7X1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O2 | sing | 1.44Å | 1.44Å | |
| O2 | C3 | sing | 1.37Å | 1.37Å | |
| C3 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C3 | C23 | doub | 1.41Å | 1.41Å | Aromatic |
| C4 | C5 | doub | 1.41Å | 1.41Å | Aromatic |
| C5 | C6 | sing | 1.42Å | 1.42Å | Aromatic |
| C5 | C21 | sing | 1.42Å | 1.42Å | Aromatic |
| C6 | N7 | sing | 1.40Å | 1.40Å | |
| C6 | N18 | doub | 1.35Å | 1.35Å | Aromatic |
| N7 | C8 | sing | 1.41Å | 1.41Å | |
| C8 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| C8 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C9 | O10 | sing | 1.36Å | 1.36Å | |
| C9 | C13 | doub | 1.40Å | 1.40Å | Aromatic |
| O10 | C11 | sing | 1.44Å | 1.44Å | |
| C11 | O12 | sing | 1.43Å | 1.43Å | |
| O12 | C13 | sing | 1.34Å | 1.34Å | |
| C13 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.40Å | 1.40Å | Aromatic |
| C16 | CL1 | sing | 1.73Å | 1.73Å | |
| N18 | C19 | sing | 1.33Å | 1.33Å | Aromatic |
| C19 | N20 | doub | 1.32Å | 1.32Å | Aromatic |
| N20 | C21 | sing | 1.36Å | 1.36Å | Aromatic |
| C21 | C22 | doub | 1.41Å | 1.41Å | Aromatic |
| C22 | C23 | sing | 1.37Å | 1.37Å | Aromatic |
| C23 | O24 | sing | 1.36Å | 1.36Å | |
| O24 | C25 | sing | 1.42Å | 1.42Å | |
| C25 | C26 | sing | 1.54Å | 1.54Å | |
| C26 | C27 | sing | 1.53Å | 1.53Å | |
| C27 | N28 | sing | 1.48Å | 1.48Å | |
| N28 | C29 | sing | 1.48Å | 1.48Å | |
| N28 | C33 | sing | 1.47Å | 1.47Å | |
| C29 | C30 | sing | 1.54Å | 1.54Å | |
| C30 | C31 | sing | 1.54Å | 1.54Å | |
| C31 | C32 | sing | 1.54Å | 1.54Å | |
| C32 | C33 | sing | 1.54Å | 1.54Å | |
| C1 | H1C1 | sing | 1.10Å | 1.10Å | |
| C1 | H1C2 | sing | 1.10Å | 1.10Å | |
| C1 | H1C3 | sing | 1.10Å | 1.10Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| N7 | H7 | sing | 1.00Å | 1.00Å | |
| C11 | H111 | sing | 1.10Å | 1.10Å | |
| C11 | H112 | sing | 1.10Å | 1.10Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.10Å | 1.10Å | |
| C25 | H252 | sing | 1.10Å | 1.10Å | |
| C26 | H261 | sing | 1.10Å | 1.10Å | |
| C26 | H262 | sing | 1.10Å | 1.10Å | |
| C27 | H271 | sing | 1.10Å | 1.10Å | |
| C27 | H272 | sing | 1.10Å | 1.10Å | |
| C29 | H291 | sing | 1.10Å | 1.10Å | |
| C29 | H292 | sing | 1.10Å | 1.10Å | |
| C33 | H331 | sing | 1.10Å | 1.10Å | |
| C33 | H332 | sing | 1.10Å | 1.10Å | |
