RO4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C8 | doub | 1.21Å | 1.23Å | |
| O3 | C11 | doub | 1.21Å | 1.24Å | |
| O4 | C13 | doub | 1.21Å | 1.23Å | |
| O29 | C28 | doub | 1.21Å | 1.24Å | |
| O30 | C28 | sing | 1.34Å | 1.44Å | |
| O30 | C31 | sing | 1.45Å | 1.47Å | |
| O2 | N6 | sing | 1.42Å | 1.28Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| N6 | C8 | sing | 1.35Å | 1.33Å | |
| N6 | HN6 | sing | 0.97Å | 1.02Å | |
| N7 | C13 | sing | 1.35Å | 1.33Å | |
| N7 | C14 | sing | 1.46Å | 1.46Å | |
| N7 | HN7 | sing | 0.97Å | 1.02Å | |
| N5 | C11 | sing | 1.35Å | 1.33Å | |
| N5 | C12 | sing | 1.46Å | 1.46Å | |
| N5 | HN5 | sing | 0.97Å | 1.02Å | |
| C8 | C9 | sing | 1.51Å | 1.52Å | |
| C11 | C10 | sing | 1.51Å | 1.54Å | |
| C13 | C12 | sing | 1.51Å | 1.51Å | |
| C28 | C14 | sing | 1.51Å | 1.53Å | |
| C10 | C9 | sing | 1.53Å | 1.55Å | |
| C10 | C15 | sing | 1.53Å | 1.54Å | |
| C10 | H10 | sing | 1.09Å | 1.11Å | |
| C12 | C19 | sing | 1.53Å | 1.53Å | |
| C12 | H12 | sing | 1.09Å | 1.12Å | |
| C14 | C27 | sing | 1.53Å | 1.52Å | |
| C14 | H14 | sing | 1.09Å | 1.12Å | |
| C16 | C15 | sing | 1.53Å | 1.54Å | |
| C16 | C17 | sing | 1.53Å | 1.50Å | |
| C16 | C18 | sing | 1.53Å | 1.49Å | |
| C16 | H16 | sing | 1.09Å | 1.12Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C20 | C22 | sing | 1.53Å | 1.51Å | |
| C20 | H20 | sing | 1.09Å | 1.11Å | |
| C9 | H91 | sing | 1.09Å | 1.12Å | |
| C9 | H92 | sing | 1.09Å | 1.11Å | |
| C31 | C32 | sing | 1.53Å | 1.53Å | |
| C31 | H311 | sing | 1.09Å | 1.11Å | |
| C31 | H312 | sing | 1.09Å | 1.11Å | |
| C15 | H151 | sing | 1.09Å | 1.12Å | |
| C15 | H152 | sing | 1.09Å | 1.12Å | |
| C19 | H191 | sing | 1.09Å | 1.11Å | |
| C19 | H192 | sing | 1.09Å | 1.12Å | |
| C32 | H321 | sing | 1.09Å | 1.11Å | |
| C32 | H322 | sing | 1.09Å | 1.12Å | |
| C32 | H323 | sing | 1.09Å | 1.12Å | |
| C17 | H171 | sing | 1.09Å | 1.11Å | |
| C17 | H172 | sing | 1.09Å | 1.12Å | |
| C17 | H173 | sing | 1.09Å | 1.11Å | |
| C18 | H181 | sing | 1.09Å | 1.11Å | |
| C18 | H182 | sing | 1.09Å | 1.12Å | |
| C18 | H183 | sing | 1.09Å | 1.11Å | |
| C21 | H211 | sing | 1.09Å | 1.11Å | |
| C21 | H212 | sing | 1.09Å | 1.11Å | |
| C21 | H213 | sing | 1.09Å | 1.12Å | |
| C22 | H221 | sing | 1.09Å | 1.11Å | |
| C22 | H222 | sing | 1.09Å | 1.12Å | |
| C22 | H223 | sing | 1.09Å | 1.12Å | |
