NFW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | C4 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C3 | C8 | sing | 1.41Å | 1.42Å | Aromatic |
| C3 | C9 | doub | 1.35Å | 1.38Å | Aromatic |
| C4 | C10 | sing | 1.40Å | 1.38Å | Aromatic |
| C5 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C14 | doub | 1.39Å | 1.38Å | Aromatic |
| C8 | C16 | doub | 1.34Å | 1.37Å | Aromatic |
| C9 | O37 | sing | 1.34Å | 1.36Å | Aromatic |
| C10 | C12 | doub | 1.40Å | 1.38Å | Aromatic |
| C10 | C19 | sing | 1.48Å | 1.49Å | |
| C11 | C13 | sing | 1.40Å | 1.40Å | Aromatic |
| C11 | C15 | doub | 1.40Å | 1.39Å | Aromatic |
| C11 | C20 | sing | 1.47Å | 1.50Å | |
| C12 | C24 | sing | 1.51Å | 1.49Å | |
| C13 | C25 | sing | 1.51Å | 1.50Å | |
| C14 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | O39 | sing | 1.36Å | 1.39Å | |
| C15 | O38 | sing | 1.36Å | 1.40Å | |
| C16 | C26 | sing | 1.51Å | 1.47Å | |
| C16 | O37 | sing | 1.34Å | 1.36Å | Aromatic |
| C19 | N30 | sing | 1.35Å | 1.38Å | |
| C19 | O34 | doub | 1.22Å | 1.23Å | |
| C20 | O32 | doub | 1.21Å | 1.27Å | |
| C20 | O35 | sing | 1.35Å | 1.28Å | |
| C21 | C28 | sing | 1.51Å | 1.52Å | |
| C21 | O33 | sing | 1.34Å | 1.27Å | |
| C21 | O36 | doub | 1.21Å | 1.26Å | |
| C23 | C22 | sing | 1.54Å | 1.50Å | |
| C23 | C29 | sing | 1.53Å | 1.52Å | |
| C23 | O39 | sing | 1.43Å | 1.43Å | |
| C22 | O38 | sing | 1.43Å | 1.43Å | |
| C24 | N31 | sing | 1.47Å | 1.49Å | |
| C25 | N31 | sing | 1.47Å | 1.52Å | |
| C26 | N30 | sing | 1.46Å | 1.45Å | |
| C27 | N31 | sing | 1.47Å | 1.50Å | |
| C28 | C29 | sing | 1.53Å | 1.52Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| N30 | H30 | sing | 0.97Å | 1.00Å | |
| O35 | H35 | sing | 0.97Å | 0.95Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| O33 | H33 | sing | 0.97Å | 0.95Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C27 | H273 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C4 | 120.6° | 120.2° |
| C1 | C2 | C5 | 119.3° | 120.3° |
| C2 | C1 | H1 | 119.7° | 119.9° |
| C1 | C2 | H2 | 120.4° | 119.9° |
| C1 | C4 | C10 | 120.0° | 119.8° |
| C4 | C1 | H1 | 119.7° | 119.9° |
| C1 | C4 | H4 | 120.0° | 120.1° |
| C2 | C5 | C12 | 120.5° | 120.1° |
| C5 | C2 | H2 | 120.3° | 119.8° |
| C2 | C5 | H5 | 119.7° | 119.9° |
| C8 | C3 | C9 | 106.3° | 106.8° |
| C3 | C8 | C16 | 105.9° | 106.9° |
| C8 | C3 | H3 | 126.8° | 126.6° |
| C3 | C8 | H8 | 127.1° | 126.6° |
| C3 | C9 | O37 | 110.6° | 108.4° |
| C9 | C3 | H3 | 126.9° | 126.5° |
| C3 | C9 | H9 | 124.7° | 125.8° |
| C4 | C10 | C12 | 119.7° | 119.7° |
| C4 | C10 | C19 | 119.9° | 120.1° |
| C10 | C4 | H4 | 120.0° | 120.1° |
