NGI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C3 | N1 | sing | 1.35Å | 1.34Å | |
| N1 | C2 | sing | 1.46Å | 1.45Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| O1 | C3 | doub | 1.21Å | 1.22Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C23 | N2 | sing | 1.37Å | 1.34Å | Aromatic |
| N2 | C8 | sing | 1.36Å | 1.34Å | Aromatic |
| N2 | C5 | sing | 1.46Å | 1.49Å | |
| C5 | O2 | sing | 1.44Å | 1.43Å | |
| O2 | C4 | sing | 1.44Å | 1.43Å | |
| C4 | C3 | sing | 1.51Å | 1.49Å | |
| C9 | N3 | sing | 1.36Å | 1.35Å | Aromatic |
| N3 | C8 | doub | 1.30Å | 1.35Å | Aromatic |
| C6 | O3 | sing | 1.43Å | 1.43Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C4 | C7 | sing | 1.54Å | 1.52Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| N4 | C10 | sing | 1.38Å | 1.36Å | |
| N4 | HN4 | sing | 0.97Å | 1.00Å | |
| N4 | HN4A | sing | 0.97Å | 1.00Å | |
| C7 | O4 | sing | 1.43Å | 1.43Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C5 | C6 | sing | 1.54Å | 1.53Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| N5 | C10 | doub | 1.33Å | 1.35Å | Aromatic |
| N5 | C11 | sing | 1.33Å | 1.36Å | Aromatic |
| O5 | C20 | sing | 1.34Å | 1.22Å | |
| O5 | HO5 | sing | 0.97Å | 0.95Å | |
| C6 | C7 | sing | 1.55Å | 1.51Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | N6 | sing | 1.47Å | 1.45Å | |
| N6 | C11 | sing | 1.39Å | 1.36Å | |
| N6 | HN6 | sing | 0.97Å | 1.00Å | |
| O6 | C20 | doub | 1.21Å | 1.33Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | N7 | doub | 1.32Å | 1.36Å | Aromatic |
| N7 | C23 | sing | 1.33Å | 1.35Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C10 | C9 | sing | 1.41Å | 1.39Å | Aromatic |
| C9 | C23 | doub | 1.40Å | 1.39Å | Aromatic |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C14 | C13 | sing | 1.51Å | 1.51Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C22 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C17 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C18 | C17 | sing | 1.51Å | 1.51Å | |
| C17 | C21 | doub | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C20 | C19 | sing | 1.51Å | 1.51Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C21 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.4° | 109.5° |
| C2 | C1 | H1B | 109.5° | 109.5° |
| C1 | C2 | N1 | 112.4° | 109.5° |