| C27 | H271 | sing | 1.09Å | 1.12Å | |
| C27 | H272 | sing | 1.09Å | 1.12Å | |
| C27 | H273 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C8 | N6 | 122.4° | 120.0° |
| O1 | C8 | C9 | 121.4° | 120.0° |
| O3 | C11 | N5 | 123.0° | 120.0° |
| O3 | C11 | C10 | 120.8° | 120.0° |
| O4 | C13 | N7 | 123.9° | 120.0° |
| O4 | C13 | C12 | 119.9° | 120.0° |
| O29 | C28 | O30 | 119.5° | 120.0° |
| O29 | C28 | C14 | 120.7° | 120.0° |
| C28 | O30 | C31 | 123.5° | 120.0° |
| O30 | C28 | C14 | 119.7° | 120.0° |
| O30 | C31 | C32 | 116.5° | 109.5° |
| O30 | C31 | H311 | 109.7° | 109.5° |
| O30 | C31 | H312 | 109.6° | 109.5° |
| N6 | O2 | HO2 | 120.0° | 106.8° |
| O2 | N6 | C8 | 120.1° | 120.0° |
| O2 | N6 | HN6 | 118.0° | 120.0° |
| C8 | N6 | HN6 | 121.9° | 120.0° |
| N6 | C8 | C9 | 116.3° | 120.0° |
| C13 | N7 | C14 | 123.1° | 120.1° |
| C13 | N7 | HN7 | 113.6° | 120.0° |
| N7 | C13 | C12 | 115.8° | 120.0° |
| C14 | N7 | HN7 | 123.4° | 120.0° |
| N7 | C14 | C28 | 113.3° | 109.5° |
| N7 | C14 | C27 | 109.8° | 109.4° |
| N7 | C14 | H14 | 106.7° | 109.5° |
| C11 | N5 | C12 | 122.6° | 120.0° |
| C11 | N5 | HN5 | 113.9° | 119.9° |
| N5 | C11 | C10 | 116.2° | 120.0° |
| C12 | N5 | HN5 | 123.6° | 120.0° |
| N5 | C12 | C13 | 111.9° | 109.4° |
| N5 | C12 | C19 | 110.9° | 109.4° |
| N5 | C12 | H12 | 106.2° | 109.5° |
| C8 | C9 | C10 | 112.4° | 109.5° |
| C8 | C9 | H91 | 111.1° | 109.4° |
| C8 | C9 | H92 | 111.1° | 109.5° |
| C11 | C10 | C9 | 104.6° | 109.5° |
| C11 | C10 | C15 | 111.0° | 109.4° |
| C11 | C10 | H10 | 111.3° | 109.5° |
| C13 | C12 | C19 | 107.6° | 109.5° |
| C13 | C12 | H12 | 109.6° | 109.5° |
| C28 | C14 | C27 | 109.6° | 109.5° |
| C28 | C14 | H14 | 106.9° | 109.5° |
| C9 | C10 | C15 | 108.5° | 109.4° |
| C9 | C10 | H10 | 113.8° | 109.5° |
| C10 | C9 | H91 | 111.1° | 109.4° |
| C10 | C9 | H92 | 111.1° | 109.5° |
| C15 | C10 | H10 | 107.7° | 109.5° |
| C10 | C15 | C16 | 121.7° | 109.5° |
| C10 | C15 | H151 | 107.9° | 109.5° |
| C10 | C15 | H152 | 107.9° | 109.5° |
| C19 | C12 | H12 | 110.7° | 109.5° |
| C12 | C19 | C20 | 120.4° | 109.5° |
| C12 | C19 | H191 | 108.3° | 109.5° |
| C12 | C19 | H192 | 108.3° | 109.4° |
| C27 | C14 | H14 | 110.5° | 109.4° |
| C14 | C27 | H271 | 109.8° | 109.5° |
| C14 | C27 | H272 | 112.1° | 109.5° |
| C14 | C27 | H273 | 112.1° | 109.5° |
| C15 | C16 | C17 | 113.0° | 109.5° |
