LPN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL1 | C2 | sing | 1.74Å | 1.78Å | |
| C2 | C3 | doub | 1.39Å | 1.38Å | Aromatic |
| C2 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | O5 | sing | 1.36Å | 1.37Å | |
| C3 | C6 | sing | 1.39Å | 1.38Å | Aromatic |
| C4 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| O5 | C8 | sing | 1.43Å | 1.43Å | |
| C6 | CL9 | sing | 1.74Å | 1.78Å | |
| C6 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | C11 | sing | 1.51Å | 1.50Å | |
| C8 | C12 | sing | 1.53Å | 1.52Å | |
| C12 | O13 | sing | 1.43Å | 1.42Å | |
| O13 | C14 | sing | 1.36Å | 1.38Å | |
| C14 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C14 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | C19 | doub | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.51Å | 1.51Å | |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C20 | C22 | sing | 1.53Å | 1.53Å | |
| C21 | C23 | sing | 1.51Å | 1.52Å | |
| C21 | C24 | sing | 1.53Å | 1.54Å | |
| C22 | C25 | sing | 1.53Å | 1.52Å | |
| C23 | O26 | doub | 1.21Å | 1.22Å | |
| C23 | N27 | sing | 1.35Å | 1.34Å | |
| C24 | N28 | sing | 1.47Å | 1.45Å | |
| C25 | N28 | sing | 1.47Å | 1.46Å | |
| N27 | C29 | sing | 1.47Å | 1.48Å | |
| N27 | C30 | sing | 1.47Å | 1.45Å | |
| C29 | C31 | sing | 1.53Å | 1.53Å | |
| C29 | C32 | sing | 1.53Å | 1.52Å | |
| C30 | C33 | sing | 1.51Å | 1.50Å | |
| C31 | C32 | sing | 1.53Å | 1.51Å | |
| C33 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C34 | CL36 | sing | 1.74Å | 1.79Å | |
| C34 | C37 | sing | 1.38Å | 1.38Å | Aromatic |
| C35 | C38 | doub | 1.38Å | 1.39Å | Aromatic |
| C37 | C39 | doub | 1.38Å | 1.39Å | Aromatic |
| C38 | C39 | sing | 1.38Å | 1.38Å | Aromatic |
| C38 | C40 | sing | 1.51Å | 1.50Å | |
| C40 | C41 | sing | 1.53Å | 1.51Å | |
| C41 | C42 | sing | 1.53Å | 1.52Å | |
| C42 | O43 | sing | 1.43Å | 1.42Å | |
| O43 | C44 | sing | 1.43Å | 1.42Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C11 | H11B | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| N28 | HN28 | sing | 1.01Å | 1.00Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C39 | H39 | sing | 1.08Å | 1.08Å | |
| C40 | H40 | sing | 1.09Å | 1.10Å | |
| C40 | H40A | sing | 1.09Å | 1.10Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| C41 | H41A | sing | 1.09Å | 1.10Å | |
| C42 | H42 | sing | 1.09Å | 1.10Å | |
| C42 | H42A | sing | 1.09Å | 1.10Å | |
| C44 | H44 | sing | 1.09Å | 1.10Å | |
| C44 | H44A | sing | 1.09Å | 1.10Å | |
| C44 | H44B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL1 | C2 | C3 | 120.0° | 120.0° |
| CL1 | C2 | C4 | 119.8° | 120.0° |
| C3 | C2 | C4 | 120.2° | 119.9° |
| C2 | C3 | O5 | 121.3° | 120.1° |
| C2 | C3 | C6 | 119.0° | 119.8° |
| C2 | C4 | C7 | 120.3° | 120.1° |
