L3W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N46 | C44 | sing | 1.35Å | 1.37Å | |
| O45 | C44 | doub | 1.22Å | 1.22Å | |
| C44 | C43 | sing | 1.46Å | 1.49Å | |
| C43 | O47 | sing | 1.36Å | 1.37Å | |
| C43 | C42 | doub | 1.36Å | 1.35Å | |
| C42 | C41 | sing | 1.41Å | 1.45Å | |
| C41 | C40 | doub | 1.35Å | 1.34Å | |
| C40 | N39 | sing | 1.38Å | 1.43Å | |
| N39 | C36 | sing | 1.46Å | 1.51Å | |
| N39 | C48 | sing | 1.35Å | 1.46Å | |
| C36 | O38 | sing | 1.44Å | 1.43Å | |
| C36 | C34 | sing | 1.55Å | 1.54Å | |
| C48 | O49 | doub | 1.21Å | 1.22Å | |
| O50 | C34 | sing | 1.43Å | 1.42Å | |
| O38 | C30 | sing | 1.44Å | 1.41Å | |
| C34 | C32 | sing | 1.54Å | 1.54Å | |
| O52 | C14 | sing | 1.43Å | 1.42Å | |
| C30 | C32 | sing | 1.54Å | 1.52Å | |
| C30 | C29 | sing | 1.53Å | 1.52Å | |
| C32 | O51 | sing | 1.43Å | 1.41Å | |
| O28 | C29 | sing | 1.43Å | 1.43Å | |
| O28 | P25 | sing | 1.61Å | 1.63Å | |
| O27 | P25 | doub | 1.48Å | 1.50Å | |
| C14 | C16 | sing | 1.54Å | 1.52Å | |
| C14 | C12 | sing | 1.55Å | 1.52Å | |
| C16 | C19 | sing | 1.53Å | 1.52Å | |
| C16 | O18 | sing | 1.44Å | 1.42Å | |
| P25 | O26 | sing | 1.61Å | 1.51Å | |
| P25 | O24 | sing | 1.61Å | 1.62Å | |
| O53 | C12 | sing | 1.43Å | 1.42Å | |
| C19 | O20 | sing | 1.43Å | 1.43Å | |
| C12 | C10 | sing | 1.55Å | 1.51Å | |
| O18 | C10 | sing | 1.44Å | 1.43Å | |
| O24 | P21 | sing | 1.61Å | 1.63Å | |
| C10 | N7 | sing | 1.46Å | 1.45Å | |
| O20 | P21 | sing | 1.61Å | 1.64Å | |
| P21 | O23 | doub | 1.48Å | 1.51Å | |
| P21 | O22 | sing | 1.61Å | 1.50Å | |
| N7 | C5 | sing | 1.37Å | 1.37Å | Aromatic |
| N7 | C8 | sing | 1.36Å | 1.37Å | Aromatic |
| N6 | C5 | doub | 1.33Å | 1.33Å | Aromatic |
| N6 | C1 | sing | 1.32Å | 1.34Å | Aromatic |
| C5 | C4 | sing | 1.40Å | 1.39Å | Aromatic |
| C1 | N2 | doub | 1.32Å | 1.34Å | Aromatic |
| C8 | N9 | doub | 1.30Å | 1.32Å | Aromatic |
| C4 | N9 | sing | 1.36Å | 1.37Å | Aromatic |
| C4 | C3 | doub | 1.40Å | 1.38Å | Aromatic |
| N2 | C3 | sing | 1.33Å | 1.34Å | Aromatic |
| C3 | N54 | sing | 1.38Å | 1.39Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C8 | H2 | sing | 1.08Å | 1.08Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C14 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C19 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C30 | H9 | sing | 1.09Å | 1.10Å | |
| C32 | H10 | sing | 1.09Å | 1.10Å | |
