382
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C1 | C6 | sing | 1.53Å | 1.54Å | |
| C1 | H11 | sing | 1.09Å | 1.11Å | |
| C1 | H12 | sing | 1.09Å | 1.12Å | |
| C2 | N3 | sing | 1.47Å | 1.49Å | |
| C2 | H21 | sing | 1.09Å | 1.12Å | |
| C2 | H22 | sing | 1.09Å | 1.11Å | |
| N3 | C4 | sing | 1.47Å | 1.49Å | |
| N3 | HN3 | sing | 1.01Å | 1.02Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C15 | sing | 1.53Å | 1.55Å | |
| C4 | H4 | sing | 1.09Å | 1.12Å | |
| C5 | C6 | sing | 1.53Å | 1.55Å | |
| C5 | H51 | sing | 1.09Å | 1.12Å | |
| C5 | H52A | sing | 1.09Å | 1.11Å | |
| C6 | H61 | sing | 1.09Å | 1.11Å | |
| C6 | H62 | sing | 1.09Å | 1.12Å | |
| C15 | F17 | sing | 1.40Å | 1.36Å | |
| C15 | F18 | sing | 1.40Å | 1.36Å | |
| C15 | C19 | sing | 1.53Å | 1.53Å | |
| C19 | N20 | sing | 1.46Å | 1.48Å | |
| C19 | H191 | sing | 1.09Å | 1.12Å | |
| C19 | H192 | sing | 1.09Å | 1.12Å | |
| N20 | C23 | sing | 1.39Å | 1.42Å | |
| N20 | H20 | sing | 0.97Å | 1.02Å | |
| C23 | C24 | sing | 1.40Å | 1.44Å | Aromatic |
| C23 | N28 | doub | 1.32Å | 1.42Å | Aromatic |
| C24 | C25 | doub | 1.40Å | 1.42Å | Aromatic |
| C24 | N31 | sing | 1.36Å | 1.39Å | Aromatic |
| C25 | C26 | sing | 1.39Å | 1.48Å | Aromatic |
| C25 | O33 | sing | 1.35Å | 1.37Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.48Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.10Å | |
| C27 | N28 | sing | 1.32Å | 1.41Å | Aromatic |
| C27 | H27 | sing | 1.08Å | 1.10Å | |
| N31 | C32 | doub | 1.30Å | 1.39Å | Aromatic |
| C32 | O33 | sing | 1.34Å | 1.39Å | Aromatic |
| C32 | C34 | sing | 1.51Å | 1.54Å | |
| C34 | C36 | sing | 1.51Å | 1.53Å | |
| C34 | H341 | sing | 1.09Å | 1.12Å | |
| C34 | H342 | sing | 1.09Å | 1.12Å | |
| C36 | C39 | doub | 1.38Å | 1.47Å | Aromatic |
| C36 | C43 | sing | 1.39Å | 1.47Å | Aromatic |
| C39 | C40 | sing | 1.38Å | 1.47Å | Aromatic |
| C39 | H39 | sing | 1.08Å | 1.10Å | |
| C40 | C41 | doub | 1.38Å | 1.48Å | Aromatic |
| C40 | H40 | sing | 1.08Å | 1.10Å | |
| C41 | C42 | sing | 1.38Å | 1.48Å | Aromatic |
| C41 | H41 | sing | 1.08Å | 1.10Å | |
| C42 | C43 | doub | 1.39Å | 1.47Å | Aromatic |
| C42 | H42 | sing | 1.08Å | 1.10Å | |
| C43 | N48 | sing | 1.40Å | 1.44Å | Aromatic |
| N48 | N49 | sing | 1.40Å | 1.37Å | Aromatic |
| N48 | C52 | sing | 1.35Å | 1.36Å | Aromatic |
| N49 | C50 | doub | 1.31Å | 1.37Å | Aromatic |
| C50 | N51 | sing | 1.33Å | 1.37Å | Aromatic |
| C50 | H50 | sing | 1.08Å | 1.10Å | |
| N51 | C52 | doub | 1.31Å | 1.37Å | Aromatic |
