 | HC51 | 115.5° | 110.7° |
| C1 | C5 | HC52 | 115.5° | 110.7° |
| HC11 | C1 | HC12 | 95.7° | 110.9° |
| N3 | C2 | HC21 | 114.9° | 110.3° |
| N3 | C2 | HC22 | 115.0° | 110.5° |
| C2 | N3 | C4 | 112.5° | 108.6° |
| C2 | N3 | S9 | 119.7° | 125.6° |
| HC21 | C2 | HC22 | 95.6° | 110.4° |
| C4 | N3 | S9 | 120.1° | 125.8° |
| N3 | C4 | C5 | 101.3° | 107.4° |
| N3 | C4 | C6 | 114.9° | 109.9° |
| N3 | C4 | HC41 | 113.5° | 109.9° |
| N3 | S9 | C10 | 113.1° | 107.4° |
| N3 | S9 | O11 | 109.3° | 105.8° |
| N3 | S9 | O12 | 105.8° | 105.7° |
| C5 | C4 | C6 | 114.9° | 109.9° |
| C5 | C4 | HC41 | 113.5° | 109.9° |
| C4 | C5 | HC51 | 115.5° | 110.7° |
| C4 | C5 | HC52 | 115.5° | 110.7° |
| C6 | C4 | HC41 | 99.4° | 109.9° |
| C4 | C6 | O7 | 116.7° | 120.0° |
| C4 | C6 | N8 | 122.1° | 120.0° |
| HC51 | C5 | HC52 | 94.9° | 110.8° |
| O7 | C6 | N8 | 121.2° | 120.0° |
| C6 | N8 | C30 | 131.0° | 120.0° |
| C6 | N8 | HN81 | 109.1° | 120.0° |
| C30 | N8 | HN81 | 119.9° | 120.0° |
| N8 | C30 | C31 | 110.0° | 109.4° |
| N8 | C30 | H301 | 112.0° | 109.5° |
| N8 | C30 | H302 | 112.0° | 109.5° |
| C10 | S9 | O11 | 110.6° | 105.8° |
| C10 | S9 | O12 | 105.4° | 105.8° |
| S9 | C10 | C13 | 115.1° | 119.8° |
| S9 | C10 | C17 | 119.8° | 119.8° |
| O11 | S9 | O12 | 112.6° | 125.4° |
| C13 | C10 | C17 | 125.0° | 120.4° |
| C10 | C13 | C14 | 117.8° | 120.1° |
| C10 | C13 | H131 | 121.1° | 120.0° |
| C10 | C17 | C16 | 116.9° | 120.1° |
| C10 | C17 | H171 | 121.4° | 119.9° |
| C14 | C13 | H131 | 121.2° | 119.9° |
| C13 | C14 | C15 | 119.3° | 119.9° |
| C13 | C14 | H141 | 119.4° | 120.1° |
| C15 | C14 | H141 | 121.3° | 120.0° |
| C14 | C15 | C16 | 121.1° | 119.7° |
| C14 | C15 | C18 | 117.8° | 120.2° |
| C16 | C15 | C18 | 121.1° | 120.2° |
| C15 | C16 | C17 | 119.9° | 119.9° |
| C15 | C16 | H161 | 120.3° | 120.1° |
| C15 | C18 | N19 | 117.9° | 120.0° |
| C15 | C18 | O24 | 119.6° | 120.0° |
| C17 | C16 | H161 | 119.8° | 120.1° |
| C16 | C17 | H171 | 121.7° | 120.0° |
| N19 | C18 | O24 | 122.0° | 120.0° |
| C18 | N19 | C20 | 118.2° | 120.0° |
| C18 | N19 | H191 | 115.3° | 120.0° |
| C20 | N19 | H191 | 126.5° | 120.1° |
| N19 | C20 | C21 | 112.8° | 109.4° |
| N19 | C20 | C25 | 103.3° | 109.5° |
| N19 | C20 | H201 | 112.7° | 109.6° |
| C21 | C20 | C25 | 113.0° | 109.4° |
| C21 | C20 | H201 | 102.9° | 109.4° |
| C20 | C21 | C22 | 116.0° | 109.5° |
| C20 | C21 | H211 | 109.8° | 109.5° |
| C20 | C21 | H212 | 109.8° | 109.5° |
| C25 | C20 | H201 | 112.5° | 109.5° |
| C20 | C25 | O26 | 117.9° | 120.0° |