| C34 | H11 | sing | 1.09Å | 1.10Å | |
| O22 | H12 | sing | 0.97Å | 0.95Å | |
| O26 | H13 | sing | 0.97Å | 0.95Å | |
| C29 | H14 | sing | 1.09Å | 1.10Å | |
| C29 | H15 | sing | 1.09Å | 1.10Å | |
| C36 | H16 | sing | 1.09Å | 1.10Å | |
| C40 | H17 | sing | 1.08Å | 1.08Å | |
| C41 | H18 | sing | 1.08Å | 1.08Å | |
| C42 | H19 | sing | 1.08Å | 1.08Å | |
| N46 | H20 | sing | 0.97Å | 1.00Å | |
| N46 | H21 | sing | 0.97Å | 1.00Å | |
| O47 | H22 | sing | 0.97Å | 0.95Å | |
| C48 | H23 | sing | 1.08Å | 1.08Å | |
| O50 | H24 | sing | 0.97Å | 0.95Å | |
| O51 | H25 | sing | 0.97Å | 0.95Å | |
| O52 | H26 | sing | 0.97Å | 0.95Å | |
| O53 | H27 | sing | 0.97Å | 0.95Å | |
| N54 | H28 | sing | 0.97Å | 1.00Å | |
| N54 | H29 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N46 | C44 | O45 | 123.6° | 120.0° |
| N46 | C44 | C43 | 112.6° | 120.0° |
| C44 | N46 | H20 | 120.0° | 120.0° |
| C44 | N46 | H21 | 120.0° | 120.0° |
| O45 | C44 | C43 | 123.8° | 119.9° |
| C44 | C43 | O47 | 117.8° | 120.0° |
| C44 | C43 | C42 | 117.7° | 120.0° |
| O47 | C43 | C42 | 124.5° | 120.0° |
| C43 | O47 | H22 | 109.5° | 114.0° |
| C43 | C42 | C41 | 125.9° | 120.0° |
| C43 | C42 | H19 | 117.0° | 120.0° |
| C42 | C41 | C40 | 124.2° | 120.0° |
| C42 | C41 | H18 | 117.9° | 120.0° |
| C41 | C42 | H19 | 117.0° | 120.0° |
| C41 | C40 | N39 | 123.6° | 120.0° |
| C41 | C40 | H17 | 118.2° | 120.0° |
| C40 | C41 | H18 | 117.9° | 120.0° |
| C40 | N39 | C36 | 113.8° | 120.0° |
| C40 | N39 | C48 | 113.2° | 120.0° |
| N39 | C40 | H17 | 118.2° | 120.0° |
| C36 | N39 | C48 | 113.0° | 120.0° |
| N39 | C36 | O38 | 107.6° | 110.4° |
| N39 | C36 | C34 | 118.3° | 110.4° |
| N39 | C36 | H16 | 108.0° | 110.4° |
| N39 | C48 | O49 | 119.4° | 120.0° |
| N39 | C48 | H23 | 120.3° | 120.0° |
| O38 | C36 | C34 | 106.0° | 104.8° |
| C36 | O38 | C30 | 111.7° | 105.3° |
| O38 | C36 | H16 | 109.0° | 110.4° |
| C36 | C34 | O50 | 108.9° | 110.6° |
| C36 | C34 | C32 | 104.1° | 104.1° |
| C36 | C34 | H11 | 111.0° | 110.5° |
| C34 | C36 | H16 | 107.6° | 110.4° |
| O49 | C48 | H23 | 120.3° | 120.0° |
| O50 | C34 | C32 | 108.8° | 110.5° |
| O50 | C34 | H11 | 112.7° | 110.5° |
| C34 | O50 | H24 | 109.5° | 114.0° |
| O38 | C30 | C32 | 104.1° | 104.8° |
| O38 | C30 | C29 | 107.1° | 110.4° |
| O38 | C30 | H9 | 112.1° | 110.4° |
| C34 | C32 | C30 | 104.7° | 104.1° |
| C34 | C32 | O51 | 110.7° | 110.5° |