| C30 | H301 | sing | 1.10Å | 1.10Å | |
| C30 | H302 | sing | 1.10Å | 1.10Å | |
| C31 | H311 | sing | 1.10Å | 1.10Å | |
| C31 | H312 | sing | 1.10Å | 1.10Å | |
| C32 | H321 | sing | 1.10Å | 1.10Å | |
| C32 | H322 | sing | 1.10Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | O2 | C3 | 112.8° | 112.8° |
| O2 | C1 | H1C1 | 109.5° | 109.5° |
| O2 | C1 | H1C2 | 109.5° | 109.5° |
| O2 | C1 | H1C3 | 109.4° | 109.4° |
| O2 | C3 | C4 | 124.7° | 124.7° |
| O2 | C3 | C23 | 115.1° | 115.1° |
| C4 | C3 | C23 | 120.2° | 120.2° |
| C3 | C4 | C5 | 119.9° | 119.9° |
| C3 | C4 | H4 | 120.0° | 120.0° |
| C3 | C23 | C22 | 120.8° | 120.8° |
| C3 | C23 | O24 | 115.5° | 115.5° |
| C4 | C5 | C6 | 123.4° | 123.4° |
| C4 | C5 | C21 | 119.5° | 119.5° |
| C5 | C4 | H4 | 120.0° | 120.0° |
| C6 | C5 | C21 | 117.1° | 117.1° |
| C5 | C6 | N7 | 119.3° | 119.3° |
| C5 | C6 | N18 | 118.8° | 118.8° |
| C5 | C21 | N20 | 119.1° | 119.1° |
| C5 | C21 | C22 | 119.2° | 119.2° |
| N7 | C6 | N18 | 121.9° | 121.9° |
| C6 | N7 | C8 | 123.7° | 123.7° |
| C6 | N7 | H7 | 118.2° | 118.2° |
| C6 | N18 | C19 | 122.1° | 122.1° |
| N7 | C8 | C9 | 119.4° | 119.4° |
| N7 | C8 | C16 | 122.2° | 122.2° |
| C8 | N7 | H7 | 118.2° | 118.2° |
| C9 | C8 | C16 | 118.4° | 118.4° |
| C8 | C9 | O10 | 129.2° | 129.2° |
| C8 | C9 | C13 | 119.8° | 119.8° |
| C8 | C16 | C15 | 122.1° | 122.1° |
| C8 | C16 | CL1 | 118.3° | 118.3° |
| O10 | C9 | C13 | 111.0° | 111.0° |
| C9 | O10 | C11 | 104.6° | 104.6° |
| C9 | C13 | O12 | 108.1° | 108.1° |
| C9 | C13 | C14 | 122.0° | 122.0° |
| O10 | C11 | O12 | 106.7° | 106.7° |
| O10 | C11 | H111 | 110.4° | 110.4° |
| O10 | C11 | H112 | 111.0° | 111.0° |
| C11 | O12 | C13 | 107.3° | 107.3° |
| O12 | C11 | H111 | 110.4° | 110.4° |
| O12 | C11 | H112 | 111.0° | 111.0° |
| O12 | C13 | C14 | 129.9° | 129.9° |
| C13 | C14 | C15 | 118.1° | 118.1° |
| C13 | C14 | H14 | 120.9° | 120.9° |
| C14 | C15 | C16 | 119.5° | 119.5° |
| C15 | C14 | H14 | 120.9° | 120.9° |
| C14 | C15 | H15 | 120.2° | 120.2° |
| C15 | C16 | CL1 | 119.6° | 119.6° |
| C16 | C15 | H15 | 120.2° | 120.2° |
| N18 | C19 | N20 | 121.3° | 121.3° |
| N18 | C19 | H19 | 119.3° | 119.3° |
| C19 | N20 | C21 | 121.5° | 121.5° |
| N20 | C19 | H19 | 119.4° | 119.4° |
| N20 | C21 | C22 | 121.6° | 121.6° |
| C21 | C22 | C23 | 120.3° | 120.3° |