| C5 | C12 | C10 | 119.9° | 119.9° |
| C5 | C12 | C24 | 119.3° | 120.1° |
| C12 | C5 | H5 | 119.7° | 120.0° |
| C7 | C6 | C13 | 120.3° | 120.4° |
| C6 | C7 | C14 | 119.2° | 120.4° |
| C7 | C6 | H6 | 119.9° | 119.8° |
| C6 | C7 | H7 | 120.4° | 119.8° |
| C6 | C13 | C11 | 120.8° | 119.9° |
| C6 | C13 | C25 | 118.4° | 120.1° |
| C13 | C6 | H6 | 119.8° | 119.8° |
| C7 | C14 | C15 | 120.8° | 119.9° |
| C7 | C14 | O39 | 116.9° | 119.4° |
| C14 | C7 | H7 | 120.4° | 119.8° |
| C8 | C16 | C26 | 131.2° | 125.8° |
| C8 | C16 | O37 | 111.1° | 108.4° |
| C16 | C8 | H8 | 127.1° | 126.6° |
| C9 | O37 | C16 | 106.2° | 109.5° |
| O37 | C9 | H9 | 124.7° | 125.8° |
| C12 | C10 | C19 | 120.5° | 120.1° |
| C10 | C12 | C24 | 120.8° | 120.1° |
| C10 | C19 | N30 | 114.0° | 120.0° |
| C10 | C19 | O34 | 120.9° | 120.0° |
| C13 | C11 | C15 | 118.3° | 119.7° |
| C13 | C11 | C20 | 121.1° | 120.2° |
| C11 | C13 | C25 | 120.8° | 120.0° |
| C15 | C11 | C20 | 120.5° | 120.1° |
| C11 | C15 | C14 | 120.6° | 119.7° |
| C11 | C15 | O38 | 118.0° | 119.5° |
| C11 | C20 | O32 | 119.3° | 120.0° |
| C11 | C20 | O35 | 115.7° | 120.0° |
| C12 | C24 | N31 | 116.1° | 109.5° |
| C12 | C24 | H241 | 107.8° | 109.5° |
| C12 | C24 | H242 | 107.8° | 109.5° |
| C13 | C25 | N31 | 108.5° | 109.5° |
| C13 | C25 | H251 | 109.7° | 109.5° |
| C13 | C25 | H252 | 109.7° | 109.4° |
| C15 | C14 | O39 | 122.3° | 120.7° |
| C14 | C15 | O38 | 121.4° | 120.9° |
| C14 | O39 | C23 | 111.6° | 116.7° |
| C15 | O38 | C22 | 111.9° | 116.7° |
| C26 | C16 | O37 | 117.7° | 125.8° |
| C16 | C26 | N30 | 108.6° | 109.5° |
| C16 | C26 | H261 | 109.7° | 109.4° |
| C16 | C26 | H262 | 109.7° | 109.4° |
| N30 | C19 | O34 | 125.1° | 120.0° |
| C19 | N30 | C26 | 122.7° | 120.0° |
| C19 | N30 | H30 | 118.6° | 120.0° |
| O32 | C20 | O35 | 124.7° | 120.0° |
| C20 | O35 | H35 | 109.5° | 117.0° |
| C28 | C21 | O33 | 114.7° | 120.0° |
| C28 | C21 | O36 | 116.6° | 120.0° |
| C21 | C28 | C29 | 106.2° | 109.5° |
| C21 | C28 | H281 | 110.3° | 109.5° |
| C21 | C28 | H282 | 110.3° | 109.5° |
| O33 | C21 | O36 | 128.7° | 120.0° |
| C21 | O33 | H33 | 109.5° | 117.0° |
| C22 | C23 | C29 | 108.4° | 109.7° |
| C22 | C23 | O39 | 109.0° | 108.2° |
| C23 | C22 | O38 | 108.5° | 108.2° |
| C22 | C23 | H23 | 109.2° | 109.7° |
| C23 | C22 | H221 | 109.7° | 109.7° |
| C23 | C22 | H222 | 109.7° | 109.8° |
| C29 | C23 | O39 | 111.0° | 109.7° |
| C23 | C29 | C28 | 112.6° | 109.5° |
| C29 | C23 | H23 | 109.0° | 109.7° |
| C23 | C29 | H291 | 108.7° | 109.5° |
| C23 | C29 | H292 | 108.6° | 109.5° |
| O39 | C23 | H23 | 110.2° | 109.8° |