| C52 | H52 | sing | 1.08Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 110.6° | 109.2° |
| C2 | C1 | H11 | 111.8° | 109.4° |
| C2 | C1 | H12 | 111.8° | 109.5° |
| C1 | C2 | N3 | 109.8° | 109.7° |
| C1 | C2 | H21 | 112.1° | 109.5° |
| C1 | C2 | H22 | 112.1° | 109.5° |
| C6 | C1 | H11 | 111.8° | 109.5° |
| C6 | C1 | H12 | 111.8° | 109.6° |
| C1 | C6 | C5 | 110.4° | 108.9° |
| C1 | C6 | H61 | 111.9° | 109.6° |
| C1 | C6 | H62 | 111.9° | 109.5° |
| H11 | C1 | H12 | 98.6° | 109.6° |
| N3 | C2 | H21 | 112.1° | 109.4° |
| N3 | C2 | H22 | 112.1° | 109.4° |
| C2 | N3 | C4 | 113.3° | 107.3° |
| C2 | N3 | HN3 | 110.8° | 106.7° |
| H21 | C2 | H22 | 98.3° | 109.4° |
| C4 | N3 | HN3 | 110.8° | 106.7° |
| N3 | C4 | C5 | 109.5° | 109.7° |
| N3 | C4 | C15 | 111.7° | 109.4° |
| N3 | C4 | H4 | 110.0° | 109.5° |
| C5 | C4 | C15 | 114.8° | 109.4° |
| C5 | C4 | H4 | 106.6° | 109.5° |
| C4 | C5 | C6 | 109.2° | 109.1° |
| C4 | C5 | H51 | 112.3° | 109.5° |
| C4 | C5 | H52A | 112.3° | 109.5° |
| C15 | C4 | H4 | 104.0° | 109.4° |
| C4 | C15 | F17 | 113.4° | 109.5° |
| C4 | C15 | F18 | 110.9° | 109.5° |
| C4 | C15 | C19 | 108.8° | 109.5° |
| C6 | C5 | H51 | 112.3° | 109.5° |
| C6 | C5 | H52A | 112.3° | 109.5° |
| C5 | C6 | H61 | 111.9° | 109.6° |
| C5 | C6 | H62 | 111.9° | 109.5° |
| H51 | C5 | H52A | 98.1° | 109.6° |
| H61 | C6 | H62 | 98.5° | 109.7° |
| F17 | C15 | F18 | 108.2° | 109.4° |
| F17 | C15 | C19 | 106.2° | 109.5° |
| F18 | C15 | C19 | 109.3° | 109.5° |
| C15 | C19 | N20 | 113.5° | 109.5° |
| C15 | C19 | H191 | 110.7° | 109.5° |
| C15 | C19 | H192 | 110.8° | 109.5° |
| N20 | C19 | H191 | 110.7° | 109.5° |
| N20 | C19 | H192 | 110.7° | 109.5° |
| C19 | N20 | C23 | 123.4° | 120.0° |
| C19 | N20 | H20 | 107.3° | 120.0° |
| H191 | C19 | H192 | 99.6° | 109.4° |
| C23 | N20 | H20 | 107.2° | 120.0° |
| N20 | C23 | C24 | 120.7° | 120.0° |
| N20 | C23 | N28 | 118.1° | 120.0° |
| C24 | C23 | N28 | 121.3° | 120.1° |
| C23 | C24 | C25 | 119.7° | 118.8° |
| C23 | C24 | N31 | 134.1° | 134.6° |
| C23 | N28 | C27 | 123.0° | 122.2° |
| C25 | C24 | N31 | 106.1° | 106.5° |
| C24 | C25 | C26 | 118.1° | 118.6° |
| C24 | C25 | O33 | 112.0° | 106.3° |
| C24 | N31 | C32 | 105.7° | 108.8° |
| C26 | C25 | O33 | 129.9° | 135.1° |
| C25 | C26 | C27 | 121.6° | 119.0° |
| C25 | C26 | H26 | 119.3° | 120.5° |
| C25 | O33 | C32 | 103.1° | 108.1° |
| C27 | C26 | H26 | 119.0° | 120.5° |
| C26 | C27 | N28 | 116.2° | 121.3° |
| C26 | C27 | H27 | 124.1° | 119.3° |
| N28 | C27 | H27 | 119.7° | 119.4° |
| N31 | C32 | O33 | 113.0° | 110.3° |