| C15 | C16 | C18 | 110.7° | 109.5° |
| C15 | C16 | H16 | 106.4° | 109.4° |
| C16 | C15 | H151 | 107.9° | 109.4° |
| C16 | C15 | H152 | 107.9° | 109.4° |
| C17 | C16 | C18 | 110.3° | 109.5° |
| C17 | C16 | H16 | 106.9° | 109.5° |
| C16 | C17 | H171 | 113.0° | 109.5° |
| C16 | C17 | H172 | 110.9° | 109.5° |
| C16 | C17 | H173 | 110.9° | 109.5° |
| C18 | C16 | H16 | 109.3° | 109.5° |
| C16 | C18 | H181 | 110.7° | 109.5° |
| C16 | C18 | H182 | 111.8° | 109.4° |
| C16 | C18 | H183 | 111.8° | 109.5° |
| C19 | C20 | C21 | 107.6° | 109.5° |
| C19 | C20 | C22 | 110.5° | 109.5° |
| C19 | C20 | H20 | 110.2° | 109.4° |
| C20 | C19 | H191 | 108.3° | 109.5° |
| C20 | C19 | H192 | 108.3° | 109.4° |
| C21 | C20 | C22 | 110.1° | 109.5° |
| C21 | C20 | H20 | 110.6° | 109.5° |
| C20 | C21 | H211 | 107.6° | 109.5° |
| C20 | C21 | H212 | 112.9° | 109.5° |
| C20 | C21 | H213 | 112.9° | 109.4° |
| C22 | C20 | H20 | 107.7° | 109.4° |
| C20 | C22 | H221 | 110.5° | 109.4° |
| C20 | C22 | H222 | 111.8° | 109.5° |
| C20 | C22 | H223 | 111.8° | 109.5° |
| H91 | C9 | H92 | 99.3° | 109.5° |
| C32 | C31 | H311 | 109.7° | 109.5° |
| C32 | C31 | H312 | 109.7° | 109.5° |
| C31 | C32 | H321 | 116.5° | 109.5° |
| C31 | C32 | H322 | 109.7° | 109.5° |
| C31 | C32 | H323 | 109.6° | 109.5° |
| H311 | C31 | H312 | 100.6° | 109.5° |
| H151 | C15 | H152 | 102.0° | 109.5° |
| H191 | C19 | H192 | 101.7° | 109.4° |
| H321 | C32 | H322 | 109.7° | 109.5° |
| H321 | C32 | H323 | 109.7° | 109.5° |
| H322 | C32 | H323 | 100.5° | 109.5° |
| H171 | C17 | H172 | 110.9° | 109.4° |
| H171 | C17 | H173 | 110.9° | 109.4° |
| H172 | C17 | H173 | 99.5° | 109.5° |
| H181 | C18 | H182 | 111.7° | 109.5° |
| H181 | C18 | H183 | 111.8° | 109.5° |
| H182 | C18 | H183 | 98.6° | 109.5° |
| H211 | C21 | H212 | 112.9° | 109.5° |
| H211 | C21 | H213 | 112.9° | 109.4° |
| H212 | C21 | H213 | 97.5° | 109.4° |
| H221 | C22 | H222 | 111.8° | 109.5° |
| H221 | C22 | H223 | 111.8° | 109.4° |
| H222 | C22 | H223 | 98.5° | 109.6° |
| H271 | C27 | H272 | 112.0° | 109.4° |
| H271 | C27 | H273 | 112.1° | 109.5° |
| H272 | C27 | H273 | 98.3° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C8 | N6 | O2 | 6.5° | 0.1° |
| O1 | C8 | N6 | C9 | 178.7° | 179.9° |
| O1 | C8 | N6 | HN6 | 173.5° | 180.0° |
| O1 | C8 | C9 | C10 | 76.8° | 0.1° |
| O1 | C8 | C9 | H91 | 157.9° | 120.1° |