| C20 | C25 | O27 | 115.5° | 120.0° |
| C22 | C21 | H211 | 109.8° | 109.5° |
| C22 | C21 | H212 | 109.8° | 109.5° |
| C21 | C22 | C23 | 108.7° | 109.5° |
| C21 | C22 | H221 | 112.5° | 109.5° |
| C21 | C22 | H222 | 112.5° | 109.5° |
| H211 | C21 | H212 | 100.3° | 109.4° |
| C23 | C22 | H221 | 112.5° | 109.4° |
| C23 | C22 | H222 | 112.5° | 109.5° |
| C22 | C23 | O28 | 120.6° | 120.0° |
| C22 | C23 | O29 | 118.9° | 120.0° |
| H221 | C22 | H222 | 97.9° | 109.5° |
| O28 | C23 | O29 | 120.4° | 120.0° |
| C23 | O28 | H281 | 120.6° | 120.0° |
| O26 | C25 | O27 | 126.6° | 120.0° |
| C25 | O27 | H271 | 115.5° | 120.0° |
| C31 | C30 | H301 | 112.1° | 109.5° |
| C31 | C30 | H302 | 112.0° | 109.4° |
| C30 | C31 | C32 | 108.0° | 109.4° |
| C30 | C31 | H311 | 112.7° | 109.5° |
| C30 | C31 | H312 | 112.7° | 109.5° |
| H301 | C30 | H302 | 98.4° | 109.5° |
| C32 | C31 | H311 | 112.8° | 109.4° |
| C32 | C31 | H312 | 112.8° | 109.5° |
| C31 | C32 | O33 | 117.8° | 120.0° |
| C31 | C32 | O34 | 117.1° | 120.0° |
| H311 | C31 | H312 | 97.7° | 109.5° |
| O33 | C32 | O34 | 125.1° | 120.0° |
| C32 | O33 | H331 | 117.8° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C5 | HC11 | 125.3° | 118.1° |
| C2 | C1 | C5 | HC12 | 125.3° | 118.1° |
| C2 | C1 | HC11 | HC12 | 120.5° | 123.9° |
| C1 | C2 | N3 | HC21 | 125.3° | 118.8° |
| C1 | C2 | N3 | HC22 | 125.2° | 118.8° |
| C1 | C2 | HC21 | HC22 | 120.7° | 122.2° |
| C1 | C2 | N3 | C4 | 7.1° | 24.3° |
| C1 | C2 | N3 | S9 | 142.4° | 155.9° |
| C2 | C1 | C5 | C4 | 44.3° | 35.5° |
| C2 | C1 | C5 | HC51 | 80.9° | 153.8° |
| C2 | C1 | C5 | HC52 | 169.6° | 82.9° |
| C5 | C1 | HC11 | HC12 | 120.5° | 123.9° |
| C5 | C1 | C2 | N3 | 31.9° | 37.1° |
| C5 | C1 | C2 | HC21 | 157.2° | 155.9° |
| C5 | C1 | C2 | HC22 | 93.4° | 81.9° |
| C1 | C5 | C4 | N3 | 38.8° | 22.1° |
| C1 | C5 | C4 | HC51 | 125.3° | 118.4° |
| C1 | C5 | C4 | HC52 | 125.2° | 118.4° |
| C1 | C5 | C4 | C6 | 163.3° | 141.6° |
| C1 | C5 | C4 | HC41 | 83.2° | 97.4° |
| C1 | C5 | HC51 | HC52 | 121.3° | 123.2° |
| HC11 | C1 | C2 | N3 | 157.2° | 81.0° |
| HC11 | C1 | C2 | HC21 | 77.6° | 37.8° |
| HC11 | C1 | C2 | HC22 | 31.9° | 160.0° |
| HC11 | C1 | C5 | C4 | 169.6° | 82.6° |
| HC11 | C1 | C5 | HC51 | 44.4° | 35.8° |
| HC11 | C1 | C5 | HC52 | 65.1° | 159.1° |
| HC12 | C1 | C2 | N3 | 93.4° | 155.2° |
| HC12 | C1 | C2 | HC21 | 31.9° | 86.0° |
| HC12 | C1 | C2 | HC22 | 141.3° | 36.2° |
| HC12 | C1 | C5 | C4 | 81.0° | 153.6° |
| HC12 | C1 | C5 | HC51 | 153.7° | 88.0° |
| HC12 | C1 | C5 | HC52 | 44.3° | 35.2° |