| O38 | C22 | H221 | 109.7° | 109.7° |
| O38 | C22 | H222 | 109.7° | 109.8° |
| C24 | N31 | C25 | 116.4° | 111.0° |
| C24 | N31 | C27 | 106.3° | 111.0° |
| N31 | C24 | H241 | 107.8° | 109.5° |
| N31 | C24 | H242 | 107.8° | 109.5° |
| C25 | N31 | C27 | 116.0° | 111.0° |
| N31 | C25 | H251 | 109.7° | 109.5° |
| N31 | C25 | H252 | 109.7° | 109.5° |
| N30 | C26 | H261 | 109.7° | 109.5° |
| N30 | C26 | H262 | 109.7° | 109.5° |
| C26 | N30 | H30 | 118.7° | 120.0° |
| N31 | C27 | H271 | 109.5° | 109.5° |
| N31 | C27 | H272 | 109.5° | 109.5° |
| N31 | C27 | H273 | 109.5° | 109.5° |
| C29 | C28 | H281 | 110.3° | 109.4° |
| C29 | C28 | H282 | 110.3° | 109.4° |
| C28 | C29 | H291 | 108.7° | 109.4° |
| C28 | C29 | H292 | 108.7° | 109.5° |
| H241 | C24 | H242 | 109.4° | 109.4° |
| H251 | C25 | H252 | 109.5° | 109.5° |
| H261 | C26 | H262 | 109.5° | 109.5° |
| H281 | C28 | H282 | 109.5° | 109.5° |
| H221 | C22 | H222 | 109.5° | 109.7° |
| H291 | C29 | H292 | 109.5° | 109.5° |
| H271 | C27 | H272 | 109.5° | 109.4° |
| H271 | C27 | H273 | 109.5° | 109.5° |
| H272 | C27 | H273 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C4 | H1 | 180.0° | 179.8° |
| C1 | C2 | C5 | H2 | 180.0° | 179.9° |
| C2 | C1 | C4 | C10 | 0.7° | 0.0° |
| C1 | C2 | C5 | C12 | 0.0° | 0.0° |
| C2 | C1 | C4 | H4 | 179.3° | 180.0° |
| C1 | C2 | C5 | H5 | 180.0° | 179.9° |
| C4 | C1 | C2 | C5 | 0.5° | 0.0° |
| C1 | C4 | C10 | H4 | 180.0° | 179.9° |
| C1 | C4 | C10 | C12 | 0.4° | 0.1° |
| C1 | C4 | C10 | C19 | 179.3° | 180.0° |
| C4 | C1 | C2 | H2 | 179.5° | 179.9° |
| C2 | C5 | C12 | H5 | 180.0° | 179.9° |
| C2 | C5 | C12 | C10 | 0.3° | 0.1° |
| C2 | C5 | C12 | C24 | 179.9° | 180.0° |
| C5 | C2 | C1 | H1 | 179.5° | 179.8° |
| C8 | C3 | C9 | H3 | 180.0° | 179.7° |
| C3 | C8 | C16 | H8 | 180.0° | 180.0° |
| C8 | C3 | C9 | O37 | 0.4° | 0.0° |
| C3 | C8 | C16 | C26 | 179.5° | 180.0° |
| C3 | C8 | C16 | O37 | 0.2° | 0.0° |
| C8 | C3 | C9 | H9 | 179.5° | 180.0° |
| C9 | C3 | C8 | C16 | 0.3° | 0.0° |
| C3 | C9 | O37 | H9 | 180.0° | 180.0° |
| C3 | C9 | O37 | C16 | 0.3° | 0.0° |
| C9 | C3 | C8 | H8 | 179.6° | 180.0° |
| C4 | C10 | C12 | C5 | 0.1° | 0.1° |
| C4 | C10 | C12 | C19 | 179.7° | 179.9° |
| C4 | C10 | C12 | C24 | 179.7° | 180.0° |
| C4 | C10 | C19 | N30 | 56.8° | 0.1° |
| C4 | C10 | C19 | O34 | 125.1° | 180.0° |
| C10 | C4 | C1 | H1 | 179.3° | 179.8° |
| C5 | C12 | C10 | C24 | 179.7° | 179.9° |
| C5 | C12 | C10 | C19 | 179.8° | 179.9° |
| C5 | C12 | C24 | N31 | 73.4° | 100.1° |
| C12 | C5 | C2 | H2 | 180.0° | 179.9° |
| C5 | C12 | C24 | H241 | 47.6° | 20.0° |
| C5 | C12 | C24 | H242 | 165.7° | 139.9° |