| C2 | C4 | H4 | 119.8° | 120.0° |
| O5 | C3 | C6 | 119.7° | 120.1° |
| C3 | O5 | C8 | 120.8° | 117.0° |
| C3 | C6 | CL9 | 117.8° | 120.0° |
| C3 | C6 | C10 | 121.9° | 120.0° |
| C4 | C7 | C10 | 120.0° | 120.1° |
| C4 | C7 | C11 | 119.6° | 119.9° |
| C7 | C4 | H4 | 119.9° | 120.0° |
| O5 | C8 | C12 | 109.4° | 109.5° |
| O5 | C8 | H8 | 109.5° | 109.5° |
| O5 | C8 | H8A | 109.5° | 109.5° |
| CL9 | C6 | C10 | 120.3° | 120.0° |
| C6 | C10 | C7 | 118.6° | 120.1° |
| C6 | C10 | H10 | 120.7° | 120.0° |
| C10 | C7 | C11 | 120.4° | 119.9° |
| C7 | C10 | H10 | 120.7° | 120.0° |
| C7 | C11 | H11 | 109.5° | 109.4° |
| C7 | C11 | H11A | 109.5° | 109.5° |
| C7 | C11 | H11B | 109.4° | 109.5° |
| C8 | C12 | O13 | 108.9° | 109.5° |
| C12 | C8 | H8 | 109.5° | 109.5° |
| C12 | C8 | H8A | 109.5° | 109.5° |
| C8 | C12 | H12 | 109.7° | 109.5° |
| C8 | C12 | H12A | 109.7° | 109.4° |
| C12 | O13 | C14 | 123.8° | 117.0° |
| O13 | C12 | H12 | 109.7° | 109.6° |
| O13 | C12 | H12A | 109.7° | 109.5° |
| O13 | C14 | C15 | 123.5° | 120.1° |
| O13 | C14 | C16 | 117.5° | 120.1° |
| C15 | C14 | C16 | 119.0° | 119.9° |
| C14 | C15 | C17 | 121.1° | 120.0° |
| C14 | C15 | H15 | 119.5° | 120.0° |
| C14 | C16 | C18 | 120.5° | 120.0° |
| C14 | C16 | H16 | 119.7° | 120.0° |
| C15 | C17 | C19 | 119.5° | 120.0° |
| C17 | C15 | H15 | 119.5° | 120.0° |
| C15 | C17 | H17 | 120.2° | 120.0° |
| C16 | C18 | C19 | 121.4° | 120.1° |
| C18 | C16 | H16 | 119.8° | 120.0° |
| C16 | C18 | H18 | 119.3° | 120.0° |
| C17 | C19 | C18 | 118.5° | 120.1° |
| C17 | C19 | C20 | 124.2° | 119.9° |
| C19 | C17 | H17 | 120.2° | 120.0° |
| C18 | C19 | C20 | 117.3° | 120.0° |
| C19 | C18 | H18 | 119.3° | 119.9° |
| C19 | C20 | C21 | 110.2° | 109.5° |
| C19 | C20 | C22 | 115.5° | 109.5° |
| C19 | C20 | H20 | 106.5° | 109.5° |
| C21 | C20 | C22 | 114.4° | 109.1° |
| C20 | C21 | C23 | 106.7° | 109.5° |
| C20 | C21 | C24 | 114.1° | 109.3° |
| C21 | C20 | H20 | 107.8° | 109.6° |
| C20 | C21 | H21 | 109.6° | 109.5° |
| C20 | C22 | C25 | 109.6° | 109.3° |
| C22 | C20 | H20 | 101.4° | 109.5° |
| C20 | C22 | H22 | 109.4° | 109.5° |
| C20 | C22 | H22A | 109.4° | 109.5° |
| C23 | C21 | C24 | 112.9° | 109.5° |
| C21 | C23 | O26 | 120.5° | 120.0° |
| C21 | C23 | N27 | 120.6° | 120.0° |
| C23 | C21 | H21 | 110.8° | 109.5° |
| C21 | C24 | N28 | 110.1° | 109.5° |
| C24 | C21 | H21 | 102.9° | 109.5° |
| C21 | C24 | H24 | 109.3° | 109.4° |
| C21 | C24 | H24A | 109.2° | 109.5° |
| C22 | C25 | N28 | 112.0° | 109.5° |
| C25 | C22 | H22 | 109.4° | 109.6° |
| C25 | C22 | H22A | 109.4° | 109.5° |
| C22 | C25 | H25 | 108.6° | 109.4° |
| C22 | C25 | H25A | 108.6° | 109.5° |
| O26 | C23 | N27 | 118.8° | 120.0° |
| C23 | N27 | C29 | 125.4° | 120.0° |