| C21 | C22 | H22 | 119.8° | 119.8° |
| C22 | C23 | O24 | 123.7° | 123.7° |
| C23 | C22 | H22 | 119.9° | 119.9° |
| C23 | O24 | C25 | 115.9° | 115.9° |
| O24 | C25 | C26 | 105.4° | 105.4° |
| O24 | C25 | H251 | 110.8° | 110.8° |
| O24 | C25 | H252 | 111.7° | 111.7° |
| C25 | C26 | C27 | 109.4° | 109.4° |
| C26 | C25 | H251 | 110.8° | 110.8° |
| C26 | C25 | H252 | 111.7° | 111.7° |
| C25 | C26 | H261 | 109.5° | 109.5° |
| C25 | C26 | H262 | 109.5° | 109.5° |
| C26 | C27 | N28 | 113.3° | 113.3° |
| C27 | C26 | H261 | 109.5° | 109.5° |
| C27 | C26 | H262 | 109.5° | 109.5° |
| C26 | C27 | H271 | 108.2° | 108.2° |
| C26 | C27 | H272 | 107.3° | 107.3° |
| C27 | N28 | C29 | 111.6° | 111.6° |
| C27 | N28 | C33 | 107.0° | 107.0° |
| N28 | C27 | H271 | 108.2° | 108.2° |
| N28 | C27 | H272 | 107.3° | 107.3° |
| C29 | N28 | C33 | 107.8° | 107.8° |
| N28 | C29 | C30 | 109.8° | 109.8° |
| N28 | C29 | H291 | 109.4° | 109.4° |
| N28 | C29 | H292 | 109.3° | 109.3° |
| N28 | C33 | C32 | 108.3° | 108.3° |
| N28 | C33 | H331 | 109.8° | 109.8° |
| N28 | C33 | H332 | 110.1° | 110.1° |
| C29 | C30 | C31 | 109.9° | 109.9° |
| C30 | C29 | H291 | 109.3° | 109.4° |
| C30 | C29 | H292 | 109.3° | 109.3° |
| C29 | C30 | H301 | 109.3° | 109.3° |
| C29 | C30 | H302 | 109.2° | 109.2° |
| C30 | C31 | C32 | 111.9° | 111.9° |
| C31 | C30 | H301 | 109.3° | 109.3° |
| C31 | C30 | H302 | 109.2° | 109.2° |
| C30 | C31 | H311 | 108.7° | 108.7° |
| C30 | C31 | H312 | 108.1° | 108.1° |
| C31 | C32 | C33 | 110.2° | 110.2° |
| C32 | C31 | H311 | 108.7° | 108.7° |
| C32 | C31 | H312 | 108.1° | 108.1° |
| C31 | C32 | H321 | 109.3° | 109.3° |
| C31 | C32 | H322 | 109.1° | 109.1° |
| C32 | C33 | H331 | 109.9° | 109.9° |
| C32 | C33 | H332 | 110.1° | 110.1° |
| C33 | C32 | H321 | 109.2° | 109.2° |
| C33 | C32 | H322 | 109.1° | 109.1° |
| H1C1 | C1 | H1C2 | 109.5° | 109.4° |
| H1C1 | C1 | H1C3 | 109.5° | 109.4° |
| H1C2 | C1 | H1C3 | 109.5° | 109.5° |
| H111 | C11 | H112 | 107.4° | 107.4° |
| H251 | C25 | H252 | 106.4° | 106.4° |
| H261 | C26 | H262 | 109.5° | 109.5° |
| H271 | C27 | H272 | 112.5° | 112.5° |
| H291 | C29 | H292 | 109.7° | 109.7° |
| H331 | C33 | H332 | 108.6° | 108.6° |
| H301 | C30 | H302 | 109.8° | 109.8° |
| H311 | C31 | H312 | 111.4° | 111.4° |
| H321 | C32 | H322 | 110.0° | 110.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | O2 | C3 | C4 | 4.3° | 4.3° |