| N31 | C32 | C34 | 126.1° | 124.9° |
| O33 | C32 | C34 | 120.9° | 124.8° |
| C32 | C34 | C36 | 121.1° | 109.5° |
| C32 | C34 | H341 | 108.1° | 109.5° |
| C32 | C34 | H342 | 108.1° | 109.5° |
| C36 | C34 | H341 | 108.1° | 109.5° |
| C36 | C34 | H342 | 108.0° | 109.4° |
| C34 | C36 | C39 | 113.4° | 120.1° |
| C34 | C36 | C43 | 122.7° | 120.0° |
| H341 | C34 | H342 | 101.8° | 109.5° |
| C39 | C36 | C43 | 123.9° | 119.9° |
| C36 | C39 | C40 | 119.1° | 120.1° |
| C36 | C39 | H39 | 120.6° | 120.0° |
| C36 | C43 | C42 | 116.5° | 119.9° |
| C36 | C43 | N48 | 124.3° | 120.1° |
| C40 | C39 | H39 | 120.2° | 120.0° |
| C39 | C40 | C41 | 117.7° | 120.2° |
| C39 | C40 | H40 | 120.9° | 119.9° |
| C41 | C40 | H40 | 121.5° | 120.0° |
| C40 | C41 | C42 | 122.6° | 120.1° |
| C40 | C41 | H41 | 118.6° | 120.0° |
| C42 | C41 | H41 | 118.8° | 120.0° |
| C41 | C42 | C43 | 120.2° | 119.9° |
| C41 | C42 | H42 | 120.2° | 120.0° |
| C43 | C42 | H42 | 119.6° | 120.1° |
| C42 | C43 | N48 | 119.0° | 120.0° |
| C43 | N48 | N49 | 125.1° | 126.8° |
| C43 | N48 | C52 | 127.2° | 126.9° |
| N49 | N48 | C52 | 107.6° | 106.3° |
| N48 | N49 | C50 | 108.7° | 106.8° |
| N48 | C52 | N51 | 108.2° | 108.1° |
| N48 | C52 | H52 | 125.6° | 126.0° |
| N49 | C50 | N51 | 107.4° | 109.0° |
| N49 | C50 | H50 | 126.5° | 125.5° |
| N51 | C50 | H50 | 126.1° | 125.5° |
| C50 | N51 | C52 | 108.1° | 109.8° |
| N51 | C52 | H52 | 126.2° | 126.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H11 | 125.3° | 119.8° |
| C2 | C1 | C6 | H12 | 125.2° | 120.0° |
| C2 | C1 | H11 | H12 | 117.7° | 120.1° |
| C1 | C2 | N3 | H21 | 125.2° | 120.1° |
| C1 | C2 | N3 | H22 | 125.3° | 120.1° |
| C1 | C2 | H21 | H22 | 118.0° | 119.9° |
| C1 | C2 | N3 | C4 | 57.9° | 65.7° |
| C1 | C2 | N3 | HN3 | 67.3° | 179.8° |
| C2 | C1 | C6 | C5 | 56.1° | 55.7° |
| C2 | C1 | C6 | H61 | 178.7° | 64.2° |
| C2 | C1 | C6 | H62 | 69.2° | 175.4° |
| C6 | C1 | H11 | H12 | 117.7° | 120.2° |
| C6 | C1 | C2 | N3 | 54.9° | 61.4° |
| C6 | C1 | C2 | H21 | 70.3° | 58.6° |
| C6 | C1 | C2 | H22 | 179.8° | 178.5° |
| C1 | C6 | C5 | C4 | 57.6° | 55.6° |
| C1 | C6 | C5 | H61 | 125.3° | 119.8° |
| C1 | C6 | C5 | H62 | 125.3° | 119.8° |
| C1 | C6 | C5 | H51 | 177.2° | 175.5° |
| C1 | C6 | C5 | H52A | 67.7° | 64.3° |
| C1 | C6 | H61 | H62 | 117.8° | 120.3° |
| H11 | C1 | C2 | N3 | 70.3° | 178.7° |
| H11 | C1 | C2 | H21 | 164.4° | 61.3° |
| H11 | C1 | C2 | H22 | 55.0° | 58.6° |
| H11 | C1 | C6 | C5 | 69.2° | 175.5° |
| H11 | C1 | C6 | H61 | 56.1° | 55.7° |
| H11 | C1 | C6 | H62 | 165.5° | 64.7° |