| C34 | C32 | H10 | 110.7° | 110.6° |
| C32 | C34 | H11 | 111.0° | 110.5° |
| O52 | C14 | C16 | 106.7° | 110.4° |
| O52 | C14 | C12 | 111.1° | 110.6° |
| O52 | C14 | H5 | 112.8° | 110.6° |
| C14 | O52 | H26 | 109.5° | 114.0° |
| C32 | C30 | C29 | 112.4° | 110.4° |
| C30 | C32 | O51 | 106.7° | 110.5° |
| C32 | C30 | H9 | 110.5° | 110.4° |
| C30 | C32 | H10 | 111.0° | 110.5° |
| C30 | C29 | O28 | 108.1° | 109.5° |
| C29 | C30 | H9 | 110.5° | 110.3° |
| C30 | C29 | H14 | 109.8° | 109.4° |
| C30 | C29 | H15 | 109.8° | 109.5° |
| O51 | C32 | H10 | 112.7° | 110.4° |
| C32 | O51 | H25 | 109.5° | 114.0° |
| C29 | O28 | P25 | 120.6° | 123.0° |
| O28 | C29 | H14 | 109.8° | 109.5° |
| O28 | C29 | H15 | 109.8° | 109.4° |
| O28 | P25 | O27 | 110.5° | 109.5° |
| O28 | P25 | O26 | 107.5° | 109.5° |
| O28 | P25 | O24 | 96.6° | 109.5° |
| O27 | P25 | O26 | 118.3° | 109.5° |
| O27 | P25 | O24 | 110.2° | 109.4° |
| C16 | C14 | C12 | 103.4° | 104.2° |
| C14 | C16 | C19 | 111.7° | 109.9° |
| C14 | C16 | O18 | 105.7° | 107.4° |
| C16 | C14 | H5 | 111.1° | 110.5° |
| C14 | C16 | H6 | 109.2° | 109.9° |
| C14 | C12 | O53 | 113.5° | 110.9° |
| C14 | C12 | C10 | 102.1° | 102.1° |
| C14 | C12 | H4 | 109.9° | 110.9° |
| C12 | C14 | H5 | 111.2° | 110.4° |
| C19 | C16 | O18 | 110.6° | 109.9° |
| C16 | C19 | O20 | 109.9° | 109.5° |
| C19 | C16 | H6 | 109.1° | 109.9° |
| C16 | C19 | H7 | 109.3° | 109.5° |
| C16 | C19 | H8 | 109.4° | 109.6° |
| C16 | O18 | C10 | 111.2° | 106.9° |
| O18 | C16 | H6 | 110.5° | 109.9° |
| O26 | P25 | O24 | 111.6° | 109.5° |
| P25 | O26 | H13 | 109.5° | 114.0° |
| P25 | O24 | P21 | 133.6° | 134.0° |
| O53 | C12 | C10 | 109.6° | 110.9° |
| O53 | C12 | H4 | 111.3° | 110.8° |
| C12 | O53 | H27 | 109.5° | 114.0° |
| C19 | O20 | P21 | 122.3° | 123.0° |
| O20 | C19 | H7 | 109.4° | 109.4° |
| O20 | C19 | H8 | 109.3° | 109.5° |
| C12 | C10 | O18 | 104.9° | 103.6° |
| C12 | C10 | N7 | 111.8° | 110.6° |
| C12 | C10 | H3 | 109.2° | 110.6° |
| C10 | C12 | H4 | 110.0° | 110.9° |
| O18 | C10 | N7 | 110.2° | 110.7° |
| O18 | C10 | H3 | 110.5° | 110.6° |
| O24 | P21 | O20 | 104.1° | 109.5° |
| O24 | P21 | O23 | 103.6° | 109.5° |
| O24 | P21 | O22 | 109.5° | 109.5° |
| C10 | N7 | C5 | 127.8° | 126.3° |
| C10 | N7 | C8 | 125.9° | 126.3° |
| N7 | C10 | H3 | 110.1° | 110.6° |
| O20 | P21 | O23 | 108.6° | 109.5° |
| O20 | P21 | O22 | 108.2° | 109.5° |