| C1 | O2 | C3 | C23 | 177.7° | 177.7° |
| O2 | C1 | H1C1 | H1C2 | 120.0° | 120.0° |
| O2 | C1 | H1C1 | H1C3 | 120.0° | 120.0° |
| O2 | C1 | H1C2 | H1C3 | 120.0° | 120.0° |
| O2 | C3 | C4 | C23 | 177.9° | 177.9° |
| O2 | C3 | C4 | C5 | 179.2° | 179.2° |
| O2 | C3 | C23 | C22 | 179.9° | 179.9° |
| O2 | C3 | C23 | O24 | 0.2° | 0.2° |
| C3 | O2 | C1 | H1C1 | 72.1° | 72.1° |
| C3 | O2 | C1 | H1C2 | 167.9° | 167.9° |
| C3 | O2 | C1 | H1C3 | 47.8° | 47.8° |
| O2 | C3 | C4 | H4 | 0.8° | 0.8° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 178.7° | 178.7° |
| C3 | C4 | C5 | C21 | 2.6° | 2.6° |
| C4 | C3 | C23 | C22 | 2.1° | 2.1° |
| C4 | C3 | C23 | O24 | 178.3° | 178.3° |
| C23 | C3 | C4 | C5 | 3.0° | 3.0° |
| C3 | C23 | C22 | C21 | 0.8° | 0.8° |
| C3 | C23 | C22 | O24 | 179.6° | 179.6° |
| C3 | C23 | O24 | C25 | 172.1° | 172.1° |
| C23 | C3 | C4 | H4 | 177.0° | 177.0° |
| C3 | C23 | C22 | H22 | 179.2° | 179.2° |
| C4 | C5 | C6 | C21 | 178.7° | 178.7° |
| C4 | C5 | C6 | N7 | 0.9° | 0.9° |
| C4 | C5 | C6 | N18 | 179.9° | 179.9° |
| C4 | C5 | C21 | N20 | 179.7° | 179.7° |
| C4 | C5 | C21 | C22 | 1.4° | 1.4° |
| C5 | C6 | N7 | N18 | 179.2° | 179.2° |
| C5 | C6 | N7 | C8 | 171.8° | 171.8° |
| C5 | C6 | N18 | C19 | 1.1° | 1.1° |
| C6 | C5 | C21 | N20 | 1.0° | 1.0° |
| C6 | C5 | C21 | C22 | 179.9° | 179.9° |
| C6 | C5 | C4 | H4 | 1.3° | 1.3° |
| C5 | C6 | N7 | H7 | 8.2° | 8.2° |
| C21 | C5 | C6 | N7 | 177.9° | 177.9° |
| C21 | C5 | C6 | N18 | 1.4° | 1.4° |
| C5 | C21 | N20 | C19 | 0.3° | 0.3° |
| C5 | C21 | N20 | C22 | 178.9° | 178.9° |
| C5 | C21 | C22 | C23 | 0.5° | 0.5° |
| C21 | C5 | C4 | H4 | 177.4° | 177.4° |
| C5 | C21 | C22 | H22 | 179.5° | 179.5° |
| C6 | N7 | C8 | H7 | 180.0° | 180.0° |
| C6 | N7 | C8 | C9 | 66.5° | 66.5° |
| C6 | N7 | C8 | C16 | 114.7° | 114.7° |
| N7 | C6 | N18 | C19 | 178.1° | 178.1° |
| N18 | C6 | N7 | C8 | 8.9° | 8.9° |
| C6 | N18 | C19 | N20 | 0.4° | 0.4° |
| N18 | C6 | N7 | H7 | 171.0° | 171.0° |
| C6 | N18 | C19 | H19 | 179.6° | 179.6° |
| N7 | C8 | C9 | C16 | 178.8° | 178.8° |
| N7 | C8 | C9 | O10 | 1.1° | 1.1° |
| N7 | C8 | C9 | C13 | 178.4° | 178.4° |
| N7 | C8 | C16 | C15 | 179.8° | 179.8° |
| N7 | C8 | C16 | CL1 | 2.6° | 2.6° |
| C8 | C9 | O10 | C13 | 179.5° | 179.5° |