| H12 | C1 | C2 | N3 | 179.8° | 58.6° |
| H12 | C1 | C2 | H21 | 55.0° | 178.6° |
| H12 | C1 | C2 | H22 | 54.5° | 61.5° |
| H12 | C1 | C6 | C5 | 178.7° | 64.3° |
| H12 | C1 | C6 | H61 | 53.4° | 175.9° |
| H12 | C1 | C6 | H62 | 56.0° | 55.5° |
| N3 | C2 | H21 | H22 | 118.0° | 119.9° |
| C2 | N3 | C4 | HN3 | 125.3° | 114.1° |
| C2 | N3 | C4 | C5 | 60.0° | 65.8° |
| C2 | N3 | C4 | C15 | 171.7° | 174.2° |
| C2 | N3 | C4 | H4 | 56.7° | 54.4° |
| H21 | C2 | N3 | C4 | 67.3° | 54.4° |
| H21 | C2 | N3 | HN3 | 167.4° | 59.7° |
| H22 | C2 | N3 | C4 | 176.8° | 174.2° |
| H22 | C2 | N3 | HN3 | 58.0° | 60.1° |
| N3 | C4 | C5 | C15 | 126.5° | 120.0° |
| N3 | C4 | C5 | H4 | 118.9° | 120.2° |
| N3 | C4 | C15 | H4 | 118.6° | 119.9° |
| N3 | C4 | C5 | C6 | 58.3° | 61.5° |
| N3 | C4 | C5 | H51 | 176.4° | 178.7° |
| N3 | C4 | C5 | H52A | 67.0° | 58.4° |
| N3 | C4 | C15 | F17 | 34.3° | 179.9° |
| N3 | C4 | C15 | F18 | 156.2° | 60.1° |
| N3 | C4 | C15 | C19 | 83.6° | 59.9° |
| HN3 | N3 | C4 | C5 | 65.2° | 179.8° |
| HN3 | N3 | C4 | C15 | 63.0° | 60.2° |
| HN3 | N3 | C4 | H4 | 178.0° | 59.7° |
| C5 | C4 | C15 | H4 | 116.1° | 119.9° |
| C4 | C5 | C6 | H51 | 125.2° | 119.9° |
| C4 | C5 | C6 | H52A | 125.3° | 119.9° |
| C4 | C5 | H51 | H52A | 118.2° | 120.2° |
| C4 | C5 | C6 | H61 | 177.2° | 64.2° |
| C4 | C5 | C6 | H62 | 67.7° | 175.4° |
| C5 | C4 | C15 | F17 | 91.1° | 59.9° |
| C5 | C4 | C15 | F18 | 30.8° | 60.1° |
| C5 | C4 | C15 | C19 | 151.0° | 179.9° |
| C15 | C4 | C5 | C6 | 175.2° | 178.5° |
| C15 | C4 | C5 | H51 | 49.9° | 58.7° |
| C15 | C4 | C5 | H52A | 59.5° | 61.6° |
| C4 | C15 | F17 | F18 | 123.4° | 120.0° |
| C4 | C15 | F17 | C19 | 119.4° | 120.0° |
| C4 | C15 | F18 | C19 | 119.9° | 120.0° |
| C4 | C15 | C19 | N20 | 53.7° | 180.0° |
| C4 | C15 | C19 | H191 | 71.5° | 60.0° |
| C4 | C15 | C19 | H192 | 179.0° | 60.0° |
| H4 | C4 | C5 | C6 | 60.6° | 58.7° |
| H4 | C4 | C5 | H51 | 64.7° | 61.2° |
| H4 | C4 | C5 | H52A | 174.1° | 178.6° |
| H4 | C4 | C15 | F17 | 152.8° | 60.0° |
| H4 | C4 | C15 | F18 | 85.3° | 180.0° |
| H4 | C4 | C15 | C19 | 35.0° | 60.0° |
| C6 | C5 | H51 | H52A | 118.3° | 120.2° |
| C5 | C6 | H61 | H62 | 117.8° | 120.3° |
| H51 | C5 | C6 | H61 | 52.0° | 55.7° |
| H51 | C5 | C6 | H62 | 57.5° | 64.7° |
| H52A | C5 | C6 | H61 | 57.6° | 175.9° |
| H52A | C5 | C6 | H62 | 167.0° | 55.5° |
| F17 | C15 | F18 | C19 | 115.2° | 120.0° |
| F17 | C15 | C19 | N20 | 176.1° | 60.0° |
| F17 | C15 | C19 | H191 | 50.8° | 60.1° |
| F17 | C15 | C19 | H192 | 58.6° | 180.0° |