| O1 | C8 | C9 | H92 | 48.4° | 119.9° |
| O3 | C11 | N5 | C10 | 179.3° | 179.9° |
| O3 | C11 | N5 | C12 | 5.3° | 0.8° |
| O3 | C11 | N5 | HN5 | 174.7° | 179.2° |
| O3 | C11 | C10 | C9 | 67.2° | 13.4° |
| O3 | C11 | C10 | C15 | 49.6° | 106.5° |
| O3 | C11 | C10 | H10 | 169.5° | 133.5° |
| O4 | C13 | N7 | C12 | 173.6° | 180.0° |
| O4 | C13 | N7 | C14 | 4.6° | 0.1° |
| O4 | C13 | N7 | HN7 | 175.3° | 180.0° |
| O4 | C13 | C12 | N5 | 40.6° | 26.1° |
| O4 | C13 | C12 | C19 | 81.5° | 93.9° |
| O4 | C13 | C12 | H12 | 158.1° | 146.1° |
| O29 | C28 | O30 | C14 | 176.9° | 180.0° |
| O29 | C28 | O30 | C31 | 46.8° | 0.0° |
| O29 | C28 | C14 | N7 | 137.6° | 0.0° |
| O29 | C28 | C14 | C27 | 99.4° | 120.0° |
| O29 | C28 | C14 | H14 | 20.4° | 120.0° |
| O30 | C28 | C14 | N7 | 45.5° | 180.0° |
| O30 | C28 | C14 | C27 | 77.5° | 60.0° |
| O30 | C28 | C14 | H14 | 162.7° | 60.0° |
| C28 | O30 | C31 | C32 | 45.2° | 180.0° |
| C28 | O30 | C31 | H311 | 170.4° | 60.0° |
| C28 | O30 | C31 | H312 | 80.1° | 60.0° |
| C31 | O30 | C28 | C14 | 136.3° | 180.0° |
| O30 | C31 | C32 | H311 | 125.2° | 120.0° |
| O30 | C31 | C32 | H312 | 125.2° | 120.0° |
| O30 | C31 | H311 | H312 | 115.4° | 120.0° |
| O30 | C31 | C32 | H321 | 180.0° | 179.9° |
| O30 | C31 | C32 | H322 | 54.7° | 60.0° |
| O30 | C31 | C32 | H323 | 54.7° | 60.0° |
| O2 | N6 | C8 | HN6 | 180.0° | 179.9° |
| O2 | N6 | C8 | C9 | 174.8° | 180.0° |
| HO2 | O2 | N6 | C8 | 180.0° | 180.0° |
| HO2 | O2 | N6 | HN6 | 0.0° | 0.1° |
| N6 | C8 | C9 | C10 | 104.4° | 180.0° |
| N6 | C8 | C9 | H91 | 20.8° | 60.1° |
| N6 | C8 | C9 | H92 | 130.3° | 59.9° |
| HN6 | N6 | C8 | C9 | 5.2° | 0.1° |
| C13 | N7 | C14 | HN7 | 180.0° | 179.9° |
| N7 | C13 | C12 | N5 | 145.6° | 153.9° |
| C13 | N7 | C14 | C28 | 56.4° | 150.0° |
| N7 | C13 | C12 | C19 | 92.4° | 86.1° |
| N7 | C13 | C12 | H12 | 28.0° | 33.9° |
| C13 | N7 | C14 | C27 | 179.3° | 90.0° |
| C13 | N7 | C14 | H14 | 60.9° | 29.9° |
| C14 | N7 | C13 | C12 | 169.0° | 180.0° |
| N7 | C14 | C28 | C27 | 123.1° | 120.0° |
| N7 | C14 | C28 | H14 | 117.2° | 120.1° |
| N7 | C14 | C27 | H14 | 117.4° | 120.0° |
| N7 | C14 | C27 | H271 | 180.0° | 60.0° |
| N7 | C14 | C27 | H272 | 54.7° | 180.0° |
| N7 | C14 | C27 | H273 | 54.7° | 60.0° |
| HN7 | N7 | C13 | C12 | 11.0° | 0.1° |
| HN7 | N7 | C14 | C28 | 123.6° | 29.9° |
| HN7 | N7 | C14 | C27 | 0.7° | 90.1° |