| C8 | C9 | O10 | C11 | 171.0° | 171.0° |
| C8 | C9 | C13 | O12 | 179.8° | 179.8° |
| C8 | C9 | C13 | C14 | 0.9° | 0.9° |
| C9 | C8 | C16 | C15 | 1.0° | 1.0° |
| C9 | C8 | C16 | CL1 | 178.6° | 178.6° |
| C9 | C8 | N7 | H7 | 113.5° | 113.5° |
| C16 | C8 | C9 | O10 | 180.0° | 180.0° |
| C16 | C8 | C9 | C13 | 0.5° | 0.5° |
| C8 | C16 | C15 | C14 | 2.0° | 2.0° |
| C8 | C16 | C15 | CL1 | 177.6° | 177.6° |
| C16 | C8 | N7 | H7 | 65.3° | 65.3° |
| C8 | C16 | C15 | H15 | 178.0° | 178.0° |
| C9 | O10 | C11 | O12 | 14.7° | 14.7° |
| O10 | C9 | C13 | O12 | 0.2° | 0.2° |
| O10 | C9 | C13 | C14 | 179.5° | 179.5° |
| C9 | O10 | C11 | H111 | 105.2° | 105.2° |
| C9 | O10 | C11 | H112 | 135.8° | 135.8° |
| C13 | C9 | O10 | C11 | 9.5° | 9.5° |
| C9 | C13 | O12 | C11 | 9.3° | 9.3° |
| C9 | C13 | O12 | C14 | 179.2° | 179.2° |
| C9 | C13 | C14 | C15 | 0.1° | 0.1° |
| C9 | C13 | C14 | H14 | 179.9° | 179.9° |
| O10 | C11 | O12 | H111 | 120.0° | 120.0° |
| O10 | C11 | O12 | H112 | 121.1° | 121.1° |
| O10 | C11 | O12 | C13 | 15.1° | 15.1° |
| O10 | C11 | H111 | H112 | 121.1° | 121.1° |
| C11 | O12 | C13 | C14 | 169.9° | 169.9° |
| O12 | C11 | H111 | H112 | 121.1° | 121.2° |
| O12 | C13 | C14 | C15 | 179.0° | 179.0° |
| C13 | O12 | C11 | H111 | 104.9° | 104.9° |
| C13 | O12 | C11 | H112 | 136.2° | 136.1° |
| O12 | C13 | C14 | H14 | 1.0° | 1.0° |
| C13 | C14 | C15 | H14 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 1.5° | 1.5° |
| C13 | C14 | C15 | H15 | 178.4° | 178.5° |
| C14 | C15 | C16 | H15 | 180.0° | 180.0° |
| C14 | C15 | C16 | CL1 | 179.6° | 179.6° |
| C16 | C15 | C14 | H14 | 178.5° | 178.5° |
| CL1 | C16 | C15 | H15 | 0.4° | 0.5° |
| N18 | C19 | N20 | H19 | 180.0° | 180.0° |
| N18 | C19 | N20 | C21 | 0.1° | 0.1° |
| C19 | N20 | C21 | C22 | 179.1° | 179.1° |
| N20 | C21 | C22 | C23 | 179.3° | 179.3° |
| C21 | N20 | C19 | H19 | 179.9° | 179.9° |
| N20 | C21 | C22 | H22 | 0.7° | 0.7° |
| C21 | C22 | C23 | H22 | 180.0° | 180.0° |
| C21 | C22 | C23 | O24 | 179.6° | 179.6° |
| C22 | C23 | O24 | C25 | 7.6° | 7.6° |
| C23 | O24 | C25 | C26 | 165.0° | 165.0° |
| O24 | C23 | C22 | H22 | 0.4° | 0.4° |
| C23 | O24 | C25 | H251 | 45.0° | 45.0° |
| C23 | O24 | C25 | H252 | 73.5° | 73.5° |
| O24 | C25 | C26 | H251 | 120.0° | 120.0° |
| O24 | C25 | C26 | H252 | 121.5° | 121.5° |
| O24 | C25 | C26 | C27 | 83.8° | 83.8° |