| C23 | N27 | C30 | 120.5° | 120.0° |
| C24 | N28 | C25 | 119.0° | 111.2° |
| N28 | C24 | H24 | 109.2° | 109.5° |
| N28 | C24 | H24A | 109.2° | 109.5° |
| C24 | N28 | HN28 | 106.4° | 111.0° |
| N28 | C25 | H25 | 108.7° | 109.5° |
| N28 | C25 | H25A | 108.6° | 109.5° |
| C25 | N28 | HN28 | 106.4° | 111.0° |
| C29 | N27 | C30 | 113.9° | 120.0° |
| N27 | C29 | C31 | 110.6° | 117.5° |
| N27 | C29 | C32 | 109.1° | 117.5° |
| N27 | C29 | H29 | 101.3° | 115.6° |
| N27 | C30 | C33 | 117.9° | 109.4° |
| N27 | C30 | H30 | 106.7° | 109.5° |
| N27 | C30 | H30A | 106.7° | 109.5° |
| C31 | C29 | C32 | 59.5° | 60.0° |
| C29 | C31 | C32 | 60.1° | 60.0° |
| C31 | C29 | H29 | 135.2° | 117.5° |
| C29 | C31 | H31 | 130.9° | 117.5° |
| C29 | C31 | H31A | 130.9° | 117.5° |
| C29 | C32 | C31 | 60.4° | 60.0° |
| C32 | C29 | H29 | 136.4° | 117.5° |
| C29 | C32 | H32 | 130.6° | 117.5° |
| C29 | C32 | H32A | 130.7° | 117.5° |
| C30 | C33 | C34 | 116.8° | 120.0° |
| C30 | C33 | C35 | 123.0° | 120.1° |
| C33 | C30 | H30 | 106.7° | 109.5° |
| C33 | C30 | H30A | 106.7° | 109.5° |
| C32 | C31 | H31 | 130.9° | 117.6° |
| C32 | C31 | H31A | 130.9° | 117.5° |
| C31 | C32 | H32 | 130.6° | 117.5° |
| C31 | C32 | H32A | 130.6° | 117.5° |
| C34 | C33 | C35 | 120.2° | 119.9° |
| C33 | C34 | CL36 | 119.9° | 120.0° |
| C33 | C34 | C37 | 120.8° | 120.0° |
| C33 | C35 | C38 | 118.9° | 120.1° |
| C33 | C35 | H35 | 120.6° | 119.9° |
| CL36 | C34 | C37 | 119.3° | 120.0° |
| C34 | C37 | C39 | 118.9° | 120.0° |
| C34 | C37 | H37 | 120.6° | 120.0° |
| C35 | C38 | C39 | 120.6° | 120.0° |
| C35 | C38 | C40 | 120.4° | 120.0° |
| C38 | C35 | H35 | 120.5° | 120.0° |
| C37 | C39 | C38 | 120.6° | 120.0° |
| C39 | C37 | H37 | 120.6° | 120.0° |
| C37 | C39 | H39 | 119.7° | 120.0° |
| C39 | C38 | C40 | 119.0° | 120.0° |
| C38 | C39 | H39 | 119.7° | 120.0° |
| C38 | C40 | C41 | 106.3° | 109.4° |
| C38 | C40 | H40 | 110.5° | 109.5° |
| C38 | C40 | H40A | 110.5° | 109.5° |
| C40 | C41 | C42 | 109.7° | 109.5° |
| C41 | C40 | H40 | 110.5° | 109.5° |
| C41 | C40 | H40A | 110.5° | 109.5° |
| C40 | C41 | H41 | 109.4° | 109.5° |
| C40 | C41 | H41A | 109.4° | 109.5° |
| C41 | C42 | O43 | 107.0° | 109.5° |
| C42 | C41 | H41 | 109.4° | 109.5° |
| C42 | C41 | H41A | 109.4° | 109.5° |
| C41 | C42 | H42 | 110.3° | 109.5° |
| C41 | C42 | H42A | 110.3° | 109.5° |
| C42 | O43 | C44 | 110.8° | 114.0° |
| O43 | C42 | H42 | 110.3° | 109.4° |
| O43 | C42 | H42A | 110.3° | 109.5° |
| O43 | C44 | H44 | 109.5° | 109.5° |
| O43 | C44 | H44A | 109.5° | 109.5° |
| O43 | C44 | H44B | 109.5° | 109.5° |
| H8 | C8 | H8A | 109.4° | 109.5° |
| H11 | C11 | H11A | 109.4° | 109.4° |
| H11 | C11 | H11B | 109.5° | 109.5° |
| H11A | C11 | H11B | 109.5° | 109.5° |