| C7 | C6 | C13 | H6 | 180.0° | 179.7° |
| C6 | C7 | C14 | H7 | 180.0° | 179.9° |
| C7 | C6 | C13 | C11 | 0.2° | 0.0° |
| C7 | C6 | C13 | C25 | 179.3° | 179.9° |
| C6 | C7 | C14 | C15 | 1.5° | 0.1° |
| C6 | C7 | C14 | O39 | 179.5° | 179.6° |
| C13 | C6 | C7 | C14 | 0.9° | 0.0° |
| C6 | C13 | C11 | C25 | 179.1° | 179.9° |
| C6 | C13 | C11 | C15 | 0.2° | 0.0° |
| C6 | C13 | C11 | C20 | 178.4° | 180.0° |
| C6 | C13 | C25 | N31 | 102.9° | 104.5° |
| C13 | C6 | C7 | H7 | 179.1° | 180.0° |
| C6 | C13 | C25 | H251 | 137.2° | 135.4° |
| C6 | C13 | C25 | H252 | 16.9° | 15.4° |
| C7 | C14 | C15 | C11 | 1.5° | 0.1° |
| C7 | C14 | C15 | O39 | 178.9° | 179.7° |
| C7 | C14 | C15 | O38 | 179.0° | 179.7° |
| C7 | C14 | O39 | C23 | 162.4° | 162.9° |
| C14 | C7 | C6 | H6 | 179.1° | 179.7° |
| C8 | C16 | O37 | C9 | 0.1° | 0.0° |
| C8 | C16 | C26 | O37 | 179.3° | 179.9° |
| C8 | C16 | C26 | N30 | 68.2° | 90.1° |
| C16 | C8 | C3 | H3 | 179.7° | 179.7° |
| C8 | C16 | C26 | H261 | 172.0° | 150.0° |
| C8 | C16 | C26 | H262 | 51.7° | 30.0° |
| C9 | O37 | C16 | C26 | 179.3° | 180.0° |
| O37 | C9 | C3 | H3 | 179.6° | 179.7° |
| C12 | C10 | C19 | N30 | 123.0° | 180.0° |
| C12 | C10 | C19 | O34 | 55.2° | 0.1° |
| C10 | C12 | C24 | N31 | 107.0° | 80.0° |
| C12 | C10 | C4 | H4 | 179.6° | 180.0° |
| C10 | C12 | C5 | H5 | 179.7° | 180.0° |
| C10 | C12 | C24 | H241 | 132.0° | 159.9° |
| C10 | C12 | C24 | H242 | 14.0° | 40.0° |
| C19 | C10 | C12 | C24 | 0.6° | 0.0° |
| C10 | C19 | N30 | O34 | 178.0° | 179.9° |
| C10 | C19 | N30 | C26 | 171.8° | 180.0° |
| C19 | C10 | C4 | H4 | 0.7° | 0.0° |
| C10 | C19 | N30 | H30 | 8.2° | 0.1° |
| C13 | C11 | C15 | C20 | 178.2° | 180.0° |
| C13 | C11 | C15 | C14 | 0.9° | 0.1° |
| C13 | C11 | C15 | O38 | 178.4° | 179.7° |
| C13 | C11 | C20 | O32 | 40.5° | 95.4° |
| C13 | C11 | C20 | O35 | 133.8° | 84.6° |
| C11 | C13 | C25 | N31 | 76.2° | 75.5° |
| C11 | C13 | C6 | H6 | 179.8° | 179.8° |
| C11 | C13 | C25 | H251 | 43.7° | 44.5° |
| C11 | C13 | C25 | H252 | 164.0° | 164.5° |
| C15 | C11 | C13 | C25 | 179.3° | 179.9° |
| C11 | C15 | C14 | O38 | 177.4° | 179.8° |
| C11 | C15 | C14 | O39 | 179.6° | 179.6° |
| C15 | C11 | C20 | O32 | 141.3° | 84.5° |
| C15 | C11 | C20 | O35 | 44.4° | 95.5° |
| C11 | C15 | O38 | C22 | 163.2° | 162.7° |
| C20 | C11 | C13 | C25 | 2.5° | 0.1° |
| C20 | C11 | C15 | C14 | 179.1° | 180.0° |
| C20 | C11 | C15 | O38 | 3.4° | 0.3° |
| C11 | C20 | O32 | O35 | 173.7° | 180.0° |
| C11 | C20 | O35 | H35 | 173.9° | 180.0° |
| C12 | C24 | N31 | H241 | 121.0° | 120.0° |
| C12 | C24 | N31 | H242 | 121.0° | 120.0° |