| F18 | C15 | C19 | N20 | 67.4° | 60.0° |
| F18 | C15 | C19 | H191 | 167.3° | 180.0° |
| F18 | C15 | C19 | H192 | 57.8° | 60.1° |
| C15 | C19 | N20 | H191 | 125.3° | 120.0° |
| C15 | C19 | N20 | H192 | 125.3° | 120.1° |
| C15 | C19 | H191 | H192 | 116.6° | 120.0° |
| C15 | C19 | N20 | C23 | 114.5° | 180.0° |
| C15 | C19 | N20 | H20 | 10.7° | 0.0° |
| N20 | C19 | H191 | H192 | 116.5° | 120.0° |
| C19 | N20 | C23 | H20 | 125.3° | 180.0° |
| C19 | N20 | C23 | C24 | 157.8° | 179.7° |
| C19 | N20 | C23 | N28 | 22.3° | 0.0° |
| H191 | C19 | N20 | C23 | 10.8° | 60.0° |
| H191 | C19 | N20 | H20 | 136.0° | 120.0° |
| H192 | C19 | N20 | C23 | 120.2° | 60.0° |
| H192 | C19 | N20 | H20 | 114.6° | 120.0° |
| N20 | C23 | C24 | N28 | 179.9° | 179.7° |
| N20 | C23 | C24 | C25 | 180.0° | 179.8° |
| N20 | C23 | C24 | N31 | 0.2° | 0.7° |
| N20 | C23 | N28 | C27 | 179.5° | 180.0° |
| H20 | N20 | C23 | C24 | 77.0° | 0.3° |
| H20 | N20 | C23 | N28 | 103.0° | 180.0° |
| C23 | C24 | C25 | N31 | 179.8° | 179.3° |
| C23 | C24 | C25 | C26 | 0.4° | 0.5° |
| C23 | C24 | C25 | O33 | 178.7° | 179.7° |
| C24 | C23 | N28 | C27 | 0.6° | 0.3° |
| C23 | C24 | N31 | C32 | 180.0° | 179.5° |
| N28 | C23 | C24 | C25 | 0.1° | 0.5° |
| N28 | C23 | C24 | N31 | 179.9° | 179.6° |
| C23 | N28 | C27 | C26 | 0.5° | 0.0° |
| C23 | N28 | C27 | H27 | 179.5° | 180.0° |
| C24 | C25 | C26 | O33 | 178.9° | 179.8° |
| C24 | C25 | C26 | C27 | 0.4° | 0.2° |
| C24 | C25 | C26 | H26 | 179.6° | 179.8° |
| C25 | C24 | N31 | C32 | 0.2° | 0.4° |
| C24 | C25 | O33 | C32 | 2.0° | 0.2° |
| N31 | C24 | C25 | C26 | 179.5° | 179.8° |
| N31 | C24 | C25 | O33 | 1.5° | 0.4° |
| C24 | N31 | C32 | O33 | 1.0° | 0.3° |
| C24 | N31 | C32 | C34 | 177.4° | 179.8° |
| C25 | C26 | C27 | H26 | 180.0° | 180.0° |
| C25 | C26 | C27 | N28 | 0.0° | 0.0° |
| C25 | C26 | C27 | H27 | 180.0° | 180.0° |
| C26 | C25 | O33 | C32 | 179.1° | 180.0° |
| O33 | C25 | C26 | C27 | 178.5° | 180.0° |
| O33 | C25 | C26 | H26 | 1.5° | 0.0° |
| C25 | O33 | C32 | N31 | 1.9° | 0.0° |
| C25 | O33 | C32 | C34 | 176.7° | 180.0° |
| C26 | C27 | N28 | H27 | 180.0° | 179.9° |
| H26 | C26 | C27 | N28 | 180.0° | 180.0° |
| H26 | C26 | C27 | H27 | 0.1° | 0.0° |
| N31 | C32 | O33 | C34 | 178.5° | 180.0° |
| N31 | C32 | C34 | C36 | 12.5° | 89.9° |
| N31 | C32 | C34 | H341 | 137.8° | 150.1° |
| N31 | C32 | C34 | H342 | 112.8° | 30.0° |
| O33 | C32 | C34 | C36 | 169.2° | 90.0° |
| O33 | C32 | C34 | H341 | 43.9° | 30.0° |
| O33 | C32 | C34 | H342 | 65.6° | 150.0° |