| H12 | C12 | H12A | 109.3° | 109.5° |
| H22 | C22 | H22A | 109.5° | 109.5° |
| H24 | C24 | H24A | 109.7° | 109.5° |
| H25 | C25 | H25A | 110.3° | 109.4° |
| H30 | C30 | H30A | 112.1° | 109.5° |
| H31 | C31 | H31A | 81.8° | 115.5° |
| H32 | C32 | H32A | 82.2° | 115.6° |
| H40 | C40 | H40A | 108.4° | 109.5° |
| H41 | C41 | H41A | 109.5° | 109.4° |
| H42 | C42 | H42A | 108.6° | 109.5° |
| H44 | C44 | H44A | 109.5° | 109.4° |
| H44 | C44 | H44B | 109.4° | 109.4° |
| H44A | C44 | H44B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL1 | C2 | C3 | C4 | 179.8° | 179.8° |
| CL1 | C2 | C3 | O5 | 0.0° | 0.0° |
| CL1 | C2 | C3 | C6 | 179.7° | 179.9° |
| CL1 | C2 | C4 | C7 | 179.9° | 180.0° |
| CL1 | C2 | C4 | H4 | 0.2° | 0.1° |
| C2 | C3 | O5 | C6 | 179.6° | 180.0° |
| C3 | C2 | C4 | C7 | 0.0° | 0.2° |
| C2 | C3 | O5 | C8 | 80.3° | 90.0° |
| C2 | C3 | C6 | CL9 | 179.8° | 180.0° |
| C2 | C3 | C6 | C10 | 0.7° | 0.0° |
| C3 | C2 | C4 | H4 | 180.0° | 179.7° |
| C4 | C2 | C3 | O5 | 179.9° | 179.7° |
| C4 | C2 | C3 | C6 | 0.5° | 0.3° |
| C2 | C4 | C7 | H4 | 180.0° | 179.9° |
| C2 | C4 | C7 | C10 | 0.2° | 0.1° |
| C2 | C4 | C7 | C11 | 179.8° | 179.9° |
| O5 | C3 | C6 | CL9 | 0.6° | 0.1° |
| O5 | C3 | C6 | C10 | 179.6° | 180.0° |
| C3 | O5 | C8 | C12 | 144.1° | 180.0° |
| C3 | O5 | C8 | H8 | 24.1° | 60.0° |
| C3 | O5 | C8 | H8A | 95.9° | 60.0° |
| C6 | C3 | O5 | C8 | 100.1° | 90.0° |
| C3 | C6 | CL9 | C10 | 179.0° | 179.9° |
| C3 | C6 | C10 | C7 | 0.5° | 0.3° |
| C3 | C6 | C10 | H10 | 179.5° | 180.0° |
| C4 | C7 | C10 | C6 | 0.0° | 0.3° |
| C4 | C7 | C10 | C11 | 179.6° | 180.0° |
| C4 | C7 | C10 | H10 | 180.0° | 180.0° |
| C4 | C7 | C11 | H11 | 90.2° | 90.0° |
| C4 | C7 | C11 | H11A | 149.8° | 150.1° |
| C4 | C7 | C11 | H11B | 29.8° | 30.0° |
| O5 | C8 | C12 | H8 | 120.0° | 120.0° |
| O5 | C8 | C12 | H8A | 120.0° | 120.0° |
| O5 | C8 | C12 | O13 | 93.7° | 64.9° |
| O5 | C8 | H8 | H8A | 120.0° | 120.0° |
| O5 | C8 | C12 | H12 | 146.3° | 175.0° |
| O5 | C8 | C12 | H12A | 26.3° | 55.0° |
| CL9 | C6 | C10 | C7 | 179.5° | 179.7° |
| CL9 | C6 | C10 | H10 | 0.5° | 0.0° |
| C6 | C10 | C7 | H10 | 180.0° | 179.7° |
| C6 | C10 | C7 | C11 | 179.6° | 179.7° |
| C10 | C7 | C4 | H4 | 179.8° | 180.0° |
| C10 | C7 | C11 | H11 | 90.2° | 90.0° |
| C10 | C7 | C11 | H11A | 29.8° | 29.9° |
| C10 | C7 | C11 | H11B | 149.8° | 150.0° |
| C11 | C7 | C4 | H4 | 0.1° | 0.0° |
| C11 | C7 | C10 | H10 | 0.4° | 0.0° |
| C7 | C11 | H11 | H11A | 120.0° | 120.0° |
| C7 | C11 | H11 | H11B | 120.0° | 120.0° |
| C7 | C11 | H11A | H11B | 120.0° | 120.0° |
| C8 | C12 | O13 | H12 | 120.0° | 120.0° |
| C8 | C12 | O13 | H12A | 120.0° | 119.9° |
| C8 | C12 | O13 | C14 | 135.6° | 180.0° |
| C12 | C8 | H8 | H8A | 120.0° | 120.0° |