| C1 | C2 | H2 | 108.7° | 109.4° |
| C1 | C2 | H2A | 108.7° | 109.4° |
| H1 | C1 | H1A | 109.5° | 109.5° |
| H1 | C1 | H1B | 109.5° | 109.4° |
| H1A | C1 | H1B | 109.5° | 109.4° |
| C3 | N1 | C2 | 122.7° | 120.0° |
| C3 | N1 | HN1 | 118.7° | 120.0° |
| N1 | C3 | O1 | 124.6° | 120.0° |
| N1 | C3 | C4 | 115.8° | 120.0° |
| C2 | N1 | HN1 | 118.6° | 120.0° |
| N1 | C2 | H2 | 108.7° | 109.5° |
| N1 | C2 | H2A | 108.7° | 109.5° |
| O1 | C3 | C4 | 119.5° | 120.0° |
| H2 | C2 | H2A | 109.5° | 109.5° |
| C23 | N2 | C8 | 107.5° | 107.5° |
| C23 | N2 | C5 | 126.9° | 126.3° |
| N2 | C23 | N7 | 133.0° | 134.8° |
| N2 | C23 | C9 | 107.9° | 106.0° |
| C8 | N2 | C5 | 125.5° | 126.3° |
| N2 | C8 | N3 | 109.9° | 110.0° |
| N2 | C8 | H8 | 125.1° | 125.1° |
| N2 | C5 | O2 | 109.4° | 110.4° |
| N2 | C5 | C6 | 112.6° | 110.4° |
| N2 | C5 | H5 | 109.3° | 110.4° |
| C5 | O2 | C4 | 111.3° | 105.3° |
| O2 | C5 | C6 | 106.5° | 104.8° |
| O2 | C5 | H5 | 110.2° | 110.3° |
| O2 | C4 | C3 | 109.8° | 110.4° |
| O2 | C4 | C7 | 106.8° | 104.8° |
| O2 | C4 | H4 | 111.1° | 110.4° |
| C3 | C4 | C7 | 109.0° | 110.3° |
| C3 | C4 | H4 | 110.2° | 110.3° |
| C9 | N3 | C8 | 107.1° | 109.4° |
| N3 | C9 | C10 | 133.1° | 134.6° |
| N3 | C9 | C23 | 107.5° | 107.2° |
| N3 | C8 | H8 | 125.0° | 125.0° |
| C6 | O3 | HO3 | 109.5° | 114.0° |
| O3 | C6 | C5 | 109.2° | 110.5° |
| O3 | C6 | C7 | 110.1° | 110.5° |
| O3 | C6 | H6 | 111.8° | 110.5° |
| C7 | C4 | H4 | 109.9° | 110.4° |
| C4 | C7 | O4 | 111.3° | 110.5° |
| C4 | C7 | C6 | 104.5° | 104.1° |
| C4 | C7 | H7 | 108.7° | 110.5° |
| C10 | N4 | HN4 | 109.5° | 120.0° |
| C10 | N4 | HN4A | 109.5° | 120.1° |
| N4 | C10 | N5 | 120.2° | 120.8° |
| N4 | C10 | C9 | 120.2° | 120.7° |
| HN4 | N4 | HN4A | 109.4° | 120.0° |
| C7 | O4 | HO4 | 109.5° | 114.0° |
| O4 | C7 | C6 | 113.4° | 110.5° |
| O4 | C7 | H7 | 109.9° | 110.6° |
| C6 | C5 | H5 | 108.9° | 110.4° |
| C5 | C6 | C7 | 104.6° | 104.0° |
| C5 | C6 | H6 | 110.4° | 110.5° |
| C10 | N5 | C11 | 120.7° | 121.1° |
| N5 | C10 | C9 | 119.6° | 118.6° |
| N5 | C11 | N6 | 121.7° | 118.9° |
| N5 | C11 | N7 | 119.8° | 122.3° |
| C20 | O5 | HO5 | 109.5° | 117.0° |
| O5 | C20 | O6 | 118.8° | 120.0° |
| O5 | C20 | C19 | 119.8° | 120.0° |
| C7 | C6 | H6 | 110.5° | 110.6° |
| C6 | C7 | H7 | 108.7° | 110.5° |