| O23 | P21 | O22 | 121.4° | 109.4° |
| P21 | O22 | H12 | 109.5° | 114.0° |
| C5 | N7 | C8 | 106.2° | 107.4° |
| N7 | C5 | N6 | 127.7° | 134.9° |
| N7 | C5 | C4 | 105.4° | 106.0° |
| N7 | C8 | N9 | 113.2° | 110.0° |
| N7 | C8 | H2 | 123.4° | 125.0° |
| C5 | N6 | C1 | 110.5° | 120.7° |
| N6 | C5 | C4 | 126.9° | 119.0° |
| N6 | C1 | N2 | 128.5° | 122.5° |
| N6 | C1 | H1 | 115.7° | 118.7° |
| C5 | C4 | N9 | 111.1° | 107.1° |
| C5 | C4 | C3 | 116.8° | 118.2° |
| C1 | N2 | C3 | 118.8° | 121.2° |
| N2 | C1 | H1 | 115.7° | 118.8° |
| C8 | N9 | C4 | 104.1° | 109.4° |
| N9 | C8 | H2 | 123.4° | 125.0° |
| N9 | C4 | C3 | 132.1° | 134.7° |
| C4 | C3 | N2 | 118.5° | 118.4° |
| C4 | C3 | N54 | 121.0° | 120.8° |
| N2 | C3 | N54 | 120.5° | 120.8° |
| C3 | N54 | H28 | 109.5° | 120.0° |
| C3 | N54 | H29 | 109.5° | 120.0° |
| H7 | C19 | H8 | 109.5° | 109.4° |
| H14 | C29 | H15 | 109.5° | 109.5° |
| H20 | N46 | H21 | 120.0° | 119.9° |
| H28 | N54 | H29 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N46 | C44 | O45 | C43 | 179.4° | 180.0° |
| N46 | C44 | C43 | O47 | 2.5° | 0.0° |
| N46 | C44 | C43 | C42 | 177.2° | 180.0° |
| C44 | N46 | H20 | H21 | 180.0° | 179.9° |
| O45 | C44 | C43 | O47 | 178.0° | 180.0° |
| O45 | C44 | C43 | C42 | 2.2° | 0.0° |
| O45 | C44 | N46 | H20 | 0.0° | 180.0° |
| O45 | C44 | N46 | H21 | 180.0° | 0.0° |
| C44 | C43 | O47 | C42 | 179.7° | 180.0° |
| C44 | C43 | C42 | C41 | 176.1° | 180.0° |
| C44 | C43 | C42 | H19 | 3.8° | 0.0° |
| C43 | C44 | N46 | H20 | 179.5° | 0.1° |
| C43 | C44 | N46 | H21 | 0.6° | 180.0° |
| C44 | C43 | O47 | H22 | 180.0° | 0.0° |
| O47 | C43 | C42 | C41 | 3.6° | 0.0° |
| O47 | C43 | C42 | H19 | 176.4° | 180.0° |
| C43 | C42 | C41 | H19 | 180.0° | 180.0° |
| C43 | C42 | C41 | C40 | 164.1° | 180.0° |
| C43 | C42 | C41 | H18 | 15.9° | 0.0° |
| C42 | C43 | O47 | H22 | 0.3° | 180.0° |
| C42 | C41 | C40 | H18 | 180.0° | 180.0° |
| C42 | C41 | C40 | N39 | 175.0° | 174.3° |
| C42 | C41 | C40 | H17 | 5.0° | 5.7° |
| C41 | C40 | N39 | H17 | 180.0° | 180.0° |
| C41 | C40 | N39 | C36 | 54.1° | 4.8° |
| C41 | C40 | N39 | C48 | 174.9° | 175.3° |
| C40 | C41 | C42 | H19 | 15.9° | 0.0° |
| C40 | N39 | C36 | C48 | 131.1° | 179.9° |
| C40 | N39 | C36 | O38 | 135.8° | 131.4° |
| C40 | N39 | C36 | C34 | 104.2° | 113.2° |
| C40 | N39 | C48 | O49 | 170.2° | 5.2° |
| C40 | N39 | C36 | H16 | 18.2° | 9.1° |