| O24 | C25 | H251 | H252 | 121.7° | 121.6° |
| O24 | C25 | C26 | H261 | 36.2° | 36.2° |
| O24 | C25 | C26 | H262 | 156.2° | 156.2° |
| C25 | C26 | C27 | H261 | 120.0° | 120.0° |
| C25 | C26 | C27 | H262 | 120.0° | 120.0° |
| C25 | C26 | C27 | N28 | 177.3° | 177.3° |
| C26 | C25 | H251 | H252 | 121.6° | 121.6° |
| C25 | C26 | H261 | H262 | 120.0° | 120.0° |
| C25 | C26 | C27 | H271 | 62.7° | 62.7° |
| C25 | C26 | C27 | H272 | 59.0° | 59.0° |
| C26 | C27 | N28 | H271 | 120.0° | 120.0° |
| C26 | C27 | N28 | H272 | 118.3° | 118.3° |
| C26 | C27 | N28 | C29 | 83.6° | 83.6° |
| C26 | C27 | N28 | C33 | 158.6° | 158.6° |
| C27 | C26 | C25 | H251 | 156.2° | 156.2° |
| C27 | C26 | C25 | H252 | 37.7° | 37.7° |
| C27 | C26 | H261 | H262 | 120.0° | 120.0° |
| C26 | C27 | H271 | H272 | 118.4° | 118.4° |
| C27 | N28 | C29 | C33 | 117.3° | 117.3° |
| C27 | N28 | C29 | C30 | 174.9° | 174.9° |
| C27 | N28 | C33 | C32 | 171.4° | 171.4° |
| N28 | C27 | C26 | H261 | 57.3° | 57.3° |
| N28 | C27 | C26 | H262 | 62.7° | 62.7° |
| N28 | C27 | H271 | H272 | 118.4° | 118.4° |
| C27 | N28 | C29 | H291 | 54.9° | 54.8° |
| C27 | N28 | C29 | H292 | 65.2° | 65.2° |
| C27 | N28 | C33 | H331 | 68.6° | 68.6° |
| C27 | N28 | C33 | H332 | 51.0° | 51.0° |
| N28 | C29 | C30 | H291 | 120.0° | 120.0° |
| N28 | C29 | C30 | H292 | 119.9° | 119.9° |
| N28 | C29 | C30 | C31 | 57.3° | 57.3° |
| C29 | N28 | C33 | C32 | 68.4° | 68.4° |
| C29 | N28 | C27 | H271 | 36.4° | 36.4° |
| C29 | N28 | C27 | H272 | 158.1° | 158.1° |
| N28 | C29 | H291 | H292 | 119.9° | 119.8° |
| C29 | N28 | C33 | H331 | 51.6° | 51.6° |
| C29 | N28 | C33 | H332 | 171.2° | 171.2° |
| N28 | C29 | C30 | H301 | 62.7° | 62.7° |
| N28 | C29 | C30 | H302 | 177.1° | 177.1° |
| C33 | N28 | C29 | C30 | 67.8° | 67.8° |
| N28 | C33 | C32 | C31 | 59.7° | 59.7° |
| N28 | C33 | C32 | H331 | 120.0° | 120.0° |
| N28 | C33 | C32 | H332 | 120.4° | 120.4° |
| C33 | N28 | C27 | H271 | 81.4° | 81.4° |
| C33 | N28 | C27 | H272 | 40.3° | 40.3° |
| C33 | N28 | C29 | H291 | 172.2° | 172.1° |
| C33 | N28 | C29 | H292 | 52.0° | 52.0° |
| N28 | C33 | H331 | H332 | 120.5° | 120.5° |
| N28 | C33 | C32 | H321 | 60.4° | 60.4° |
| N28 | C33 | C32 | H322 | 179.4° | 179.4° |
| C29 | C30 | C31 | H301 | 120.0° | 120.0° |
| C29 | C30 | C31 | H302 | 119.9° | 119.8° |