| C12 | N6 | C11 | 122.5° | 120.0° |
| C12 | N6 | HN6 | 106.1° | 120.0° |
| N6 | C12 | C13 | 112.5° | 109.5° |
| N6 | C12 | H12 | 108.7° | 109.5° |
| N6 | C12 | H12A | 108.7° | 109.4° |
| C11 | N6 | HN6 | 106.1° | 120.0° |
| N6 | C11 | N7 | 118.5° | 118.9° |
| O6 | C20 | C19 | 121.5° | 120.0° |
| C11 | N7 | C23 | 121.5° | 120.6° |
| N7 | C23 | C9 | 119.0° | 119.2° |
| C10 | C9 | C23 | 119.4° | 118.2° |
| C13 | C12 | H12 | 108.7° | 109.5° |
| C13 | C12 | H12A | 108.7° | 109.5° |
| C12 | C13 | C14 | 112.2° | 109.5° |
| C12 | C13 | H13 | 108.8° | 109.5° |
| C12 | C13 | H13A | 108.8° | 109.4° |
| H12 | C12 | H12A | 109.5° | 109.5° |
| C14 | C13 | H13 | 108.8° | 109.5° |
| C14 | C13 | H13A | 108.8° | 109.5° |
| C13 | C14 | C22 | 119.5° | 120.0° |
| C13 | C14 | C15 | 120.7° | 120.0° |
| H13 | C13 | H13A | 109.5° | 109.5° |
| C22 | C14 | C15 | 119.8° | 120.0° |
| C14 | C22 | C21 | 120.1° | 120.0° |
| C14 | C22 | H22 | 119.9° | 120.0° |
| C14 | C15 | C16 | 120.3° | 120.0° |
| C14 | C15 | H15 | 119.9° | 120.0° |
| C16 | C15 | H15 | 119.8° | 120.0° |
| C15 | C16 | C17 | 119.8° | 120.0° |
| C15 | C16 | H16 | 120.1° | 120.0° |
| C17 | C16 | H16 | 120.1° | 120.0° |
| C16 | C17 | C18 | 120.4° | 120.0° |
| C16 | C17 | C21 | 119.9° | 120.0° |
| C18 | C17 | C21 | 119.8° | 120.0° |
| C17 | C18 | C19 | 108.4° | 109.5° |
| C17 | C18 | H18 | 109.8° | 109.4° |
| C17 | C18 | H18A | 109.7° | 109.5° |
| C17 | C21 | C22 | 120.2° | 120.0° |
| C17 | C21 | H21 | 119.9° | 120.0° |
| C19 | C18 | H18 | 109.7° | 109.5° |
| C19 | C18 | H18A | 109.7° | 109.5° |
| C18 | C19 | C20 | 112.3° | 109.5° |
| C18 | C19 | H19 | 108.8° | 109.5° |
| C18 | C19 | H19A | 108.8° | 109.5° |
| H18 | C18 | H18A | 109.4° | 109.4° |
| C20 | C19 | H19 | 108.8° | 109.5° |
| C20 | C19 | H19A | 108.8° | 109.4° |
| H19 | C19 | H19A | 109.4° | 109.5° |
| C22 | C21 | H21 | 119.9° | 119.9° |
| C21 | C22 | H22 | 120.0° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | H1 | H1A | 120.0° | 120.1° |
| C2 | C1 | H1 | H1B | 120.0° | 120.0° |
| C2 | C1 | H1A | H1B | 120.0° | 120.0° |
| C1 | C2 | N1 | C3 | 150.2° | 180.0° |
| C1 | C2 | N1 | H2 | 120.4° | 120.0° |
| C1 | C2 | N1 | H2A | 120.4° | 120.0° |
| C1 | C2 | N1 | HN1 | 29.8° | 0.0° |
| C1 | C2 | H2 | H2A | 118.7° | 120.0° |