| C8 | C12 | H12 | H12A | 120.2° | 119.9° |
| C12 | O13 | C14 | C15 | 5.2° | 180.0° |
| C12 | O13 | C14 | C16 | 175.3° | 0.2° |
| O13 | C12 | C8 | H8 | 26.3° | 55.1° |
| O13 | C12 | C8 | H8A | 146.3° | 175.0° |
| O13 | C12 | H12 | H12A | 120.2° | 120.1° |
| O13 | C14 | C15 | C16 | 179.4° | 179.7° |
| O13 | C14 | C15 | C17 | 179.8° | 180.0° |
| O13 | C14 | C16 | C18 | 179.3° | 180.0° |
| C14 | O13 | C12 | H12 | 104.4° | 60.0° |
| C14 | O13 | C12 | H12A | 15.6° | 60.1° |
| O13 | C14 | C15 | H15 | 0.1° | 0.0° |
| O13 | C14 | C16 | H16 | 0.7° | 0.0° |
| C14 | C15 | C17 | H15 | 180.0° | 180.0° |
| C15 | C14 | C16 | C18 | 0.2° | 0.3° |
| C14 | C15 | C17 | C19 | 0.7° | 0.0° |
| C15 | C14 | C16 | H16 | 179.9° | 179.7° |
| C14 | C15 | C17 | H17 | 179.3° | 180.0° |
| C16 | C14 | C15 | C17 | 0.4° | 0.3° |
| C14 | C16 | C18 | H16 | 180.0° | 180.0° |
| C14 | C16 | C18 | C19 | 0.5° | 0.0° |
| C16 | C14 | C15 | H15 | 179.6° | 179.8° |
| C14 | C16 | C18 | H18 | 179.6° | 180.0° |
| C15 | C17 | C19 | H17 | 180.0° | 180.0° |
| C15 | C17 | C19 | C18 | 0.4° | 0.3° |
| C15 | C17 | C19 | C20 | 178.3° | 179.9° |
| C16 | C18 | C19 | C17 | 0.2° | 0.3° |
| C16 | C18 | C19 | H18 | 180.0° | 180.0° |
| C16 | C18 | C19 | C20 | 177.9° | 180.0° |
| C17 | C19 | C18 | C20 | 178.1° | 179.8° |
| C17 | C19 | C20 | C21 | 89.6° | 120.0° |
| C17 | C19 | C20 | C22 | 42.0° | 120.3° |
| C19 | C17 | C15 | H15 | 179.3° | 179.9° |
| C17 | C19 | C18 | H18 | 179.8° | 179.7° |
| C17 | C19 | C20 | H20 | 153.7° | 0.2° |
| C18 | C19 | C20 | C21 | 88.3° | 60.2° |
| C18 | C19 | C20 | C22 | 140.1° | 59.4° |
| C19 | C18 | C16 | H16 | 179.6° | 180.0° |
| C18 | C19 | C17 | H17 | 179.6° | 179.7° |
| C18 | C19 | C20 | H20 | 28.4° | 179.6° |
| C19 | C20 | C21 | C22 | 132.1° | 119.9° |
| C19 | C20 | C21 | H20 | 115.9° | 120.2° |
| C19 | C20 | C22 | H20 | 114.7° | 120.2° |
| C19 | C20 | C21 | C23 | 56.4° | 62.5° |
| C19 | C20 | C21 | C24 | 178.2° | 177.5° |
| C19 | C20 | C22 | C25 | 178.5° | 177.5° |
| C20 | C19 | C17 | H17 | 1.7° | 0.0° |
| C20 | C19 | C18 | H18 | 2.1° | 0.0° |
| C19 | C20 | C21 | H21 | 63.6° | 57.5° |
| C19 | C20 | C22 | H22 | 61.6° | 62.5° |
| C19 | C20 | C22 | H22A | 58.4° | 57.6° |
| C21 | C20 | C22 | H20 | 115.8° | 119.9° |
| C20 | C21 | C23 | C24 | 126.1° | 119.8° |
| C20 | C21 | C23 | H21 | 119.2° | 120.1° |
| C20 | C21 | C24 | H21 | 118.6° | 120.0° |
| C21 | C20 | C22 | C25 | 48.9° | 57.6° |
| C20 | C21 | C23 | O26 | 71.4° | 0.0° |
| C20 | C21 | C23 | N27 | 106.5° | 180.0° |
| C20 | C21 | C24 | N28 | 43.4° | 59.2° |
| C21 | C20 | C22 | H22 | 168.9° | 177.7° |
| C21 | C20 | C22 | H22A | 71.1° | 62.3° |
| C20 | C21 | C24 | H24 | 163.4° | 179.2° |
| C20 | C21 | C24 | H24A | 76.6° | 60.8° |
| C22 | C20 | C21 | C23 | 171.5° | 177.6° |