| N3 | C2 | HC21 | HC22 | 120.8° | 122.4° |
| C2 | N3 | C4 | S9 | 149.4° | 179.8° |
| C2 | N3 | C4 | C5 | 20.2° | 1.2° |
| C2 | N3 | C4 | C6 | 144.7° | 118.2° |
| C2 | N3 | C4 | HC41 | 101.7° | 120.7° |
| C2 | N3 | S9 | C10 | 58.0° | 87.3° |
| C2 | N3 | S9 | O11 | 65.5° | 25.4° |
| C2 | N3 | S9 | O12 | 172.9° | 160.1° |
| HC21 | C2 | N3 | C4 | 132.3° | 143.1° |
| HC21 | C2 | N3 | S9 | 17.2° | 37.1° |
| HC22 | C2 | N3 | C4 | 118.1° | 94.5° |
| HC22 | C2 | N3 | S9 | 92.4° | 85.2° |
| N3 | C4 | C5 | C6 | 124.5° | 119.5° |
| N3 | C4 | C5 | HC41 | 122.0° | 119.5° |
| N3 | C4 | C6 | HC41 | 121.5° | 121.0° |
| N3 | C4 | C5 | HC51 | 86.5° | 140.4° |
| N3 | C4 | C5 | HC52 | 164.0° | 96.3° |
| N3 | C4 | C6 | O7 | 29.2° | 25.2° |
| N3 | C4 | C6 | N8 | 152.6° | 154.8° |
| C4 | N3 | S9 | C10 | 89.2° | 93.0° |
| C4 | N3 | S9 | O11 | 147.2° | 154.4° |
| C4 | N3 | S9 | O12 | 25.7° | 19.6° |
| S9 | N3 | C4 | C5 | 169.6° | 179.0° |
| S9 | N3 | C4 | C6 | 65.9° | 61.5° |
| S9 | N3 | C4 | HC41 | 47.7° | 59.5° |
| N3 | S9 | C10 | O11 | 122.9° | 112.6° |
| N3 | S9 | C10 | O12 | 115.1° | 112.6° |
| N3 | S9 | O11 | O12 | 117.3° | 123.1° |
| N3 | S9 | C10 | C13 | 56.0° | 92.9° |
| N3 | S9 | C10 | C17 | 127.7° | 87.3° |
| C5 | C4 | C6 | HC41 | 121.5° | 121.0° |
| C4 | C5 | HC51 | HC52 | 121.4° | 123.2° |
| C5 | C4 | C6 | O7 | 87.7° | 92.8° |
| C5 | C4 | C6 | N8 | 90.4° | 87.3° |
| C6 | C4 | C5 | HC51 | 38.0° | 100.0° |
| C6 | C4 | C5 | HC52 | 71.5° | 23.2° |
| C4 | C6 | O7 | N8 | 178.2° | 180.0° |
| C4 | C6 | N8 | C30 | 171.5° | 180.0° |
| C4 | C6 | N8 | HN81 | 8.5° | 0.1° |
| HC41 | C4 | C5 | HC51 | 151.5° | 21.0° |
| HC41 | C4 | C5 | HC52 | 42.0° | 144.2° |
| HC41 | C4 | C6 | O7 | 150.8° | 146.2° |
| HC41 | C4 | C6 | N8 | 31.1° | 33.7° |
| O7 | C6 | N8 | C30 | 10.4° | 0.0° |
| O7 | C6 | N8 | HN81 | 169.6° | 180.0° |
| C6 | N8 | C30 | HN81 | 180.0° | 180.0° |
| C6 | N8 | C30 | C31 | 89.9° | 180.0° |
| C6 | N8 | C30 | H301 | 35.4° | 60.0° |
| C6 | N8 | C30 | H302 | 144.8° | 60.1° |
| N8 | C30 | C31 | H301 | 125.3° | 120.0° |
| N8 | C30 | C31 | H302 | 125.3° | 120.0° |
| N8 | C30 | H301 | H302 | 117.9° | 120.0° |
| N8 | C30 | C31 | C32 | 169.6° | 180.0° |
| N8 | C30 | C31 | H311 | 65.1° | 60.0° |
| N8 | C30 | C31 | H312 | 44.3° | 60.0° |
| HN81 | N8 | C30 | C31 | 90.2° | 0.0° |
| HN81 | N8 | C30 | H301 | 144.5° | 120.0° |
| HN81 | N8 | C30 | H302 | 35.1° | 120.0° |
| C10 | S9 | O11 | O12 | 117.6° | 123.2° |
| S9 | C10 | C13 | C17 | 176.1° | 179.7° |
| S9 | C10 | C13 | C14 | 177.3° | 180.0° |
| S9 | C10 | C13 | H131 | 2.7° | 0.0° |