| H1 | C1 | H1A | H1B | 120.0° | 119.9° |
| H1 | C1 | C2 | N1 | 180.0° | 180.0° |
| H1 | C1 | C2 | H2 | 59.6° | 60.1° |
| H1 | C1 | C2 | H2A | 59.6° | 59.9° |
| H1A | C1 | C2 | N1 | 60.0° | 60.0° |
| H1A | C1 | C2 | H2 | 60.4° | 60.0° |
| H1A | C1 | C2 | H2A | 179.6° | 180.0° |
| H1B | C1 | C2 | N1 | 60.0° | 60.0° |
| H1B | C1 | C2 | H2 | 179.6° | 180.0° |
| H1B | C1 | C2 | H2A | 60.4° | 60.0° |
| C3 | N1 | C2 | HN1 | 180.0° | 180.0° |
| N1 | C3 | O1 | C4 | 179.8° | 180.0° |
| C3 | N1 | C2 | H2 | 29.7° | 60.0° |
| C3 | N1 | C2 | H2A | 89.4° | 60.0° |
| N1 | C3 | C4 | O2 | 120.6° | 176.4° |
| N1 | C3 | C4 | C7 | 122.8° | 68.2° |
| N1 | C3 | C4 | H4 | 2.1° | 54.2° |
| C2 | N1 | C3 | O1 | 9.8° | 0.0° |
| N1 | C2 | H2 | H2A | 118.7° | 120.1° |
| C2 | N1 | C3 | C4 | 170.4° | 180.0° |
| HN1 | N1 | C3 | O1 | 170.2° | 180.0° |
| HN1 | N1 | C2 | H2 | 150.3° | 120.0° |
| HN1 | N1 | C2 | H2A | 90.6° | 120.0° |
| HN1 | N1 | C3 | C4 | 9.6° | 0.0° |
| O1 | C3 | C4 | O2 | 59.6° | 3.5° |
| O1 | C3 | C4 | C7 | 57.1° | 111.9° |
| O1 | C3 | C4 | H4 | 177.8° | 125.8° |
| C23 | N2 | C8 | C5 | 178.9° | 179.8° |
| C23 | N2 | C5 | O2 | 153.6° | 156.7° |
| N2 | C23 | C9 | N3 | 0.3° | 0.2° |
| C23 | N2 | C8 | N3 | 0.2° | 0.2° |
| C23 | N2 | C5 | C6 | 88.3° | 87.9° |
| C23 | N2 | C5 | H5 | 32.8° | 34.5° |
| N2 | C23 | N7 | C11 | 179.8° | 180.0° |
| N2 | C23 | N7 | C9 | 179.8° | 180.0° |
| C23 | N2 | C8 | H8 | 179.9° | 179.7° |
| N2 | C23 | C9 | C10 | 179.8° | 180.0° |
| C8 | N2 | C5 | O2 | 25.1° | 23.6° |
| N2 | C8 | N3 | C9 | 0.0° | 0.4° |
| N2 | C8 | N3 | H8 | 180.0° | 179.9° |
| C8 | N2 | C5 | C6 | 93.0° | 91.9° |
| C8 | N2 | C5 | H5 | 145.8° | 145.8° |
| C8 | N2 | C23 | N7 | 180.0° | 180.0° |
| C8 | N2 | C23 | C9 | 0.3° | 0.0° |
| N2 | C5 | O2 | C6 | 121.9° | 118.9° |
| N2 | C5 | O2 | H5 | 120.2° | 122.2° |
| N2 | C5 | O2 | C4 | 114.8° | 159.4° |
| C5 | N2 | C8 | N3 | 179.0° | 180.0° |
| N2 | C5 | C6 | O3 | 142.6° | 98.5° |
| N2 | C5 | C6 | H5 | 121.4° | 122.3° |
| N2 | C5 | C6 | C7 | 99.6° | 142.8° |
| N2 | C5 | C6 | H6 | 19.3° | 24.1° |
| C5 | N2 | C23 | N7 | 1.1° | 0.2° |
| C5 | N2 | C8 | H8 | 1.0° | 0.0° |
| C5 | N2 | C23 | C9 | 179.1° | 179.8° |
| C5 | O2 | C4 | C3 | 127.2° | 159.3° |
| O2 | C5 | C6 | O3 | 97.5° | 142.6° |
| C5 | O2 | C4 | C7 | 9.2° | 40.5° |