| N39 | C40 | C41 | H18 | 5.0° | 5.7° |
| C40 | N39 | C48 | H23 | 9.8° | 174.9° |
| N39 | C36 | O38 | C34 | 127.6° | 118.8° |
| N39 | C36 | O38 | H16 | 116.9° | 122.4° |
| N39 | C36 | C34 | H16 | 122.6° | 122.4° |
| C36 | N39 | C48 | O49 | 58.4° | 174.9° |
| N39 | C36 | C34 | O50 | 125.2° | 98.5° |
| N39 | C36 | O38 | C30 | 145.4° | 159.3° |
| N39 | C36 | C34 | C32 | 118.9° | 142.8° |
| N39 | C36 | C34 | H11 | 0.6° | 24.2° |
| C36 | N39 | C40 | H17 | 125.9° | 175.2° |
| C36 | N39 | C48 | H23 | 121.6° | 5.1° |
| C48 | N39 | C36 | O38 | 93.2° | 48.6° |
| C48 | N39 | C36 | C34 | 26.9° | 66.7° |
| N39 | C48 | O49 | H23 | 180.0° | 179.9° |
| C48 | N39 | C36 | H16 | 149.3° | 171.0° |
| C48 | N39 | C40 | H17 | 5.1° | 4.7° |
| O38 | C36 | C34 | H16 | 116.5° | 118.8° |
| O38 | C36 | C34 | O50 | 113.9° | 142.7° |
| O38 | C36 | C34 | C32 | 2.0° | 24.0° |
| C36 | O38 | C30 | C32 | 30.2° | 40.5° |
| C36 | O38 | C30 | C29 | 149.4° | 159.4° |
| C36 | O38 | C30 | H9 | 89.3° | 78.4° |
| O38 | C36 | C34 | H11 | 121.4° | 94.7° |
| C36 | C34 | O50 | C32 | 112.8° | 114.7° |
| C36 | C34 | O50 | H11 | 123.6° | 122.7° |
| C34 | C36 | O38 | C30 | 17.9° | 40.5° |
| C36 | C34 | C32 | H11 | 119.4° | 118.6° |
| C36 | C34 | C32 | C30 | 19.1° | 0.0° |
| C36 | C34 | C32 | O51 | 133.7° | 118.6° |
| C36 | C34 | C32 | H10 | 100.6° | 118.7° |
| C36 | C34 | O50 | H24 | 180.0° | 176.2° |
| O50 | C34 | C32 | H11 | 124.6° | 122.6° |
| O50 | C34 | C32 | C30 | 96.9° | 118.8° |
| O50 | C34 | C32 | O51 | 17.7° | 0.1° |
| O50 | C34 | C32 | H10 | 143.4° | 122.5° |
| O50 | C34 | C36 | H16 | 2.6° | 23.9° |
| O38 | C30 | C32 | C34 | 29.6° | 24.0° |
| O38 | C30 | C32 | C29 | 115.6° | 118.8° |
| O38 | C30 | C32 | H9 | 120.6° | 118.9° |
| O38 | C30 | C29 | H9 | 122.4° | 122.3° |
| O38 | C30 | C32 | O51 | 147.1° | 142.7° |
| O38 | C30 | C29 | O28 | 60.6° | 69.6° |
| O38 | C30 | C32 | H10 | 89.8° | 94.8° |
| O38 | C30 | C29 | H14 | 179.6° | 50.4° |
| O38 | C30 | C29 | H15 | 59.2° | 170.4° |
| C30 | O38 | C36 | H16 | 97.7° | 78.3° |
| C34 | C32 | C30 | O51 | 117.4° | 118.7° |
| C34 | C32 | C30 | H10 | 119.5° | 118.8° |
| C34 | C32 | C30 | C29 | 145.2° | 142.8° |
| C34 | C32 | O51 | H10 | 124.6° | 122.8° |
| C34 | C32 | C30 | H9 | 90.9° | 94.9° |
| C32 | C34 | C36 | H16 | 118.6° | 94.8° |
| C32 | C34 | O50 | H24 | 67.2° | 61.5° |
| C34 | C32 | O51 | H25 | 180.0° | 65.3° |