| HN7 | N7 | C14 | H14 | 119.1° | 150.0° |
| C11 | N5 | C12 | HN5 | 180.0° | 180.0° |
| C11 | N5 | C12 | C13 | 78.0° | 124.9° |
| N5 | C11 | C10 | C9 | 112.1° | 166.5° |
| N5 | C11 | C10 | C15 | 131.1° | 73.6° |
| N5 | C11 | C10 | H10 | 11.2° | 46.4° |
| C11 | N5 | C12 | C19 | 161.9° | 115.1° |
| C11 | N5 | C12 | H12 | 41.5° | 4.9° |
| C12 | N5 | C11 | C10 | 175.4° | 179.1° |
| N5 | C12 | C13 | C19 | 122.1° | 120.0° |
| N5 | C12 | C13 | H12 | 117.5° | 120.0° |
| N5 | C12 | C19 | H12 | 117.6° | 120.0° |
| N5 | C12 | C19 | C20 | 81.7° | 63.3° |
| N5 | C12 | C19 | H191 | 43.6° | 56.8° |
| N5 | C12 | C19 | H192 | 153.0° | 176.7° |
| HN5 | N5 | C11 | C10 | 4.6° | 0.9° |
| HN5 | N5 | C12 | C13 | 102.0° | 55.1° |
| HN5 | N5 | C12 | C19 | 18.1° | 64.9° |
| HN5 | N5 | C12 | H12 | 138.5° | 175.1° |
| C8 | C9 | C10 | C11 | 174.8° | NaN° |
| C8 | C9 | C10 | H91 | 125.2° | 119.9° |
| C8 | C9 | C10 | H92 | 125.3° | 120.1° |
| C8 | C9 | C10 | C15 | 66.6° | 60.1° |
| C8 | C9 | C10 | H10 | 53.1° | 59.9° |
| C8 | C9 | H91 | H92 | 117.0° | 120.0° |
| C11 | C10 | C9 | C15 | 118.5° | 119.9° |
| C11 | C10 | C9 | H10 | 121.7° | 120.1° |
| C11 | C10 | C15 | H10 | 122.0° | 120.1° |
| C11 | C10 | C15 | C16 | 95.4° | 116.5° |
| C11 | C10 | C9 | H91 | 59.9° | 60.1° |
| C11 | C10 | C9 | H92 | 49.6° | 59.9° |
| C11 | C10 | C15 | H151 | 139.3° | 123.5° |
| C11 | C10 | C15 | H152 | 29.9° | 3.5° |
| C13 | C12 | C19 | H12 | 119.7° | 120.1° |
| C13 | C12 | C19 | C20 | 155.6° | 176.7° |
| C13 | C12 | C19 | H191 | 79.1° | 63.2° |
| C13 | C12 | C19 | H192 | 30.3° | 56.7° |
| C28 | C14 | C27 | H14 | 117.5° | 120.0° |
| C28 | C14 | C27 | H271 | 55.0° | 60.0° |
| C28 | C14 | C27 | H272 | 179.8° | 60.0° |
| C28 | C14 | C27 | H273 | 70.3° | 180.0° |
| C9 | C10 | C15 | H10 | 123.5° | 120.0° |
| C9 | C10 | C15 | C16 | 150.2° | 123.6° |
| C10 | C9 | H91 | H92 | 117.0° | 120.0° |
| C9 | C10 | C15 | H151 | 24.9° | 3.6° |
| C9 | C10 | C15 | H152 | 84.5° | 116.5° |
| C10 | C15 | C16 | H151 | 125.3° | 120.0° |
| C10 | C15 | C16 | H152 | 125.3° | 120.0° |
| C10 | C15 | C16 | C17 | 7.2° | 177.6° |
| C10 | C15 | C16 | C18 | 117.2° | 62.3° |
| C10 | C15 | C16 | H16 | 124.1° | 57.6° |
| C15 | C10 | C9 | H91 | 58.6° | 180.0° |
| C15 | C10 | C9 | H92 | 168.1° | 60.0° |
| C10 | C15 | H151 | H152 | 113.4° | 120.1° |
| H10 | C10 | C15 | C16 | 26.7° | 3.6° |