| C22 | C20 | C21 | C24 | 46.1° | 57.6° |
| C20 | C22 | C25 | H22 | 120.0° | 120.0° |
| C20 | C22 | C25 | H22A | 120.0° | 119.9° |
| C20 | C22 | C25 | N28 | 51.6° | 59.2° |
| C22 | C20 | C21 | H21 | 68.5° | 62.3° |
| C20 | C22 | H22 | H22A | 119.9° | 120.0° |
| C20 | C22 | C25 | H25 | 68.4° | 60.8° |
| C20 | C22 | C25 | H25A | 171.6° | 179.2° |
| C23 | C21 | C24 | H21 | 119.5° | 120.1° |
| C21 | C23 | O26 | N27 | 178.0° | 180.0° |
| C23 | C21 | C24 | N28 | 165.4° | 179.1° |
| C21 | C23 | N27 | C29 | 1.3° | 3.7° |
| C21 | C23 | N27 | C30 | 175.2° | 176.4° |
| C23 | C21 | C20 | H20 | 59.5° | 57.6° |
| C23 | C21 | C24 | H24 | 74.6° | 60.9° |
| C23 | C21 | C24 | H24A | 45.4° | 59.1° |
| C24 | C21 | C23 | O26 | 54.6° | 119.8° |
| C24 | C21 | C23 | N27 | 127.4° | 60.2° |
| C21 | C24 | N28 | H24 | 120.0° | 120.0° |
| C21 | C24 | N28 | H24A | 120.0° | 120.0° |
| C21 | C24 | N28 | C25 | 50.1° | 61.8° |
| C24 | C21 | C20 | H20 | 65.9° | 62.3° |
| C21 | C24 | H24 | H24A | 119.7° | 119.9° |
| C21 | C24 | N28 | HN28 | 69.9° | 62.4° |
| C22 | C25 | N28 | C24 | 56.0° | 61.8° |
| C22 | C25 | N28 | H25 | 120.0° | 120.0° |
| C22 | C25 | N28 | H25A | 120.0° | 120.1° |
| C25 | C22 | C20 | H20 | 66.9° | 62.3° |
| C25 | C22 | H22 | H22A | 119.9° | 120.1° |
| C22 | C25 | H25 | H25A | 119.0° | 119.9° |
| C22 | C25 | N28 | HN28 | 64.0° | 62.4° |
| O26 | C23 | N27 | C29 | 176.7° | 176.3° |
| O26 | C23 | N27 | C30 | 2.8° | 3.6° |
| O26 | C23 | C21 | H21 | 169.4° | 120.1° |
| C23 | N27 | C29 | C30 | 174.2° | 180.0° |
| C23 | N27 | C29 | C31 | 62.6° | 112.3° |
| C23 | N27 | C29 | C32 | 126.3° | 179.1° |
| C23 | N27 | C30 | C33 | 92.4° | 70.6° |
| N27 | C23 | C21 | H21 | 12.7° | 59.9° |
| C23 | N27 | C29 | H29 | 85.4° | 33.4° |
| C23 | N27 | C30 | H30 | 147.6° | 49.4° |
| C23 | N27 | C30 | H30A | 27.6° | 169.4° |
| C24 | N28 | C25 | HN28 | 120.0° | 124.1° |
| N28 | C24 | C21 | H21 | 75.2° | 60.8° |
| N28 | C24 | H24 | H24A | 119.7° | 120.0° |
| C24 | N28 | C25 | H25 | 64.0° | 58.2° |
| C24 | N28 | C25 | H25A | 176.0° | 178.2° |
| N28 | C25 | C22 | H22 | 171.6° | 179.2° |
| N28 | C25 | C22 | H22A | 68.4° | 60.8° |
| C25 | N28 | C24 | H24 | 170.1° | 178.2° |
| C25 | N28 | C24 | H24A | 69.9° | 58.2° |
| N28 | C25 | H25 | H25A | 119.0° | 120.0° |
| N27 | C29 | C31 | C32 | 100.7° | 107.5° |
| N27 | C29 | C31 | H29 | 132.5° | 145.1° |
| N27 | C29 | C32 | H29 | 131.7° | 145.0° |
| C29 | N27 | C30 | C33 | 93.1° | 109.5° |
| C29 | N27 | C30 | H30 | 26.9° | 130.6° |
| C29 | N27 | C30 | H30A | 146.9° | 10.6° |
| N27 | C29 | C31 | H31 | 19.4° | 0.1° |
| N27 | C29 | C31 | H31A | 139.3° | 145.0° |
| N27 | C29 | C32 | H32 | 136.8° | 145.0° |
| N27 | C29 | C32 | H32A | 16.8° | 0.1° |
| C30 | N27 | C29 | C31 | 123.2° | 67.6° |