| C12 | C24 | N31 | C25 | 69.8° | 170.0° |
| C12 | C24 | N31 | C27 | 159.3° | 66.0° |
| C24 | C12 | C5 | H5 | 0.1° | 0.1° |
| C12 | C24 | H241 | H242 | 117.0° | 120.0° |
| C13 | C25 | N31 | C24 | 169.7° | 175.6° |
| C13 | C25 | N31 | H251 | 119.8° | 120.1° |
| C13 | C25 | N31 | H252 | 119.8° | 119.9° |
| C13 | C25 | N31 | C27 | 43.4° | 60.4° |
| C25 | C13 | C6 | H6 | 0.7° | 0.2° |
| C13 | C25 | H251 | H252 | 120.5° | 120.0° |
| C15 | C14 | O39 | C23 | 18.7° | 17.4° |
| C14 | C15 | O38 | C22 | 19.3° | 17.5° |
| C15 | C14 | C7 | H7 | 178.5° | 179.9° |
| O39 | C14 | C15 | O38 | 2.1° | 0.6° |
| C14 | O39 | C23 | C22 | 50.2° | 46.2° |
| C14 | O39 | C23 | C29 | 169.5° | 165.9° |
| O39 | C14 | C7 | H7 | 0.5° | 0.4° |
| C14 | O39 | C23 | H23 | 69.7° | 73.5° |
| C15 | O38 | C22 | C23 | 50.6° | 46.3° |
| C15 | O38 | C22 | H221 | 170.4° | 165.9° |
| C15 | O38 | C22 | H222 | 69.3° | 73.5° |
| C16 | C26 | N30 | C19 | 91.7° | 180.0° |
| C16 | C26 | N30 | H261 | 119.9° | 119.9° |
| C16 | C26 | N30 | H262 | 119.9° | 120.0° |
| C26 | C16 | C8 | H8 | 0.5° | 0.0° |
| C16 | C26 | H261 | H262 | 120.4° | 120.0° |
| C16 | C26 | N30 | H30 | 88.3° | 0.0° |
| O37 | C16 | C26 | N30 | 111.1° | 90.0° |
| O37 | C16 | C8 | H8 | 179.8° | 180.0° |
| C16 | O37 | C9 | H9 | 179.6° | 180.0° |
| O37 | C16 | C26 | H261 | 8.7° | 29.9° |
| O37 | C16 | C26 | H262 | 129.0° | 149.9° |
| C19 | N30 | C26 | H30 | 180.0° | 179.9° |
| C19 | N30 | C26 | H261 | 148.5° | 60.1° |
| C19 | N30 | C26 | H262 | 28.2° | 60.0° |
| O34 | C19 | N30 | C26 | 10.2° | 0.1° |
| O34 | C19 | N30 | H30 | 169.8° | 180.0° |
| O32 | C20 | O35 | H35 | 0.0° | 0.0° |
| C28 | C21 | O33 | O36 | 179.0° | 180.0° |
| C21 | C28 | C29 | C23 | 75.4° | 180.0° |
| C21 | C28 | C29 | H281 | 119.5° | 120.0° |
| C21 | C28 | C29 | H282 | 119.5° | 120.0° |
| C21 | C28 | H281 | H282 | 121.5° | 120.1° |
| C28 | C21 | O33 | H33 | 178.9° | 180.0° |
| C21 | C28 | C29 | H291 | 164.2° | 60.0° |
| C21 | C28 | C29 | H292 | 45.1° | 60.0° |
| O33 | C21 | C28 | C29 | 137.9° | 180.0° |
| O33 | C21 | C28 | H281 | 102.6° | 60.0° |
| O33 | C21 | C28 | H282 | 18.4° | 60.0° |
| O36 | C21 | C28 | C29 | 43.0° | 0.0° |
| O36 | C21 | C28 | H281 | 76.5° | 119.9° |
| O36 | C21 | C28 | H282 | 162.5° | 120.0° |
| O36 | C21 | O33 | H33 | 0.0° | 0.0° |
| C22 | C23 | C29 | O39 | 119.7° | 118.8° |
| C22 | C23 | C29 | H23 | 118.8° | 120.5° |
| C22 | C23 | O39 | H23 | 119.9° | 119.7° |
| C23 | C22 | O38 | H221 | 119.8° | 119.6° |
| C23 | C22 | O38 | H222 | 119.9° | 119.8° |
| C22 | C23 | C29 | C28 | 175.7° | 175.0° |
| C23 | C22 | H221 | H222 | 120.5° | 120.6° |