| O52 | C14 | C16 | C12 | 117.3° | 118.8° |
| O52 | C14 | C16 | H5 | 123.3° | 122.7° |
| O52 | C14 | C12 | H5 | 126.5° | 122.7° |
| O52 | C14 | C16 | C19 | 145.8° | 119.8° |
| O52 | C14 | C16 | O18 | 93.9° | 120.7° |
| O52 | C14 | C12 | O53 | 37.9° | 20.4° |
| O52 | C14 | C12 | C10 | 80.0° | 97.8° |
| O52 | C14 | C12 | H4 | 163.4° | 143.9° |
| O52 | C14 | C16 | H6 | 24.9° | 1.2° |
| C32 | C30 | C29 | H9 | 123.9° | 122.3° |
| C30 | C32 | O51 | H10 | 122.1° | 122.6° |
| C32 | C30 | C29 | O28 | 174.3° | 175.0° |
| C30 | C32 | C34 | H11 | 138.5° | 118.6° |
| C32 | C30 | C29 | H14 | 65.9° | 65.0° |
| C32 | C30 | C29 | H15 | 54.5° | 55.0° |
| C30 | C32 | O51 | H25 | 66.6° | 180.0° |
| C29 | C30 | C32 | O51 | 97.4° | 98.5° |
| C30 | C29 | O28 | H14 | 119.8° | 120.0° |
| C30 | C29 | O28 | H15 | 119.8° | 120.0° |
| C30 | C29 | O28 | P25 | 165.5° | 180.0° |
| C29 | C30 | C32 | H10 | 25.7° | 24.0° |
| C30 | C29 | H14 | H15 | 120.6° | 120.0° |
| O51 | C32 | C30 | H9 | 26.5° | 23.7° |
| O51 | C32 | C34 | H11 | 106.9° | 122.7° |
| C29 | O28 | P25 | O27 | 177.7° | 55.0° |
| C29 | O28 | P25 | O26 | 47.3° | 65.0° |
| C29 | O28 | P25 | O24 | 67.8° | 175.0° |
| O28 | C29 | C30 | H9 | 61.8° | 52.7° |
| O28 | C29 | H14 | H15 | 120.7° | 120.0° |
| O28 | P25 | O27 | O26 | 124.5° | 120.0° |
| O28 | P25 | O27 | O24 | 105.5° | 120.0° |
| O28 | P25 | O26 | O24 | 104.7° | 120.0° |
| O28 | P25 | O24 | P21 | 174.1° | 160.0° |
| O28 | P25 | O26 | H13 | 125.9° | 60.0° |
| P25 | O28 | C29 | H14 | 45.7° | 60.0° |
| P25 | O28 | C29 | H15 | 74.8° | 60.0° |
| O27 | P25 | O26 | O24 | 129.4° | 120.0° |
| O27 | P25 | O24 | P21 | 59.4° | 40.1° |
| O27 | P25 | O26 | H13 | 0.0° | 180.0° |
| C16 | C14 | C12 | H5 | 119.4° | 118.6° |
| C14 | C16 | C19 | O18 | 117.4° | 117.9° |
| C14 | C16 | C19 | H6 | 120.8° | 121.0° |
| C14 | C16 | O18 | H6 | 118.0° | 119.5° |
| C16 | C14 | C12 | O53 | 152.0° | 139.1° |
| C14 | C16 | C19 | O20 | 53.2° | 175.0° |
| C16 | C14 | C12 | C10 | 34.2° | 20.9° |
| C14 | C16 | O18 | C10 | 2.4° | 26.3° |
| C16 | C14 | C12 | H4 | 82.5° | 97.4° |
| C14 | C16 | C19 | H7 | 173.3° | 55.1° |
| C14 | C16 | C19 | H8 | 66.8° | 64.9° |
| C16 | C14 | O52 | H26 | 180.0° | 180.0° |
| C12 | C14 | C16 | C19 | 97.0° | 121.4° |
| C12 | C14 | C16 | O18 | 23.3° | 1.9° |
| C14 | C12 | O53 | C10 | 113.4° | 112.7° |
| C14 | C12 | O53 | H4 | 124.7° | 123.6° |