| H10 | C10 | C9 | H91 | 178.4° | 60.0° |
| H10 | C10 | C9 | H92 | 72.1° | 180.0° |
| H10 | C10 | C15 | H151 | 98.6° | 116.4° |
| H10 | C10 | C15 | H152 | 151.9° | 123.6° |
| C12 | C19 | C20 | H191 | 125.2° | 120.1° |
| C12 | C19 | C20 | H192 | 125.2° | 120.0° |
| C12 | C19 | C20 | C21 | 173.0° | 175.1° |
| C12 | C19 | C20 | C22 | 52.7° | 64.8° |
| C12 | C19 | C20 | H20 | 66.3° | 55.0° |
| C12 | C19 | H191 | H192 | 113.9° | 120.0° |
| H12 | C12 | C19 | C20 | 35.9° | 56.6° |
| H12 | C12 | C19 | H191 | 161.2° | 176.7° |
| H12 | C12 | C19 | H192 | 89.4° | 63.3° |
| C14 | C27 | H271 | H272 | 125.3° | 120.0° |
| C14 | C27 | H271 | H273 | 125.3° | 120.0° |
| C14 | C27 | H272 | H273 | 118.0° | 120.1° |
| H14 | C14 | C27 | H271 | 62.6° | 180.0° |
| H14 | C14 | C27 | H272 | 62.7° | 60.0° |
| H14 | C14 | C27 | H273 | 172.1° | 60.0° |
| C15 | C16 | C17 | C18 | 124.5° | 120.0° |
| C15 | C16 | C17 | H16 | 116.7° | 120.0° |
| C15 | C16 | C18 | H16 | 116.9° | 119.9° |
| C16 | C15 | H151 | H152 | 113.4° | 119.9° |
| C15 | C16 | C17 | H171 | 180.0° | 180.0° |
| C15 | C16 | C17 | H172 | 54.8° | 60.0° |
| C15 | C16 | C17 | H173 | 54.8° | 60.0° |
| C15 | C16 | C18 | H181 | 180.0° | 56.2° |
| C15 | C16 | C18 | H182 | 54.7° | 63.8° |
| C15 | C16 | C18 | H183 | 54.7° | 176.2° |
| C17 | C16 | C18 | H16 | 117.2° | 120.0° |
| C17 | C16 | C15 | H151 | 118.2° | 57.6° |
| C17 | C16 | C15 | H152 | 132.4° | 62.4° |
| C16 | C17 | H171 | H172 | 125.2° | 120.0° |
| C16 | C17 | H171 | H173 | 125.2° | 120.0° |
| C16 | C17 | H172 | H173 | 116.8° | 120.1° |
| C17 | C16 | C18 | H181 | 54.2° | 63.9° |
| C17 | C16 | C18 | H182 | 179.4° | 176.2° |
| C17 | C16 | C18 | H183 | 71.2° | 56.2° |
| C18 | C16 | C15 | H151 | 117.5° | 177.6° |
| C18 | C16 | C15 | H152 | 8.1° | 57.7° |
| C18 | C16 | C17 | H171 | 55.5° | 60.0° |
| C18 | C16 | C17 | H172 | 69.8° | 180.0° |
| C18 | C16 | C17 | H173 | 179.3° | 60.0° |
| C16 | C18 | H181 | H182 | 125.3° | 120.0° |
| C16 | C18 | H181 | H183 | 125.4° | 120.0° |
| C16 | C18 | H182 | H183 | 117.7° | 120.0° |
| H16 | C16 | C15 | H151 | 1.2° | 62.4° |
| H16 | C16 | C15 | H152 | 110.6° | 177.6° |
| H16 | C16 | C17 | H171 | 63.3° | 60.0° |
| H16 | C16 | C17 | H172 | 171.5° | 60.0° |
| H16 | C16 | C17 | H173 | 61.9° | 180.0° |
| H16 | C16 | C18 | H181 | 63.1° | 176.1° |
| H16 | C16 | C18 | H182 | 62.2° | 56.1° |