| C22 | C23 | C29 | H291 | 55.2° | 65.0° |
| C22 | C23 | C29 | H292 | 63.8° | 55.0° |
| C29 | C23 | O39 | H23 | 120.8° | 120.7° |
| C29 | C23 | C22 | O38 | 170.7° | 179.4° |
| C23 | C29 | C28 | H291 | 120.5° | 120.0° |
| C23 | C29 | C28 | H292 | 120.4° | 120.0° |
| C23 | C29 | C28 | H281 | 165.1° | 60.0° |
| C23 | C29 | C28 | H282 | 44.1° | 60.0° |
| C29 | C23 | C22 | H221 | 50.8° | 61.0° |
| C29 | C23 | C22 | H222 | 69.5° | 59.6° |
| C23 | C29 | H291 | H292 | 118.5° | 120.1° |
| O39 | C23 | C22 | O38 | 68.4° | 59.7° |
| O39 | C23 | C29 | C28 | 56.1° | 66.3° |
| O39 | C23 | C22 | H221 | 171.7° | 179.4° |
| O39 | C23 | C22 | H222 | 51.4° | 60.1° |
| O39 | C23 | C29 | H291 | 64.4° | 53.7° |
| O39 | C23 | C29 | H292 | 176.5° | 173.7° |
| O38 | C22 | C23 | H23 | 52.0° | 60.1° |
| O38 | C22 | H221 | H222 | 120.5° | 120.6° |
| C24 | N31 | C25 | C27 | 126.2° | 124.0° |
| N31 | C24 | H241 | H242 | 117.0° | 120.0° |
| C24 | N31 | C25 | H251 | 70.5° | 55.5° |
| C24 | N31 | C25 | H252 | 49.8° | 64.5° |
| C24 | N31 | C27 | H271 | 180.0° | 64.1° |
| C24 | N31 | C27 | H272 | 60.0° | 175.9° |
| C24 | N31 | C27 | H273 | 60.0° | 55.9° |
| C25 | N31 | C24 | H241 | 169.2° | 70.0° |
| C25 | N31 | C24 | H242 | 51.1° | 50.0° |
| N31 | C25 | H251 | H252 | 120.5° | 120.0° |
| C25 | N31 | C27 | H271 | 48.8° | 59.9° |
| C25 | N31 | C27 | H272 | 168.9° | 60.1° |
| C25 | N31 | C27 | H273 | 71.2° | 179.9° |
| N30 | C26 | H261 | H262 | 120.4° | 120.1° |
| C27 | N31 | C24 | H241 | 38.3° | 54.0° |
| C27 | N31 | C24 | H242 | 79.8° | 174.0° |
| C27 | N31 | C25 | H251 | 163.3° | 179.5° |
| C27 | N31 | C25 | H252 | 76.4° | 59.5° |
| N31 | C27 | H271 | H272 | 120.0° | 120.0° |
| N31 | C27 | H271 | H273 | 120.0° | 120.0° |
| N31 | C27 | H272 | H273 | 120.0° | 120.1° |
| C29 | C28 | H281 | H282 | 121.5° | 120.0° |
| C28 | C29 | C23 | H23 | 65.5° | 54.5° |
| C28 | C29 | H291 | H292 | 118.6° | 120.0° |
| H1 | C1 | C2 | H2 | 0.5° | 0.2° |
| H1 | C1 | C4 | H4 | 0.7° | 0.1° |
| H2 | C2 | C5 | H5 | 0.0° | 0.0° |
| H3 | C3 | C8 | H8 | 0.4° | 0.3° |
| H3 | C3 | C9 | H9 | 0.5° | 0.3° |
| H6 | C6 | C7 | H7 | 0.9° | 0.3° |
| H261 | C26 | N30 | H30 | 31.6° | 120.0° |
| H262 | C26 | N30 | H30 | 151.8° | 119.9° |
| H281 | C28 | C29 | H291 | 44.7° | 60.0° |
| H281 | C28 | C29 | H292 | 74.4° | 180.0° |
| H282 | C28 | C29 | H291 | 76.4° | NaN° |
| H282 | C28 | C29 | H292 | 164.6° | 60.0° |
| H23 | C23 | C22 | H221 | 67.8° | 59.6° |
| H23 | C23 | C22 | H222 | 171.9° | 179.8° |
| H23 | C23 | C29 | H291 | 174.1° | 174.4° |
| H23 | C23 | C29 | H292 | 55.0° | 65.5° |
| H271 | C27 | H272 | H273 | 120.0° | 119.9° |