| C30 | N27 | C29 | C32 | 59.5° | 1.0° |
| N27 | C30 | C33 | H30 | 120.0° | 119.9° |
| N27 | C30 | C33 | H30A | 120.0° | 120.0° |
| N27 | C30 | C33 | C34 | 164.8° | 78.2° |
| N27 | C30 | C33 | C35 | 14.8° | 101.6° |
| C30 | N27 | C29 | H29 | 88.8° | 146.7° |
| N27 | C30 | H30 | H30A | 116.5° | 120.0° |
| C31 | C29 | C32 | H29 | 125.1° | 107.5° |
| C29 | C31 | C32 | H31 | 120.0° | 107.5° |
| C29 | C31 | C32 | H31A | 120.0° | 107.5° |
| C29 | C31 | H31 | H31A | 138.6° | 145.6° |
| C31 | C29 | C32 | H32 | 120.0° | 107.5° |
| C31 | C29 | C32 | H32A | 120.0° | 107.4° |
| C29 | C32 | H32 | H32A | 138.5° | 145.7° |
| C30 | C33 | C34 | C35 | 179.6° | 179.8° |
| C30 | C33 | C34 | CL36 | 0.1° | 0.1° |
| C30 | C33 | C34 | C37 | 179.4° | 180.0° |
| C30 | C33 | C35 | C38 | 179.3° | 180.0° |
| C33 | C30 | H30 | H30A | 116.5° | 120.1° |
| C30 | C33 | C35 | H35 | 0.7° | 0.1° |
| C32 | C31 | H31 | H31A | 138.6° | 145.7° |
| C31 | C32 | H32 | H32A | 138.5° | 145.7° |
| C33 | C34 | CL36 | C37 | 179.3° | 180.0° |
| C34 | C33 | C35 | C38 | 0.3° | 0.2° |
| C33 | C34 | C37 | C39 | 0.1° | 0.0° |
| C34 | C33 | C30 | H30 | 44.8° | 161.9° |
| C34 | C33 | C30 | H30A | 75.2° | 41.8° |
| C34 | C33 | C35 | H35 | 179.7° | 179.7° |
| C33 | C34 | C37 | H37 | 179.8° | 180.0° |
| C35 | C33 | C34 | CL36 | 179.5° | 179.8° |
| C35 | C33 | C34 | C37 | 0.2° | 0.2° |
| C33 | C35 | C38 | H35 | 180.0° | 179.9° |
| C33 | C35 | C38 | C39 | 0.4° | 0.0° |
| C33 | C35 | C38 | C40 | 179.6° | 179.9° |
| C35 | C33 | C30 | H30 | 134.8° | 18.3° |
| C35 | C33 | C30 | H30A | 105.2° | 138.4° |
| CL36 | C34 | C37 | C39 | 179.5° | 180.0° |
| CL36 | C34 | C37 | H37 | 0.5° | 0.1° |
| C34 | C37 | C39 | H37 | 180.0° | 180.0° |
| C34 | C37 | C39 | C38 | 0.2° | 0.2° |
| C34 | C37 | C39 | H39 | 179.7° | 180.0° |
| C35 | C38 | C39 | C37 | 0.4° | 0.2° |
| C35 | C38 | C39 | C40 | 180.0° | 179.9° |
| C35 | C38 | C40 | C41 | 97.1° | 90.0° |
| C35 | C38 | C39 | H39 | 179.6° | 180.0° |
| C35 | C38 | C40 | H40 | 142.9° | 150.0° |
| C35 | C38 | C40 | H40A | 22.9° | 30.0° |
| C37 | C39 | C38 | H39 | 180.0° | 179.8° |
| C37 | C39 | C38 | C40 | 179.6° | 179.7° |
| C39 | C38 | C40 | C41 | 82.8° | 90.1° |
| C39 | C38 | C35 | H35 | 179.6° | 179.9° |
| C38 | C39 | C37 | H37 | 179.7° | 179.8° |
| C39 | C38 | C40 | H40 | 37.2° | 29.9° |
| C39 | C38 | C40 | H40A | 157.2° | 150.0° |
| C38 | C40 | C41 | H40 | 120.0° | 120.0° |
| C38 | C40 | C41 | H40A | 120.0° | 120.0° |
| C38 | C40 | C41 | C42 | 152.8° | 180.0° |
| C40 | C38 | C35 | H35 | 0.4° | 0.0° |
| C40 | C38 | C39 | H39 | 0.4° | 0.1° |
| C38 | C40 | H40 | H40A | 121.3° | 120.0° |
| C38 | C40 | C41 | H41 | 32.8° | 60.0° |
| C38 | C40 | C41 | H41A | 87.2° | 60.0° |