| H16 | C16 | C18 | H183 | 171.6° | 63.8° |
| C19 | C20 | C21 | C22 | 120.6° | 120.1° |
| C19 | C20 | C21 | H20 | 120.4° | 120.0° |
| C19 | C20 | C22 | H20 | 120.5° | 119.9° |
| C20 | C19 | H191 | H192 | 114.0° | 119.9° |
| C19 | C20 | C21 | H211 | 180.0° | 180.0° |
| C19 | C20 | C21 | H212 | 54.7° | 59.9° |
| C19 | C20 | C21 | H213 | 54.7° | 60.1° |
| C19 | C20 | C22 | H221 | 180.0° | 55.2° |
| C19 | C20 | C22 | H222 | 54.7° | 64.7° |
| C19 | C20 | C22 | H223 | 54.7° | 175.1° |
| C21 | C20 | C22 | H20 | 120.7° | 120.0° |
| C21 | C20 | C19 | H191 | 61.8° | 54.9° |
| C21 | C20 | C19 | H192 | 47.7° | 65.0° |
| C20 | C21 | H211 | H212 | 125.3° | 120.1° |
| C20 | C21 | H211 | H213 | 125.2° | 120.0° |
| C20 | C21 | H212 | H213 | 118.8° | 120.0° |
| C21 | C20 | C22 | H221 | 61.2° | 64.9° |
| C21 | C20 | C22 | H222 | 64.1° | 175.1° |
| C21 | C20 | C22 | H223 | 173.5° | 55.0° |
| C22 | C20 | C19 | H191 | 177.9° | 175.1° |
| C22 | C20 | C19 | H192 | 72.6° | 55.1° |
| C22 | C20 | C21 | H211 | 59.4° | 59.9° |
| C22 | C20 | C21 | H212 | 175.3° | 180.0° |
| C22 | C20 | C21 | H213 | 65.8° | 60.0° |
| C20 | C22 | H221 | H222 | 125.3° | 120.0° |
| C20 | C22 | H221 | H223 | 125.3° | 119.9° |
| C20 | C22 | H222 | H223 | 117.7° | 120.1° |
| H20 | C20 | C19 | H191 | 58.9° | 65.1° |
| H20 | C20 | C19 | H192 | 168.4° | 175.0° |
| H20 | C20 | C21 | H211 | 59.6° | 60.0° |
| H20 | C20 | C21 | H212 | 65.7° | 60.1° |
| H20 | C20 | C21 | H213 | 175.2° | 180.0° |
| H20 | C20 | C22 | H221 | 59.5° | 175.1° |
| H20 | C20 | C22 | H222 | 175.1° | 55.2° |
| H20 | C20 | C22 | H223 | 65.8° | 65.0° |
| C32 | C31 | H311 | H312 | 115.5° | 120.0° |
| C31 | C32 | H321 | H322 | 125.3° | 120.0° |
| C31 | C32 | H321 | H323 | 125.3° | 120.0° |
| C31 | C32 | H322 | H323 | 115.4° | 120.0° |
| H311 | C31 | C32 | H321 | 54.8° | 60.0° |
| H311 | C31 | C32 | H322 | 179.9° | 60.0° |
| H311 | C31 | C32 | H323 | 70.5° | 180.0° |
| H312 | C31 | C32 | H321 | 54.8° | 60.0° |
| H312 | C31 | C32 | H322 | 70.5° | NaN° |
| H312 | C31 | C32 | H323 | 179.9° | 60.0° |
| H321 | C32 | H322 | H323 | 115.4° | 120.0° |
| H171 | C17 | H172 | H173 | 116.8° | 119.9° |
| H181 | C18 | H182 | H183 | 117.6° | 120.0° |
| H211 | C21 | H212 | H213 | 118.9° | 119.9° |
| H221 | C22 | H222 | H223 | 117.7° | 120.0° |
| H271 | C27 | H272 | H273 | 118.0° | 120.0° |