| C14 | C12 | C10 | H4 | 116.6° | 118.2° |
| C14 | C12 | C10 | O18 | 33.2° | 36.9° |
| C14 | C12 | C10 | N7 | 152.6° | 155.5° |
| C14 | C12 | C10 | H3 | 85.2° | 81.6° |
| C12 | C14 | C16 | H6 | 142.2° | 117.5° |
| C12 | C14 | O52 | H26 | 68.0° | 65.2° |
| C14 | C12 | O53 | H27 | 180.0° | 67.3° |
| C19 | C16 | O18 | H6 | 120.9° | 121.1° |
| C16 | C19 | O20 | H7 | 120.0° | 120.0° |
| C16 | C19 | O20 | H8 | 120.1° | 120.1° |
| C19 | C16 | O18 | C10 | 118.7° | 145.7° |
| C16 | C19 | O20 | P21 | 175.6° | 180.0° |
| C19 | C16 | C14 | H5 | 22.4° | 2.8° |
| C16 | C19 | H7 | H8 | 119.8° | 120.1° |
| O18 | C16 | C19 | O20 | 64.2° | 67.0° |
| C16 | O18 | C10 | C12 | 19.7° | 39.8° |
| C16 | O18 | C10 | N7 | 140.1° | 158.4° |
| C16 | O18 | C10 | H3 | 97.9° | 78.7° |
| O18 | C16 | C14 | H5 | 142.7° | 116.7° |
| O18 | C16 | C19 | H7 | 55.9° | 173.0° |
| O18 | C16 | C19 | H8 | 175.8° | 53.0° |
| O26 | P25 | O24 | P21 | 74.1° | 80.0° |
| P25 | O24 | P21 | O20 | 76.8° | 160.0° |
| P25 | O24 | P21 | O23 | 169.6° | 39.9° |
| P25 | O24 | P21 | O22 | 38.7° | 80.0° |
| O24 | P25 | O26 | H13 | 129.3° | 60.0° |
| O53 | C12 | C10 | H4 | 122.7° | 123.6° |
| O53 | C12 | C10 | O18 | 153.9° | 155.1° |
| O53 | C12 | C10 | N7 | 86.7° | 86.3° |
| O53 | C12 | C10 | H3 | 35.4° | 36.6° |
| O53 | C12 | C14 | H5 | 88.6° | 102.3° |
| C19 | O20 | P21 | O24 | 48.6° | 175.0° |
| C19 | O20 | P21 | O23 | 61.3° | 55.0° |
| C19 | O20 | P21 | O22 | 165.0° | 65.0° |
| O20 | C19 | C16 | H6 | 174.1° | 54.0° |
| O20 | C19 | H7 | H8 | 119.8° | 119.9° |
| C12 | C10 | O18 | N7 | 120.5° | 118.6° |
| C12 | C10 | O18 | H3 | 117.6° | 118.6° |
| C12 | C10 | N7 | H3 | 121.6° | 122.9° |
| C12 | C10 | N7 | C5 | 106.5° | 87.2° |
| C12 | C10 | N7 | C8 | 71.8° | 92.9° |
| C10 | C12 | C14 | H5 | 153.5° | 139.5° |
| C10 | C12 | O53 | H27 | 66.6° | 180.0° |
| O18 | C10 | N7 | H3 | 122.1° | 122.9° |
| O18 | C10 | N7 | C5 | 137.2° | 158.6° |
| O18 | C10 | N7 | C8 | 44.5° | 21.4° |
| O18 | C10 | C12 | H4 | 83.4° | 81.3° |
| C10 | O18 | C16 | H6 | 120.4° | 93.2° |
| O24 | P21 | O20 | O23 | 109.9° | 120.0° |
| O24 | P21 | O20 | O22 | 116.4° | 120.0° |
| O24 | P21 | O23 | O22 | 123.4° | 120.0° |
| O24 | P21 | O22 | H12 | 120.6° | 60.0° |
| C10 | N7 | C5 | C8 | 178.6° | 179.9° |
| C10 | N7 | C5 | N6 | 1.7° | 0.0° |
| C10 | N7 | C5 | C4 | 179.5° | 179.9° |
| C10 | N7 | C8 | N9 | 179.0° | 180.0° |