| S9 | C10 | C17 | C16 | 176.9° | 179.8° |
| S9 | C10 | C17 | H171 | 3.1° | 0.3° |
| O11 | S9 | C10 | C13 | 178.8° | 19.7° |
| O11 | S9 | C10 | C17 | 4.8° | 160.0° |
| O12 | S9 | C10 | C13 | 59.2° | 154.5° |
| O12 | S9 | C10 | C17 | 117.2° | 25.2° |
| C10 | C13 | C14 | H131 | 180.0° | 180.0° |
| C10 | C13 | C14 | C15 | 1.1° | 0.0° |
| C10 | C13 | C14 | H141 | 178.9° | 180.0° |
| C13 | C10 | C17 | C16 | 1.0° | 0.5° |
| C13 | C10 | C17 | H171 | 179.1° | 180.0° |
| C17 | C10 | C13 | C14 | 1.2° | 0.2° |
| C17 | C10 | C13 | H131 | 178.8° | 179.8° |
| C10 | C17 | C16 | C15 | 0.6° | 0.5° |
| C10 | C17 | C16 | H171 | 180.0° | 179.5° |
| C10 | C17 | C16 | H161 | 179.4° | 179.8° |
| C13 | C14 | C15 | H141 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.8° | 0.1° |
| C13 | C14 | C15 | C18 | 178.9° | 179.9° |
| H131 | C13 | C14 | C15 | 178.9° | 180.0° |
| H131 | C13 | C14 | H141 | 1.1° | 0.0° |
| C14 | C15 | C16 | C18 | 178.0° | 179.9° |
| C14 | C15 | C16 | C17 | 0.6° | 0.3° |
| C14 | C15 | C16 | H161 | 179.4° | 180.0° |
| C14 | C15 | C18 | N19 | 172.9° | 180.0° |
| C14 | C15 | C18 | O24 | 15.1° | 0.1° |
| H141 | C14 | C15 | C16 | 179.2° | 180.0° |
| H141 | C14 | C15 | C18 | 1.1° | 0.1° |
| C15 | C16 | C17 | H161 | 180.0° | 179.7° |
| C15 | C16 | C17 | H171 | 179.4° | 180.0° |
| C16 | C15 | C18 | N19 | 9.0° | 0.1° |
| C16 | C15 | C18 | O24 | 163.0° | 180.0° |
| C18 | C15 | C16 | C17 | 178.6° | 179.8° |
| C18 | C15 | C16 | H161 | 1.4° | 0.1° |
| C15 | C18 | N19 | O24 | 171.7° | 179.9° |
| C15 | C18 | N19 | C20 | 178.5° | 180.0° |
| C15 | C18 | N19 | H191 | 1.5° | 0.1° |
| H161 | C16 | C17 | H171 | 0.6° | 0.3° |
| C18 | N19 | C20 | H191 | 179.9° | 180.0° |
| C18 | N19 | C20 | C21 | 112.6° | 150.0° |
| C18 | N19 | C20 | C25 | 125.1° | 90.0° |
| C18 | N19 | C20 | H201 | 3.4° | 30.0° |
| O24 | C18 | N19 | C20 | 6.7° | 0.1° |
| O24 | C18 | N19 | H191 | 173.2° | 180.0° |
| N19 | C20 | C21 | C25 | 116.7° | 120.0° |
| N19 | C20 | C21 | H201 | 121.7° | 120.1° |
| N19 | C20 | C25 | H201 | 121.8° | 120.1° |
| N19 | C20 | C21 | C22 | 15.4° | 60.0° |
| N19 | C20 | C21 | H211 | 109.9° | 60.0° |
| N19 | C20 | C21 | H212 | 140.7° | 180.0° |
| N19 | C20 | C25 | O26 | 158.7° | 150.0° |
| N19 | C20 | C25 | O27 | 22.9° | 29.9° |
| H191 | N19 | C20 | C21 | 67.3° | 30.0° |
| H191 | N19 | C20 | C25 | 55.0° | 89.9° |
| H191 | N19 | C20 | H201 | 176.7° | 150.0° |
| C21 | C20 | C25 | H201 | 116.0° | 119.9° |
| C20 | C21 | C22 | H211 | 125.3° | 120.0° |
| C20 | C21 | C22 | H212 | 125.3° | 120.0° |