| C29 | C30 | C31 | C32 | 48.9° | 48.9° |
| C30 | C29 | H291 | H292 | 119.8° | 119.9° |
| C29 | C30 | H301 | H302 | 119.8° | 119.9° |
| C29 | C30 | C31 | H311 | 168.9° | 168.9° |
| C29 | C30 | C31 | H312 | 70.1° | 70.1° |
| C30 | C31 | C32 | H311 | 120.0° | 120.0° |
| C30 | C31 | C32 | H312 | 119.0° | 119.0° |
| C30 | C31 | C32 | C33 | 50.4° | 50.4° |
| C31 | C30 | C29 | H291 | 177.3° | 177.3° |
| C31 | C30 | C29 | H292 | 62.6° | 62.6° |
| C31 | C30 | H301 | H302 | 119.8° | 119.8° |
| C30 | C31 | H311 | H312 | 119.0° | 119.0° |
| C30 | C31 | C32 | H321 | 69.7° | 69.7° |
| C30 | C31 | C32 | H322 | 170.1° | 170.1° |
| C31 | C32 | C33 | H321 | 120.0° | 120.0° |
| C31 | C32 | C33 | H322 | 119.7° | 119.7° |
| C31 | C32 | C33 | H331 | 60.3° | 60.3° |
| C31 | C32 | C33 | H332 | 179.9° | 179.9° |
| C32 | C31 | C30 | H301 | 71.1° | 71.1° |
| C32 | C31 | C30 | H302 | 168.8° | 168.7° |
| C32 | C31 | H311 | H312 | 119.0° | 119.0° |
| C31 | C32 | H321 | H322 | 119.7° | 119.7° |
| C32 | C33 | H331 | H332 | 120.5° | 120.5° |
| C33 | C32 | C31 | H311 | 170.4° | 170.4° |
| C33 | C32 | C31 | H312 | 68.6° | 68.6° |
| C33 | C32 | H321 | H322 | 119.7° | 119.7° |
| H1C1 | C1 | H1C2 | H1C3 | 120.0° | 120.0° |
| H14 | C14 | C15 | H15 | 1.6° | 1.5° |
| H251 | C25 | C26 | H261 | 83.8° | 83.8° |
| H251 | C25 | C26 | H262 | 36.2° | 36.2° |
| H252 | C25 | C26 | H261 | 157.7° | 157.7° |
| H252 | C25 | C26 | H262 | 82.3° | 82.3° |
| H261 | C26 | C27 | H271 | 177.3° | 177.3° |
| H261 | C26 | C27 | H272 | 61.0° | 61.0° |
| H262 | C26 | C27 | H271 | 57.3° | 57.3° |
| H262 | C26 | C27 | H272 | 179.0° | 179.0° |
| H291 | C29 | C30 | H301 | 57.3° | 57.3° |
| H291 | C29 | C30 | H302 | 62.8° | 62.9° |
| H292 | C29 | C30 | H301 | 177.4° | 177.4° |
| H292 | C29 | C30 | H302 | 57.3° | 57.2° |
| H331 | C33 | C32 | H321 | 179.7° | 179.7° |
| H331 | C33 | C32 | H322 | 59.4° | 59.4° |
| H332 | C33 | C32 | H321 | 60.1° | 60.1° |
| H332 | C33 | C32 | H322 | 60.2° | 60.2° |
| H301 | C30 | C31 | H311 | 48.9° | 48.9° |
| H301 | C30 | C31 | H312 | 169.9° | 169.9° |
| H302 | C30 | C31 | H311 | 71.3° | 71.3° |
| H302 | C30 | C31 | H312 | 49.8° | 49.8° |
| H311 | C31 | C32 | H321 | 50.3° | 50.3° |
| H311 | C31 | C32 | H322 | 69.9° | 69.9° |
| H312 | C31 | C32 | H321 | 171.4° | 171.4° |
| H312 | C31 | C32 | H322 | 51.1° | 51.1° |