| C10 | N7 | C8 | H2 | 1.0° | 0.1° |
| N7 | C10 | C12 | H4 | 36.0° | 37.3° |
| O20 | P21 | O23 | O22 | 126.3° | 120.0° |
| P21 | O20 | C19 | H7 | 64.4° | 60.0° |
| P21 | O20 | C19 | H8 | 55.5° | 59.9° |
| O20 | P21 | O22 | H12 | 126.5° | 60.1° |
| O23 | P21 | O22 | H12 | 0.0° | 179.9° |
| N7 | C5 | N6 | C4 | 178.7° | 179.9° |
| N7 | C5 | N6 | C1 | 179.5° | 180.0° |
| C5 | N7 | C8 | N9 | 0.4° | 0.0° |
| N7 | C5 | C4 | N9 | 1.1° | 0.0° |
| N7 | C5 | C4 | C3 | 179.9° | 179.8° |
| C5 | N7 | C8 | H2 | 179.6° | 180.0° |
| C5 | N7 | C10 | H3 | 15.1° | 35.7° |
| C8 | N7 | C5 | N6 | 179.8° | 179.9° |
| C8 | N7 | C5 | C4 | 0.9° | 0.0° |
| N7 | C8 | N9 | H2 | 180.0° | 179.9° |
| N7 | C8 | N9 | C4 | 0.3° | 0.1° |
| C8 | N7 | C10 | H3 | 166.6° | 144.3° |
| C5 | N6 | C1 | N2 | 0.5° | 0.1° |
| N6 | C5 | C4 | N9 | 180.0° | 180.0° |
| N6 | C5 | C4 | C3 | 1.0° | 0.2° |
| C5 | N6 | C1 | H1 | 179.5° | 179.7° |
| C1 | N6 | C5 | C4 | 0.8° | 0.1° |
| N6 | C1 | N2 | H1 | 180.0° | 179.8° |
| N6 | C1 | N2 | C3 | 0.3° | 0.2° |
| C5 | C4 | N9 | C8 | 0.9° | 0.1° |
| C5 | C4 | N9 | C3 | 178.8° | 179.8° |
| C5 | C4 | C3 | N2 | 0.7° | 0.4° |
| C5 | C4 | C3 | N54 | 179.3° | 179.9° |
| C1 | N2 | C3 | C4 | 0.4° | 0.5° |
| C1 | N2 | C3 | N54 | 179.6° | 180.0° |
| C8 | N9 | C4 | C3 | 179.7° | 179.7° |
| N9 | C4 | C3 | N2 | 179.5° | 179.8° |
| N9 | C4 | C3 | N54 | 0.5° | 0.3° |
| C4 | N9 | C8 | H2 | 179.7° | 180.0° |
| C4 | C3 | N2 | N54 | 180.0° | 179.5° |
| C4 | C3 | N54 | H28 | 180.0° | 179.5° |
| C4 | C3 | N54 | H29 | 60.0° | 0.5° |
| C3 | N2 | C1 | H1 | 179.7° | 180.0° |
| N2 | C3 | N54 | H28 | 0.0° | 0.0° |
| N2 | C3 | N54 | H29 | 120.0° | 180.0° |
| C3 | N54 | H28 | H29 | 120.0° | 180.0° |
| H3 | C10 | C12 | H4 | 158.1° | 160.2° |
| H4 | C12 | C14 | H5 | 36.8° | 21.3° |
| H4 | C12 | O53 | H27 | 55.3° | 56.3° |
| H5 | C14 | C16 | H6 | 98.4° | 123.9° |
| H5 | C14 | O52 | H26 | 57.7° | 57.4° |
| H6 | C16 | C19 | H7 | 65.9° | 66.0° |
| H6 | C16 | C19 | H8 | 54.0° | 174.1° |
| H9 | C30 | C32 | H10 | 149.6° | 146.3° |
| H9 | C30 | C29 | H14 | 58.0° | 172.7° |
| H9 | C30 | C29 | H15 | 178.4° | 67.3° |
| H10 | C32 | C34 | H11 | 18.8° | 0.1° |
| H10 | C32 | O51 | H25 | 55.5° | 57.4° |
| H11 | C34 | C36 | H16 | 122.0° | 146.5° |
| H11 | C34 | O50 | H24 | 56.4° | 61.1° |
| H17 | C40 | C41 | H18 | 175.0° | 174.3° |
| H18 | C41 | C42 | H19 | 164.1° | 180.0° |