| C20 | C21 | H211 | H212 | 115.6° | 120.0° |
| C20 | C21 | C22 | C23 | 154.7° | 180.0° |
| C20 | C21 | C22 | H221 | 80.1° | 60.0° |
| C20 | C21 | C22 | H222 | 29.4° | 60.0° |
| C21 | C20 | C25 | O26 | 79.2° | 90.0° |
| C21 | C20 | C25 | O27 | 99.2° | 90.0° |
| C25 | C20 | C21 | C22 | 132.1° | 180.0° |
| C25 | C20 | C21 | H211 | 6.8° | 60.0° |
| C25 | C20 | C21 | H212 | 102.7° | 60.0° |
| C20 | C25 | O26 | O27 | 178.2° | 179.9° |
| C20 | C25 | O27 | H271 | 180.0° | 180.0° |
| H201 | C20 | C21 | C22 | 106.3° | 60.1° |
| H201 | C20 | C21 | H211 | 128.4° | 179.9° |
| H201 | C20 | C21 | H212 | 19.0° | 59.9° |
| H201 | C20 | C25 | O26 | 36.8° | 29.9° |
| H201 | C20 | C25 | O27 | 144.8° | 150.0° |
| C22 | C21 | H211 | H212 | 115.6° | 120.0° |
| C21 | C22 | C23 | H221 | 125.2° | 120.0° |
| C21 | C22 | C23 | H222 | 125.3° | 120.0° |
| C21 | C22 | H221 | H222 | 118.5° | 120.0° |
| C21 | C22 | C23 | O28 | 46.4° | 180.0° |
| C21 | C22 | C23 | O29 | 133.5° | 0.0° |
| H211 | C21 | C22 | C23 | 29.4° | 60.0° |
| H211 | C21 | C22 | H221 | 154.6° | 180.0° |
| H211 | C21 | C22 | H222 | 95.9° | 60.0° |
| H212 | C21 | C22 | C23 | 80.1° | 60.0° |
| H212 | C21 | C22 | H221 | 45.2° | 60.0° |
| H212 | C21 | C22 | H222 | 154.7° | 180.0° |
| C23 | C22 | H221 | H222 | 118.4° | 120.0° |
| C22 | C23 | O28 | O29 | 179.9° | 180.0° |
| C22 | C23 | O28 | H281 | 180.0° | 180.0° |
| H221 | C22 | C23 | O28 | 171.7° | 60.0° |
| H221 | C22 | C23 | O29 | 8.3° | 120.0° |
| H222 | C22 | C23 | O28 | 78.9° | 60.0° |
| H222 | C22 | C23 | O29 | 101.2° | 120.0° |
| O29 | C23 | O28 | H281 | 0.1° | 0.0° |
| O26 | C25 | O27 | H271 | 1.7° | 0.0° |
| C31 | C30 | H301 | H302 | 118.0° | 120.0° |
| C30 | C31 | C32 | H311 | 125.2° | 120.0° |
| C30 | C31 | C32 | H312 | 125.3° | 120.0° |
| C30 | C31 | H311 | H312 | 118.6° | 120.1° |
| C30 | C31 | C32 | O33 | 119.1° | 180.0° |
| C30 | C31 | C32 | O34 | 60.3° | 0.0° |
| H301 | C30 | C31 | C32 | 44.3° | 60.0° |
| H301 | C30 | C31 | H311 | 169.6° | 180.0° |
| H301 | C30 | C31 | H312 | 80.9° | 60.0° |
| H302 | C30 | C31 | C32 | 65.1° | 60.0° |
| H302 | C30 | C31 | H311 | 60.1° | 59.9° |
| H302 | C30 | C31 | H312 | 169.6° | 180.0° |
| C32 | C31 | H311 | H312 | 118.7° | 120.0° |
| C31 | C32 | O33 | O34 | 179.4° | 180.0° |
| C31 | C32 | O33 | H331 | 179.9° | 180.0° |
| H311 | C31 | C32 | O33 | 6.1° | 60.0° |
| H311 | C31 | C32 | O34 | 174.4° | 120.0° |
| H312 | C31 | C32 | O33 | 115.6° | 60.0° |
| H312 | C31 | C32 | O34 | 64.9° | 120.0° |
| O34 | C32 | O33 | H331 | 0.6° | 0.0° |