| C32 | C34 | C36 | H341 | 125.3° | 120.0° |
| C32 | C34 | C36 | H342 | 125.3° | 120.0° |
| C32 | C34 | H341 | H342 | 113.7° | 120.1° |
| C32 | C34 | C36 | C39 | 104.7° | 95.0° |
| C32 | C34 | C36 | C43 | 76.0° | 84.8° |
| C36 | C34 | H341 | H342 | 113.6° | 120.0° |
| C34 | C36 | C39 | C43 | 179.3° | 179.7° |
| C34 | C36 | C39 | C40 | 179.0° | 180.0° |
| C34 | C36 | C39 | H39 | 1.0° | 0.1° |
| C34 | C36 | C43 | C42 | 177.4° | 179.8° |
| C34 | C36 | C43 | N48 | 7.8° | 0.2° |
| H341 | C34 | C36 | C39 | 20.6° | 145.0° |
| H341 | C34 | C36 | C43 | 158.7° | 35.2° |
| H342 | C34 | C36 | C39 | 130.0° | 25.0° |
| H342 | C34 | C36 | C43 | 49.2° | 155.2° |
| C36 | C39 | C40 | H39 | 180.0° | 179.9° |
| C36 | C39 | C40 | C41 | 1.3° | 0.0° |
| C36 | C39 | C40 | H40 | 178.7° | 180.0° |
| C39 | C36 | C43 | C42 | 1.8° | 0.5° |
| C39 | C36 | C43 | N48 | 173.0° | 180.0° |
| C43 | C36 | C39 | C40 | 0.3° | 0.3° |
| C43 | C36 | C39 | H39 | 179.7° | 179.8° |
| C36 | C43 | C42 | C41 | 1.7° | 0.5° |
| C36 | C43 | C42 | N48 | 175.1° | 179.6° |
| C36 | C43 | C42 | H42 | 178.3° | 179.7° |
| C36 | C43 | N48 | N49 | 116.0° | 39.2° |
| C36 | C43 | N48 | C52 | 66.1° | 140.5° |
| C39 | C40 | C41 | H40 | 180.0° | 180.0° |
| C39 | C40 | C41 | C42 | 1.5° | 0.0° |
| C39 | C40 | C41 | H41 | 178.5° | 180.0° |
| H39 | C39 | C40 | C41 | 178.6° | 179.9° |
| H39 | C39 | C40 | H40 | 1.3° | 0.1° |
| C40 | C41 | C42 | H41 | 180.0° | 180.0° |
| C40 | C41 | C42 | C43 | 0.1° | 0.2° |
| C40 | C41 | C42 | H42 | 179.9° | 180.0° |
| H40 | C40 | C41 | C42 | 178.6° | 180.0° |
| H40 | C40 | C41 | H41 | 1.5° | 0.1° |
| C41 | C42 | C43 | H42 | 179.9° | 179.8° |
| C41 | C42 | C43 | N48 | 173.4° | 180.0° |
| H41 | C41 | C42 | C43 | 180.0° | 179.8° |
| H41 | C41 | C42 | H42 | 0.1° | 0.0° |
| C42 | C43 | N48 | N49 | 58.6° | 140.4° |
| C42 | C43 | N48 | C52 | 119.2° | 40.0° |
| H42 | C42 | C43 | N48 | 6.6° | 0.2° |
| C43 | N48 | N49 | C52 | 178.2° | 179.7° |
| C43 | N48 | N49 | C50 | 178.5° | 179.9° |
| C43 | N48 | C52 | N51 | 178.4° | 180.0° |
| C43 | N48 | C52 | H52 | 1.6° | 0.0° |
| N48 | N49 | C50 | N51 | 0.3° | 0.4° |
| N48 | N49 | C50 | H50 | 179.8° | 179.8° |
| N49 | N48 | C52 | N51 | 0.2° | 0.2° |
| N49 | N48 | C52 | H52 | 179.8° | 179.8° |
| C52 | N48 | N49 | C50 | 0.3° | 0.4° |
| N48 | C52 | N51 | C50 | 0.1° | 0.0° |
| N48 | C52 | N51 | H52 | 180.0° | 180.0° |
| N49 | C50 | N51 | H50 | 180.0° | 179.7° |
| N49 | C50 | N51 | C52 | 0.1° | 0.3° |
| C50 | N51 | C52 | H52 | 179.9° | 180.0° |
| H50 | C50 | N51 | C52 | 179.9° | 180.0° |