| C5 | O2 | C4 | H4 | 110.7° | 78.4° |
| O2 | C5 | C6 | H5 | 118.7° | 118.8° |
| O2 | C5 | C6 | C7 | 20.3° | 23.9° |
| O2 | C5 | C6 | H6 | 139.2° | 94.8° |
| O2 | C4 | C3 | C7 | 116.6° | 115.4° |
| O2 | C4 | C3 | H4 | 122.7° | 122.3° |
| O2 | C4 | C7 | H4 | 120.6° | 118.9° |
| O2 | C4 | C7 | O4 | 144.3° | 142.6° |
| C4 | O2 | C5 | C6 | 7.1° | 40.5° |
| C4 | O2 | C5 | H5 | 125.0° | 78.4° |
| O2 | C4 | C7 | C6 | 21.6° | 24.0° |
| O2 | C4 | C7 | H7 | 94.4° | 94.7° |
| C3 | C4 | C7 | H4 | 120.9° | 122.3° |
| C3 | C4 | C7 | O4 | 97.1° | 98.5° |
| C3 | C4 | C7 | C6 | 140.1° | 142.9° |
| C3 | C4 | C7 | H7 | 24.1° | 24.2° |
| N3 | C9 | C10 | N4 | 0.2° | 0.1° |
| N3 | C9 | C10 | N5 | 179.8° | 179.9° |
| N3 | C9 | C23 | N7 | 179.9° | 179.8° |
| C9 | N3 | C8 | H8 | 180.0° | 179.6° |
| N3 | C9 | C10 | C23 | 179.9° | 179.7° |
| C8 | N3 | C9 | C10 | 179.9° | 180.0° |
| C8 | N3 | C9 | C23 | 0.2° | 0.4° |
| O3 | C6 | C7 | C4 | 92.0° | 118.6° |
| O3 | C6 | C7 | O4 | 29.5° | 0.0° |
| O3 | C6 | C5 | C7 | 117.8° | 118.6° |
| O3 | C6 | C5 | H6 | 123.3° | 122.6° |
| O3 | C6 | C5 | H5 | 21.3° | 23.8° |
| O3 | C6 | C7 | H6 | 124.0° | 122.7° |
| O3 | C6 | C7 | H7 | 152.1° | 122.7° |
| HO3 | O3 | C6 | C5 | 180.0° | 180.0° |
| HO3 | O3 | C6 | C7 | 65.8° | 65.4° |
| HO3 | O3 | C6 | H6 | 57.5° | 57.4° |
| C4 | C7 | O4 | C6 | 117.5° | 114.6° |
| C4 | C7 | O4 | H7 | 120.6° | 122.7° |
| C4 | C7 | O4 | HO4 | 180.0° | 61.5° |
| C4 | C7 | C6 | C5 | 25.2° | 0.0° |
| C4 | C7 | C6 | H7 | 116.0° | 118.6° |
| C4 | C7 | C6 | H6 | 144.1° | 118.7° |
| H4 | C4 | C7 | O4 | 23.7° | 23.7° |
| H4 | C4 | C7 | C6 | 99.0° | 94.9° |
| H4 | C4 | C7 | H7 | 145.0° | 146.5° |
| C10 | N4 | HN4 | HN4A | 120.0° | 180.0° |
| N4 | C10 | N5 | C9 | 180.0° | 180.0° |
| N4 | C10 | N5 | C11 | 179.9° | 179.3° |
| N4 | C10 | C9 | C23 | 179.9° | 179.6° |
| HN4 | N4 | C10 | N5 | 0.0° | 0.0° |
| HN4 | N4 | C10 | C9 | 180.0° | 180.0° |
| HN4A | N4 | C10 | N5 | 120.0° | 180.0° |
| HN4A | N4 | C10 | C9 | 60.0° | 0.0° |
| O4 | C7 | C6 | C5 | 146.7° | 118.7° |
| O4 | C7 | C6 | H7 | 122.6° | 122.7° |
| O4 | C7 | C6 | H6 | 94.5° | 122.6° |
| HO4 | O4 | C7 | C6 | 62.5° | 176.1° |
| HO4 | O4 | C7 | H7 | 59.5° | 61.2° |
| C5 | C6 | C7 | H6 | 118.8° | 118.7° |
| C5 | C6 | C7 | H7 | 90.7° | 118.6° |
| H5 | C5 | C6 | C7 | 139.0° | 94.9° |