| C40 | C41 | C42 | H41 | 120.0° | 120.0° |
| C40 | C41 | C42 | H41A | 120.0° | 120.0° |
| C40 | C41 | C42 | O43 | 154.9° | 180.0° |
| C41 | C40 | H40 | H40A | 121.3° | 120.0° |
| C40 | C41 | H41 | H41A | 119.9° | 120.1° |
| C40 | C41 | C42 | H42 | 85.1° | 60.0° |
| C40 | C41 | C42 | H42A | 34.9° | 60.0° |
| C41 | C42 | O43 | H42 | 120.0° | 120.0° |
| C41 | C42 | O43 | H42A | 120.0° | 120.0° |
| C41 | C42 | O43 | C44 | 135.7° | 180.0° |
| C42 | C41 | C40 | H40 | 87.2° | 60.0° |
| C42 | C41 | C40 | H40A | 32.7° | 60.0° |
| C42 | C41 | H41 | H41A | 119.9° | 119.9° |
| C41 | C42 | H42 | H42A | 121.0° | 120.0° |
| O43 | C42 | C41 | H41 | 34.9° | 60.0° |
| O43 | C42 | C41 | H41A | 85.1° | 60.0° |
| O43 | C42 | H42 | H42A | 121.0° | 120.0° |
| C42 | O43 | C44 | H44 | 180.0° | 60.0° |
| C42 | O43 | C44 | H44A | 60.0° | 59.9° |
| C42 | O43 | C44 | H44B | 60.0° | 180.0° |
| C44 | O43 | C42 | H42 | 15.7° | 60.0° |
| C44 | O43 | C42 | H42A | 104.3° | 60.0° |
| O43 | C44 | H44 | H44A | 120.0° | 120.0° |
| O43 | C44 | H44 | H44B | 120.0° | 120.0° |
| O43 | C44 | H44A | H44B | 120.0° | 120.1° |
| H8 | C8 | C12 | H12 | 93.7° | 65.0° |
| H8 | C8 | C12 | H12A | 146.3° | 175.0° |
| H8A | C8 | C12 | H12 | 26.3° | 54.9° |
| H8A | C8 | C12 | H12A | 93.7° | 65.0° |
| H11 | C11 | H11A | H11B | 120.0° | 120.0° |
| H15 | C15 | C17 | H17 | 0.7° | 0.0° |
| H16 | C16 | C18 | H18 | 0.4° | 0.0° |
| H20 | C20 | C21 | H21 | 179.4° | 177.7° |
| H20 | C20 | C22 | H22 | 53.1° | 57.7° |
| H20 | C20 | C22 | H22A | 173.1° | 177.7° |
| H21 | C21 | C24 | H24 | 44.8° | 59.3° |
| H21 | C21 | C24 | H24A | 164.9° | 179.2° |
| H22 | C22 | C25 | H25 | 51.6° | 59.1° |
| H22 | C22 | C25 | H25A | 68.4° | 60.8° |
| H22A | C22 | C25 | H25 | 171.6° | 179.2° |
| H22A | C22 | C25 | H25A | 51.6° | 59.3° |
| H24 | C24 | N28 | HN28 | 50.1° | 57.6° |
| H24A | C24 | N28 | HN28 | 170.1° | 177.6° |
| H25 | C25 | N28 | HN28 | 176.0° | 177.6° |
| H25A | C25 | N28 | HN28 | 56.0° | 57.7° |
| H29 | C29 | C31 | H31 | 113.2° | 145.0° |
| H29 | C29 | C31 | H31A | 6.8° | 0.1° |
| H29 | C29 | C32 | H32 | 5.1° | 0.0° |
| H29 | C29 | C32 | H32A | 114.9° | 145.1° |
| H31 | C31 | C32 | H32 | 120.0° | 145.0° |
| H31 | C31 | C32 | H32A | 0.0° | 0.0° |
| H31A | C31 | C32 | H32 | 0.1° | 0.0° |
| H31A | C31 | C32 | H32A | 120.0° | 145.0° |
| H37 | C37 | C39 | H39 | 0.3° | 0.0° |
| H40 | C40 | C41 | H41 | 152.8° | 180.0° |
| H40 | C40 | C41 | H41A | 32.8° | 60.0° |
| H40A | C40 | C41 | H41 | 87.2° | 60.0° |
| H40A | C40 | C41 | H41A | 152.8° | 180.0° |
| H41 | C41 | C42 | H42 | 154.9° | 179.9° |
| H41 | C41 | C42 | H42A | 85.1° | 60.0° |
| H41A | C41 | C42 | H42 | 34.9° | 60.0° |
| H41A | C41 | C42 | H42A | 154.9° | 180.0° |
| H44 | C44 | H44A | H44B | 120.0° | 119.9° |