| H5 | C5 | C6 | H6 | 102.0° | 146.4° |
| C10 | N5 | C11 | N6 | 179.9° | 180.0° |
| C10 | N5 | C11 | N7 | 0.1° | 0.7° |
| N5 | C10 | C9 | C23 | 0.1° | 0.4° |
| N5 | C11 | N6 | C12 | 11.2° | 0.0° |
| N5 | C11 | N6 | N7 | 180.0° | 179.3° |
| N5 | C11 | N6 | HN6 | 132.9° | 179.9° |
| N5 | C11 | N7 | C23 | 0.0° | 0.3° |
| C11 | N5 | C10 | C9 | 0.2° | 0.7° |
| O5 | C20 | O6 | C19 | 179.5° | 179.9° |
| O5 | C20 | C19 | C18 | 137.9° | 180.0° |
| O5 | C20 | C19 | H19 | 101.7° | 60.0° |
| O5 | C20 | C19 | H19A | 17.5° | 60.0° |
| HO5 | O5 | C20 | O6 | 0.0° | 0.1° |
| HO5 | O5 | C20 | C19 | 179.5° | 180.0° |
| H6 | C6 | C7 | H7 | 28.1° | 0.1° |
| C12 | N6 | C11 | HN6 | 121.8° | 179.9° |
| C12 | N6 | C11 | N7 | 168.9° | 179.4° |
| N6 | C12 | C13 | H12 | 120.5° | 120.1° |
| N6 | C12 | C13 | H12A | 120.4° | 119.9° |
| N6 | C12 | H12 | H12A | 118.6° | 119.9° |
| N6 | C12 | C13 | C14 | 161.4° | 180.0° |
| N6 | C12 | C13 | H13 | 41.0° | 60.0° |
| N6 | C12 | C13 | H13A | 78.2° | 60.1° |
| N6 | C11 | N7 | C23 | 180.0° | 179.6° |
| C11 | N6 | C12 | C13 | 89.8° | 180.0° |
| C11 | N6 | C12 | H12 | 149.8° | 59.9° |
| C11 | N6 | C12 | H12A | 30.6° | 60.0° |
| HN6 | N6 | C11 | N7 | 47.1° | 0.7° |
| HN6 | N6 | C12 | C13 | 148.4° | 0.1° |
| HN6 | N6 | C12 | H12 | 28.0° | 120.0° |
| HN6 | N6 | C12 | H12A | 91.1° | 120.1° |
| O6 | C20 | C19 | C18 | 42.6° | 0.0° |
| O6 | C20 | C19 | H19 | 77.8° | 120.0° |
| O6 | C20 | C19 | H19A | 163.0° | 120.0° |
| C11 | N7 | C23 | C9 | 0.0° | 0.0° |
| N7 | C23 | C9 | C10 | 0.0° | 0.0° |
| C13 | C12 | H12 | H12A | 118.6° | 120.0° |
| C12 | C13 | C14 | H13 | 120.4° | 120.0° |
| C12 | C13 | C14 | H13A | 120.4° | 119.9° |
| C12 | C13 | H13 | H13A | 118.7° | 119.9° |
| C12 | C13 | C14 | C22 | 102.8° | 90.2° |
| C12 | C13 | C14 | C15 | 77.9° | 90.0° |
| H12 | C12 | C13 | C14 | 78.2° | 60.0° |
| H12 | C12 | C13 | H13 | 161.4° | 180.0° |
| H12 | C12 | C13 | H13A | 42.3° | 60.0° |
| H12A | C12 | C13 | C14 | 41.0° | 60.0° |
| H12A | C12 | C13 | H13 | 79.4° | 60.0° |
| H12A | C12 | C13 | H13A | 161.4° | 180.0° |
| C14 | C13 | H13 | H13A | 118.7° | 120.0° |
| C13 | C14 | C22 | C15 | 179.3° | 179.8° |
| C13 | C14 | C15 | C16 | 179.5° | 180.0° |
| C13 | C14 | C15 | H15 | 0.5° | 0.0° |
| C13 | C14 | C22 | C21 | 179.5° | 179.7° |
| C13 | C14 | C22 | H22 | 0.5° | 0.2° |
| H13 | C13 | C14 | C22 | 136.8° | 149.8° |
| H13 | C13 | C14 | C15 | 42.5° | 30.0° |
| H13A | C13 | C14 | C22 | 17.6° | 29.7° |
| H13A | C13 | C14 | C15 | 161.7° | 150.1° |
| C22 | C14 | C15 | C16 | 0.2° | 0.2° |
| C22 | C14 | C15 | H15 | 179.8° | 179.7° |
| C14 | C22 | C21 | C17 | 0.2° | 0.6° |
| C14 | C22 | C21 | H22 | 180.0° | 179.4° |
| C14 | C22 | C21 | H21 | 179.8° | 179.7° |
| C14 | C15 | C16 | H15 | 180.0° | 180.0° |
| C14 | C15 | C16 | C17 | 0.1° | 0.1° |
| C14 | C15 | C16 | H16 | 179.9° | 180.0° |
| C15 | C14 | C22 | C21 | 0.3° | 0.6° |
| C15 | C14 | C22 | H22 | 179.8° | 180.0° |
| C15 | C16 | C17 | H16 | 180.0° | 179.9° |
| C15 | C16 | C17 | C18 | 180.0° | 180.0° |
| C15 | C16 | C17 | C21 | 0.1° | 0.0° |
| H15 | C15 | C16 | C17 | 179.9° | 180.0° |
| H15 | C15 | C16 | H16 | 0.1° | 0.0° |
| C16 | C17 | C18 | C21 | 180.0° | 179.9° |
| C16 | C17 | C18 | C19 | 84.8° | 90.0° |
| C16 | C17 | C18 | H18 | 155.4° | 150.0° |
| C16 | C17 | C18 | H18A | 35.0° | 30.1° |
| C16 | C17 | C21 | C22 | 0.1° | 0.3° |
| C16 | C17 | C21 | H21 | 179.9° | 180.0° |
| H16 | C16 | C17 | C18 | 0.0° | 0.1° |
| H16 | C16 | C17 | C21 | 179.9° | 180.0° |
| C17 | C18 | C19 | H18 | 119.9° | 119.9° |
| C17 | C18 | C19 | H18A | 119.9° | 120.1° |
| C17 | C18 | H18 | H18A | 120.5° | 120.0° |
| C17 | C18 | C19 | C20 | 172.7° | 180.0° |
| C17 | C18 | C19 | H19 | 52.3° | 60.1° |
| C17 | C18 | C19 | H19A | 66.8° | 60.0° |
| C18 | C17 | C21 | C22 | 179.9° | 179.7° |
| C18 | C17 | C21 | H21 | 0.1° | 0.0° |
| C21 | C17 | C18 | C19 | 95.2° | 89.9° |
| C21 | C17 | C18 | H18 | 24.6° | 30.0° |
| C21 | C17 | C18 | H18A | 144.9° | 150.0° |
| C17 | C21 | C22 | H21 | 180.0° | 179.7° |
| C17 | C21 | C22 | H22 | 179.8° | 180.0° |
| C19 | C18 | H18 | H18A | 120.5° | 120.0° |
| C18 | C19 | C20 | H19 | 120.4° | 120.0° |
| C18 | C19 | C20 | H19A | 120.4° | 120.0° |
| C18 | C19 | H19 | H19A | 118.7° | 120.0° |
| H18 | C18 | C19 | C20 | 67.4° | 60.0° |
| H18 | C18 | C19 | H19 | 172.1° | 180.0° |
| H18 | C18 | C19 | H19A | 53.0° | 60.0° |
| H18A | C18 | C19 | C20 | 52.9° | 60.0° |
| H18A | C18 | C19 | H19 | 67.6° | 60.0° |
| H18A | C18 | C19 | H19A | 173.3° | 180.0° |
| C20 | C19 | H19 | H19A | 118.7° | 120.0° |
| H21 | C21 | C22 | H22 | 0.2° | 0.3° |
